*HEADER    RNA BINDING PROTEIN                     12-MAY-08   2K3K              
*TITLE     SOLUTION STRUCTURE OF DROSOPHILA MELANOGASTER SNF RBD1                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: U1 SMALL NUCLEAR RIBONUCLEOPROTEIN A;                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RRM1 DOMAIN (UNP RESIDUES 1-98);                           
*COMPND   5 SYNONYM: U1 SNRNP PROTEIN A, U1-A, SEX DETERMINATION                 
*COMPND   6 PROTEIN SNF;                                                         
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER;                        
*SOURCE   3 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   4 EXPRESSION_SYSTEM_STRAIN: ROSETTA(DE3)PLYSS;                         
*SOURCE   5 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   6 EXPRESSION_SYSTEM_PLASMID: PET-21D(+)                                
*KEYWDS    RNA BINDING PROTEIN, SNF RBD1, RNA BINDING, RNA SPLICING,             
*KEYWDS   2 SOLUTION STRUCTURE, MRNA PROCESSING, MRNA SPLICING, NUCLEUS,         
*KEYWDS   3 RIBONUCLEOPROTEIN, RNA-BINDING, SPLICEOSOME                          
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    C.LIU, G.CUI, J.HU, C.JIN, B.XIA                                      
*REVDAT   1   03-JUN-08 2K3K    0                                                


#
#  chirality for residue 1 atoms:  CA CG HB2 HB3
 &rst iat=5,10,8,9, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 100., rk3=100.,  &end
#
#  chirality for residue 1 atoms:  CB SD HG2 HG3
 &rst iat=7,13,11,12, &end
#
#  chirality for residue 1 atoms:  N C HA CB
 &rst iat=1,18,6,7, &end
#
#  chirality for residue 2 atoms:  CA CG HB2 HB3
 &rst iat=22,27,25,26, &end
#
#  chirality for residue 2 atoms:  CB CD HG2 HG3
 &rst iat=24,30,28,29, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=20,33,23,24, &end
#
#  chirality for residue 3 atoms:  CA CG HB2 HB3
 &rst iat=37,42,40,41, &end
#
#  chirality for residue 3 atoms:  CB SD HG2 HG3
 &rst iat=39,45,43,44, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=35,50,38,39, &end
#
#  chirality for residue 4 atoms:  CA CG HB2 HB3
 &rst iat=54,59,57,58, &end
#
#  chirality for residue 4 atoms:  CB CD1 CD2 HG
 &rst iat=56,61,65,60, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=52,69,55,56, &end
#
#  chirality for residue 5 atoms:  CA CG HB2 HB3
 &rst iat=81,75,79,80, &end
#
#  chirality for residue 5 atoms:  CB CD HG2 HG3
 &rst iat=78,72,76,77, &end
#
#  chirality for residue 5 atoms:  CG N HD2 HD3
 &rst iat=75,71,73,74, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=71,83,82,78, &end
#
#  chirality for residue 6 atoms:  CA CG HB2 HB3
 &rst iat=87,92,90,91, &end
#
#  chirality for residue 6 atoms:  N C HA CB
 &rst iat=85,97,88,89, &end
#
#  chirality for residue 7 atoms:  CA CG HB2 HB3
 &rst iat=101,106,104,105, &end
#
#  chirality for residue 7 atoms:  CB CD HG2 HG3
 &rst iat=103,109,107,108, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=99,114,102,103, &end
#
#  chirality for residue 8 atoms:  CA CG2 OG1 HB
 &rst iat=118,122,126,121, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=116,128,119,120, &end
#
#  chirality for residue 9 atoms:  CA CG2 CG1 HB
 &rst iat=132,136,140,135, &end
#
#  chirality for residue 9 atoms:  CB CD1 HG12 HG13
 &rst iat=134,143,141,142, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=130,147,133,134, &end
#
#  chirality for residue 10 atoms:  CA CG HB2 HB3
 &rst iat=151,156,154,155, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=149,168,152,153, &end
#
#  chirality for residue 11 atoms:  CA CG2 CG1 HB
 &rst iat=172,176,180,175, &end
#
#  chirality for residue 11 atoms:  CB CD1 HG12 HG13
 &rst iat=174,183,181,182, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=170,187,173,174, &end
#
#  chirality for residue 12 atoms:  CA CG HB2 HB3
 &rst iat=191,196,194,195, &end
#
#  chirality for residue 12 atoms:  N C HA CB
 &rst iat=189,201,192,193, &end
#
#  chirality for residue 13 atoms:  CA CG HB2 HB3
 &rst iat=205,210,208,209, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=203,215,206,207, &end
#
#  chirality for residue 14 atoms:  CA CG HB2 HB3
 &rst iat=219,224,222,223, &end
#
#  chirality for residue 14 atoms:  CB CD1 CD2 HG
 &rst iat=221,226,230,225, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=217,234,220,221, &end
#
#  chirality for residue 15 atoms:  CA CG HB2 HB3
 &rst iat=238,243,241,242, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=236,248,239,240, &end
#
#  chirality for residue 16 atoms:  CA CG HB2 HB3
 &rst iat=252,257,255,256, &end
#
#  chirality for residue 16 atoms:  CB CD HG2 HG3
 &rst iat=254,260,258,259, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=250,263,253,254, &end
#
#  chirality for residue 17 atoms:  CA CG HB2 HB3
 &rst iat=267,272,270,271, &end
#
#  chirality for residue 17 atoms:  CB CD HG2 HG3
 &rst iat=269,275,273,274, &end
#
#  chirality for residue 17 atoms:  CD NZ HE2 HE3
 &rst iat=275,281,279,280, &end
#
#  chirality for residue 17 atoms:  CG CE HD2 HD3
 &rst iat=272,278,276,277, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=265,285,268,269, &end
#
#  chirality for residue 18 atoms:  CA CG2 CG1 HB
 &rst iat=289,293,297,292, &end
#
#  chirality for residue 18 atoms:  CB CD1 HG12 HG13
 &rst iat=291,300,298,299, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=287,304,290,291, &end
#
#  chirality for residue 19 atoms:  CA CG HB2 HB3
 &rst iat=308,313,311,312, &end
#
#  chirality for residue 19 atoms:  CB CD HG2 HG3
 &rst iat=310,316,314,315, &end
#
#  chirality for residue 19 atoms:  CD NZ HE2 HE3
 &rst iat=316,322,320,321, &end
#
#  chirality for residue 19 atoms:  CG CE HD2 HD3
 &rst iat=313,319,317,318, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=306,326,309,310, &end
#
#  chirality for residue 20 atoms:  CA CG HB2 HB3
 &rst iat=330,335,333,334, &end
#
#  chirality for residue 20 atoms:  CB CD HG2 HG3
 &rst iat=332,338,336,337, &end
#
#  chirality for residue 20 atoms:  CD NZ HE2 HE3
 &rst iat=338,344,342,343, &end
#
#  chirality for residue 20 atoms:  CG CE HD2 HD3
 &rst iat=335,341,339,340, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=328,348,331,332, &end
#
#  chirality for residue 21 atoms:  CA CG HB2 HB3
 &rst iat=352,357,355,356, &end
#
#  chirality for residue 21 atoms:  CB CD HG2 HG3
 &rst iat=354,360,358,359, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=350,363,353,354, &end
#
#  chirality for residue 22 atoms:  CA CG HB2 HB3
 &rst iat=367,372,370,371, &end
#
#  chirality for residue 22 atoms:  CB CD HG2 HG3
 &rst iat=369,375,373,374, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=365,378,368,369, &end
#
#  chirality for residue 23 atoms:  CA CG HB2 HB3
 &rst iat=382,387,385,386, &end
#
#  chirality for residue 23 atoms:  CB CD1 CD2 HG
 &rst iat=384,389,393,388, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=380,397,383,384, &end
#
#  chirality for residue 24 atoms:  CA CG HB2 HB3
 &rst iat=401,406,404,405, &end
#
#  chirality for residue 24 atoms:  CB CD HG2 HG3
 &rst iat=403,409,407,408, &end
#
#  chirality for residue 24 atoms:  CD NZ HE2 HE3
 &rst iat=409,415,413,414, &end
#
#  chirality for residue 24 atoms:  CG CE HD2 HD3
 &rst iat=406,412,410,411, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=399,419,402,403, &end
#
#  chirality for residue 25 atoms:  CA CG HB2 HB3
 &rst iat=423,428,426,427, &end
#
#  chirality for residue 25 atoms:  CB CD HG2 HG3
 &rst iat=425,431,429,430, &end
#
#  chirality for residue 25 atoms:  CD NZ HE2 HE3
 &rst iat=431,437,435,436, &end
#
#  chirality for residue 25 atoms:  CG CE HD2 HD3
 &rst iat=428,434,432,433, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=421,441,424,425, &end
#
#  chirality for residue 26 atoms:  CA OG HB2 HB3
 &rst iat=445,450,448,449, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=443,452,446,447, &end
#
#  chirality for residue 27 atoms:  CA CG HB2 HB3
 &rst iat=456,461,459,460, &end
#
#  chirality for residue 27 atoms:  CB CD1 CD2 HG
 &rst iat=458,463,467,462, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=454,471,457,458, &end
#
#  chirality for residue 28 atoms:  CA CG HB2 HB3
 &rst iat=475,480,478,479, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=473,492,476,477, &end
#
#  chirality for residue 29 atoms:  N C HA CB
 &rst iat=494,502,497,498, &end
#
#  chirality for residue 30 atoms:  CA CG2 CG1 HB
 &rst iat=506,510,514,509, &end
#
#  chirality for residue 30 atoms:  CB CD1 HG12 HG13
 &rst iat=508,517,515,516, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=504,521,507,508, &end
#
#  chirality for residue 31 atoms:  CA CG HB2 HB3
 &rst iat=525,530,528,529, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=523,541,526,527, &end
#
#  chirality for residue 32 atoms:  CA OG HB2 HB3
 &rst iat=545,550,548,549, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=543,552,546,547, &end
#
#  chirality for residue 33 atoms:  CA CG HB2 HB3
 &rst iat=556,561,559,560, &end
#
#  chirality for residue 33 atoms:  CB CD HG2 HG3
 &rst iat=558,564,562,563, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=554,569,557,558, &end
#
#  chirality for residue 34 atoms:  CA CG HB2 HB3
 &rst iat=573,578,576,577, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=571,589,574,575, &end
#
#  chirality for residue 35 atoms:  N C HA2 HA3
 &rst iat=591,596,594,595, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=600,605,603,604, &end
#
#  chirality for residue 36 atoms:  CB CD HG2 HG3
 &rst iat=602,608,606,607, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=598,613,601,602, &end
#
#  chirality for residue 37 atoms:  CA CG2 CG1 HB
 &rst iat=617,621,625,620, &end
#
#  chirality for residue 37 atoms:  CB CD1 HG12 HG13
 &rst iat=619,628,626,627, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=615,632,618,619, &end
#
#  chirality for residue 38 atoms:  CA CG HB2 HB3
 &rst iat=636,641,639,640, &end
#
#  chirality for residue 38 atoms:  CB CD1 CD2 HG
 &rst iat=638,643,647,642, &end
#
#  chirality for residue 38 atoms:  N C HA CB
 &rst iat=634,651,637,638, &end
#
#  chirality for residue 39 atoms:  CA CG HB2 HB3
 &rst iat=655,660,658,659, &end
#
#  chirality for residue 39 atoms:  N C HA CB
 &rst iat=653,663,656,657, &end
#
#  chirality for residue 40 atoms:  CA CG2 CG1 HB
 &rst iat=667,671,675,670, &end
#
#  chirality for residue 40 atoms:  CB CD1 HG12 HG13
 &rst iat=669,678,676,677, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=665,682,668,669, &end
#
#  chirality for residue 41 atoms:  CA CG1 CG2 HB
 &rst iat=686,690,694,689, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=684,698,687,688, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=700,708,703,704, &end
#
#  chirality for residue 43 atoms:  CA CG HB2 HB3
 &rst iat=712,717,715,716, &end
#
#  chirality for residue 43 atoms:  CB CD1 CD2 HG
 &rst iat=714,719,723,718, &end
#
#  chirality for residue 43 atoms:  N C HA CB
 &rst iat=710,727,713,714, &end
#
#  chirality for residue 44 atoms:  CA CG HB2 HB3
 &rst iat=731,736,734,735, &end
#
#  chirality for residue 44 atoms:  CB CD HG2 HG3
 &rst iat=733,739,737,738, &end
#
#  chirality for residue 44 atoms:  CD NZ HE2 HE3
 &rst iat=739,745,743,744, &end
#
#  chirality for residue 44 atoms:  CG CE HD2 HD3
 &rst iat=736,742,740,741, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=729,749,732,733, &end
#
#  chirality for residue 45 atoms:  CA CG2 OG1 HB
 &rst iat=753,757,761,756, &end
#
#  chirality for residue 45 atoms:  N C HA CB
 &rst iat=751,763,754,755, &end
#
#  chirality for residue 46 atoms:  CA CG HB2 HB3
 &rst iat=767,772,770,771, &end
#
#  chirality for residue 46 atoms:  CB CD1 CD2 HG
 &rst iat=769,774,778,773, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=765,782,768,769, &end
#
#  chirality for residue 47 atoms:  CA CG HB2 HB3
 &rst iat=786,791,789,790, &end
#
#  chirality for residue 47 atoms:  CB CD HG2 HG3
 &rst iat=788,794,792,793, &end
#
#  chirality for residue 47 atoms:  CD NZ HE2 HE3
 &rst iat=794,800,798,799, &end
#
#  chirality for residue 47 atoms:  CG CE HD2 HD3
 &rst iat=791,797,795,796, &end
#
#  chirality for residue 47 atoms:  N C HA CB
 &rst iat=784,804,787,788, &end
#
#  chirality for residue 48 atoms:  CA CG HB2 HB3
 &rst iat=808,813,811,812, &end
#
#  chirality for residue 48 atoms:  CB SD HG2 HG3
 &rst iat=810,816,814,815, &end
#
#  chirality for residue 48 atoms:  N C HA CB
 &rst iat=806,821,809,810, &end
#
#  chirality for residue 49 atoms:  CA CG HB2 HB3
 &rst iat=825,830,828,829, &end
#
#  chirality for residue 49 atoms:  CB CD HG2 HG3
 &rst iat=827,833,831,832, &end
#
#  chirality for residue 49 atoms:  CG NE HD2 HD3
 &rst iat=830,836,834,835, &end
#
#  chirality for residue 49 atoms:  N C HA CB
 &rst iat=823,845,826,827, &end
#
#  chirality for residue 50 atoms:  N C HA2 HA3
 &rst iat=847,852,850,851, &end
#
#  chirality for residue 51 atoms:  CA CG HB2 HB3
 &rst iat=856,861,859,860, &end
#
#  chirality for residue 51 atoms:  CB CD HG2 HG3
 &rst iat=858,864,862,863, &end
#
#  chirality for residue 51 atoms:  N C HA CB
 &rst iat=854,869,857,858, &end
#
#  chirality for residue 52 atoms:  N C HA CB
 &rst iat=871,879,874,875, &end
#
#  chirality for residue 53 atoms:  CA CG HB2 HB3
 &rst iat=883,888,886,887, &end
#
#  chirality for residue 53 atoms:  N C HA CB
 &rst iat=881,899,884,885, &end
#
#  chirality for residue 54 atoms:  CA CG1 CG2 HB
 &rst iat=903,907,911,906, &end
#
#  chirality for residue 54 atoms:  N C HA CB
 &rst iat=901,915,904,905, &end
#
#  chirality for residue 55 atoms:  CA CG2 CG1 HB
 &rst iat=919,923,927,922, &end
#
#  chirality for residue 55 atoms:  CB CD1 HG12 HG13
 &rst iat=921,930,928,929, &end
#
#  chirality for residue 55 atoms:  N C HA CB
 &rst iat=917,934,920,921, &end
#
#  chirality for residue 56 atoms:  CA CG HB2 HB3
 &rst iat=938,943,941,942, &end
#
#  chirality for residue 56 atoms:  N C HA CB
 &rst iat=936,954,939,940, &end
#
#  chirality for residue 57 atoms:  CA CG HB2 HB3
 &rst iat=958,963,961,962, &end
#
#  chirality for residue 57 atoms:  CB CD HG2 HG3
 &rst iat=960,966,964,965, &end
#
#  chirality for residue 57 atoms:  CD NZ HE2 HE3
 &rst iat=966,972,970,971, &end
#
#  chirality for residue 57 atoms:  CG CE HD2 HD3
 &rst iat=963,969,967,968, &end
#
#  chirality for residue 57 atoms:  N C HA CB
 &rst iat=956,976,959,960, &end
#
#  chirality for residue 58 atoms:  CA CG HB2 HB3
 &rst iat=980,985,983,984, &end
#
#  chirality for residue 58 atoms:  CB CD HG2 HG3
 &rst iat=982,988,986,987, &end
#
#  chirality for residue 58 atoms:  N C HA CB
 &rst iat=978,991,981,982, &end
#
#  chirality for residue 59 atoms:  CA CG2 CG1 HB
 &rst iat=995,999,1003,998, &end
#
#  chirality for residue 59 atoms:  CB CD1 HG12 HG13
 &rst iat=997,1006,1004,1005, &end
#
#  chirality for residue 59 atoms:  N C HA CB
 &rst iat=993,1010,996,997, &end
#
#  chirality for residue 60 atoms:  N C HA2 HA3
 &rst iat=1012,1017,1015,1016, &end
#
#  chirality for residue 61 atoms:  CA OG HB2 HB3
 &rst iat=1021,1026,1024,1025, &end
#
#  chirality for residue 61 atoms:  N C HA CB
 &rst iat=1019,1028,1022,1023, &end
#
#  chirality for residue 62 atoms:  N C HA CB
 &rst iat=1030,1038,1033,1034, &end
#
#  chirality for residue 63 atoms:  CA OG HB2 HB3
 &rst iat=1042,1047,1045,1046, &end
#
#  chirality for residue 63 atoms:  N C HA CB
 &rst iat=1040,1049,1043,1044, &end
#
#  chirality for residue 64 atoms:  CA CG HB2 HB3
 &rst iat=1053,1058,1056,1057, &end
#
#  chirality for residue 64 atoms:  N C HA CB
 &rst iat=1051,1063,1054,1055, &end
#
#  chirality for residue 65 atoms:  N C HA CB
 &rst iat=1065,1073,1068,1069, &end
#
#  chirality for residue 66 atoms:  CA CG HB2 HB3
 &rst iat=1077,1082,1080,1081, &end
#
#  chirality for residue 66 atoms:  CB CD1 CD2 HG
 &rst iat=1079,1084,1088,1083, &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=1075,1092,1078,1079, &end
#
#  chirality for residue 67 atoms:  CA CG HB2 HB3
 &rst iat=1096,1101,1099,1100, &end
#
#  chirality for residue 67 atoms:  CB CD HG2 HG3
 &rst iat=1098,1104,1102,1103, &end
#
#  chirality for residue 67 atoms:  CG NE HD2 HD3
 &rst iat=1101,1107,1105,1106, &end
#
#  chirality for residue 67 atoms:  N C HA CB
 &rst iat=1094,1116,1097,1098, &end
#
#  chirality for residue 68 atoms:  CA CG2 OG1 HB
 &rst iat=1120,1124,1128,1123, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=1118,1130,1121,1122, &end
#
#  chirality for residue 69 atoms:  CA CG HB2 HB3
 &rst iat=1134,1139,1137,1138, &end
#
#  chirality for residue 69 atoms:  CB SD HG2 HG3
 &rst iat=1136,1142,1140,1141, &end
#
#  chirality for residue 69 atoms:  N C HA CB
 &rst iat=1132,1147,1135,1136, &end
#
#  chirality for residue 70 atoms:  CA CG HB2 HB3
 &rst iat=1151,1156,1154,1155, &end
#
#  chirality for residue 70 atoms:  CB CD HG2 HG3
 &rst iat=1153,1159,1157,1158, &end
#
#  chirality for residue 70 atoms:  N C HA CB
 &rst iat=1149,1164,1152,1153, &end
#
#  chirality for residue 71 atoms:  N C HA2 HA3
 &rst iat=1166,1171,1169,1170, &end
#
#  chirality for residue 72 atoms:  CA CG HB2 HB3
 &rst iat=1175,1180,1178,1179, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=1173,1191,1176,1177, &end
#
#  chirality for residue 73 atoms:  CA CG HB2 HB3
 &rst iat=1203,1197,1201,1202, &end
#
#  chirality for residue 73 atoms:  CB CD HG2 HG3
 &rst iat=1200,1194,1198,1199, &end
#
#  chirality for residue 73 atoms:  CG N HD2 HD3
 &rst iat=1197,1193,1195,1196, &end
#
#  chirality for residue 73 atoms:  N C HA CB
 &rst iat=1193,1205,1204,1200, &end
#
#  chirality for residue 74 atoms:  CA CG HB2 HB3
 &rst iat=1209,1214,1212,1213, &end
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=1207,1225,1210,1211, &end
#
#  chirality for residue 75 atoms:  CA CG HB2 HB3
 &rst iat=1229,1234,1232,1233, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=1227,1246,1230,1231, &end
#
#  chirality for residue 76 atoms:  CA CG HB2 HB3
 &rst iat=1250,1255,1253,1254, &end
#
#  chirality for residue 76 atoms:  N C HA CB
 &rst iat=1248,1258,1251,1252, &end
#
#  chirality for residue 77 atoms:  CA CG HB2 HB3
 &rst iat=1262,1267,1265,1266, &end
#
#  chirality for residue 77 atoms:  CB CD HG2 HG3
 &rst iat=1264,1270,1268,1269, &end
#
#  chirality for residue 77 atoms:  CD NZ HE2 HE3
 &rst iat=1270,1276,1274,1275, &end
#
#  chirality for residue 77 atoms:  CG CE HD2 HD3
 &rst iat=1267,1273,1271,1272, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=1260,1280,1263,1264, &end
#
#  chirality for residue 78 atoms:  CA CG HB2 HB3
 &rst iat=1292,1286,1290,1291, &end
#
#  chirality for residue 78 atoms:  CB CD HG2 HG3
 &rst iat=1289,1283,1287,1288, &end
#
#  chirality for residue 78 atoms:  CG N HD2 HD3
 &rst iat=1286,1282,1284,1285, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=1282,1294,1293,1289, &end
#
#  chirality for residue 79 atoms:  CA CG HB2 HB3
 &rst iat=1298,1303,1301,1302, &end
#
#  chirality for residue 79 atoms:  CB SD HG2 HG3
 &rst iat=1300,1306,1304,1305, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=1296,1311,1299,1300, &end
#
#  chirality for residue 80 atoms:  CA CG HB2 HB3
 &rst iat=1315,1320,1318,1319, &end
#
#  chirality for residue 80 atoms:  CB CD HG2 HG3
 &rst iat=1317,1323,1321,1322, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=1313,1328,1316,1317, &end
#
#  chirality for residue 81 atoms:  CA CG2 CG1 HB
 &rst iat=1332,1336,1340,1335, &end
#
#  chirality for residue 81 atoms:  CB CD1 HG12 HG13
 &rst iat=1334,1343,1341,1342, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=1330,1347,1333,1334, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=1349,1357,1352,1353, &end
#
#  chirality for residue 83 atoms:  CA CG HB2 HB3
 &rst iat=1361,1366,1364,1365, &end
#
#  chirality for residue 83 atoms:  N C HA CB
 &rst iat=1359,1378,1362,1363, &end
#
#  chirality for residue 84 atoms:  CA OG HB2 HB3
 &rst iat=1382,1387,1385,1386, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=1380,1389,1383,1384, &end
#
#  chirality for residue 85 atoms:  CA CG HB2 HB3
 &rst iat=1393,1398,1396,1397, &end
#
#  chirality for residue 85 atoms:  CB CD HG2 HG3
 &rst iat=1395,1401,1399,1400, &end
#
#  chirality for residue 85 atoms:  CD NZ HE2 HE3
 &rst iat=1401,1407,1405,1406, &end
#
#  chirality for residue 85 atoms:  CG CE HD2 HD3
 &rst iat=1398,1404,1402,1403, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=1391,1411,1394,1395, &end
#
#  chirality for residue 86 atoms:  CA OG HB2 HB3
 &rst iat=1415,1420,1418,1419, &end
#
#  chirality for residue 86 atoms:  N C HA CB
 &rst iat=1413,1422,1416,1417, &end
#
#  chirality for residue 87 atoms:  CA CG HB2 HB3
 &rst iat=1426,1431,1429,1430, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=1424,1434,1427,1428, &end
#
#  chirality for residue 88 atoms:  CA OG HB2 HB3
 &rst iat=1438,1443,1441,1442, &end
#
#  chirality for residue 88 atoms:  N C HA CB
 &rst iat=1436,1445,1439,1440, &end
#
#  chirality for residue 89 atoms:  CA CG HB2 HB3
 &rst iat=1449,1454,1452,1453, &end
#
#  chirality for residue 89 atoms:  N C HA CB
 &rst iat=1447,1457,1450,1451, &end
#
#  chirality for residue 90 atoms:  CA CG2 CG1 HB
 &rst iat=1461,1465,1469,1464, &end
#
#  chirality for residue 90 atoms:  CB CD1 HG12 HG13
 &rst iat=1463,1472,1470,1471, &end
#
#  chirality for residue 90 atoms:  N C HA CB
 &rst iat=1459,1476,1462,1463, &end
#
#  chirality for residue 91 atoms:  CA CG1 CG2 HB
 &rst iat=1480,1484,1488,1483, &end
#
#  chirality for residue 91 atoms:  N C HA CB
 &rst iat=1478,1492,1481,1482, &end
#
#  chirality for residue 92 atoms:  N C HA CB
 &rst iat=1494,1502,1497,1498, &end
#
#  chirality for residue 93 atoms:  CA CG HB2 HB3
 &rst iat=1506,1511,1509,1510, &end
#
#  chirality for residue 93 atoms:  CB CD HG2 HG3
 &rst iat=1508,1514,1512,1513, &end
#
#  chirality for residue 93 atoms:  CD NZ HE2 HE3
 &rst iat=1514,1520,1518,1519, &end
#
#  chirality for residue 93 atoms:  CG CE HD2 HD3
 &rst iat=1511,1517,1515,1516, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=1504,1524,1507,1508, &end
#
#  chirality for residue 94 atoms:  CA CG2 CG1 HB
 &rst iat=1528,1532,1536,1531, &end
#
#  chirality for residue 94 atoms:  CB CD1 HG12 HG13
 &rst iat=1530,1539,1537,1538, &end
#
#  chirality for residue 94 atoms:  N C HA CB
 &rst iat=1526,1543,1529,1530, &end
#
#  chirality for residue 95 atoms:  CA CG HB2 HB3
 &rst iat=1547,1552,1550,1551, &end
#
#  chirality for residue 95 atoms:  CB CD HG2 HG3
 &rst iat=1549,1555,1553,1554, &end
#
#  chirality for residue 95 atoms:  CD NZ HE2 HE3
 &rst iat=1555,1561,1559,1560, &end
#
#  chirality for residue 95 atoms:  CG CE HD2 HD3
 &rst iat=1552,1558,1556,1557, &end
#
#  chirality for residue 95 atoms:  N C HA CB
 &rst iat=1545,1565,1548,1549, &end
#
#  chirality for residue 96 atoms:  N C HA2 HA3
 &rst iat=1567,1572,1570,1571, &end
#
#  chirality for residue 97 atoms:  CA CG2 OG1 HB
 &rst iat=1576,1580,1584,1579, &end
#
#  chirality for residue 97 atoms:  N C HA CB
 &rst iat=1574,1586,1577,1578, &end
#
#  chirality for residue 98 atoms:  CA CG HB2 HB3
 &rst iat=1590,1595,1593,1594, &end
#
#  chirality for residue 98 atoms:  N C HA CB
 &rst iat=1588,1606,1591,1592, &end
#
#  chirality for residue 99 atoms:  CA CG HB2 HB3
 &rst iat=1610,1615,1613,1614, &end
#
#  chirality for residue 99 atoms:  CB CD HG2 HG3
 &rst iat=1612,1618,1616,1617, &end
#
#  chirality for residue 99 atoms:  CD NZ HE2 HE3
 &rst iat=1618,1624,1622,1623, &end
#
#  chirality for residue 99 atoms:  CG CE HD2 HD3
 &rst iat=1615,1621,1619,1620, &end
#
#  chirality for residue 99 atoms:  N C HA CB
 &rst iat=1608,1628,1611,1612, &end
#
#  chirality for residue 100 atoms:  CA CG HB2 HB3
 &rst iat=1632,1637,1635,1636, &end
#
#  chirality for residue 100 atoms:  CB CD HG2 HG3
 &rst iat=1634,1640,1638,1639, &end
#
#  chirality for residue 100 atoms:  N C HA CB
 &rst iat=1630,1643,1633,1634, &end
#
#  chirality for residue 101 atoms:  CA CG HB2 HB3
 &rst iat=1647,1652,1650,1651, &end
#
#  chirality for residue 101 atoms:  CB CD HG2 HG3
 &rst iat=1649,1655,1653,1654, &end
#
#  chirality for residue 101 atoms:  CG NE HD2 HD3
 &rst iat=1652,1658,1656,1657, &end
#
#  chirality for residue 101 atoms:  N C HA CB
 &rst iat=1645,1667,1648,1649, &end
#
#  chirality for residue 102 atoms:  CA CG HB2 HB3
 &rst iat=1679,1673,1677,1678, &end
#
#  chirality for residue 102 atoms:  CB CD HG2 HG3
 &rst iat=1676,1670,1674,1675, &end
#
#  chirality for residue 102 atoms:  CG N HD2 HD3
 &rst iat=1673,1669,1671,1672, &end
#
#  chirality for residue 102 atoms:  N C HA CB
 &rst iat=1669,1681,1680,1676, &end
#
#  chirality for residue 103 atoms:  CA CG HB2 HB3
 &rst iat=1685,1690,1688,1689, &end
#
#  chirality for residue 103 atoms:  CB CD HG2 HG3
 &rst iat=1687,1693,1691,1692, &end
#
#  chirality for residue 103 atoms:  CD NZ HE2 HE3
 &rst iat=1693,1699,1697,1698, &end
#
#  chirality for residue 103 atoms:  CG CE HD2 HD3
 &rst iat=1690,1696,1694,1695, &end
#
#  chirality for residue 103 atoms:  N C HA CB
 &rst iat=1683,1703,1686,1687, &end
#
#  chirality for residue 104 atoms:  CA CG HB2 HB3
 &rst iat=1707,1712,1710,1711, &end
#
#  chirality for residue 104 atoms:  CB CD HG2 HG3
 &rst iat=1709,1715,1713,1714, &end
#
#  chirality for residue 104 atoms:  CD NZ HE2 HE3
 &rst iat=1715,1721,1719,1720, &end
#
#  chirality for residue 104 atoms:  CG CE HD2 HD3
 &rst iat=1712,1718,1716,1717, &end
#
#  chirality for residue 104 atoms:  N C HA CB
 &rst iat=1705,1725,1708,1709, &end
#
#  trans-omega constraint for residue 2
 &rst iat=22,20,18,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 150., rk3=150.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=37,35,33,22, &end
#
#  trans-omega constraint for residue 4
 &rst iat=54,52,50,37, &end
#
#  trans-omega constraint for residue 5
 &rst iat=81,71,69,54, &end
#
#  trans-omega constraint for residue 6
 &rst iat=87,85,83,81, &end
#
#  trans-omega constraint for residue 7
 &rst iat=101,99,97,87, &end
#
#  trans-omega constraint for residue 8
 &rst iat=118,116,114,101, &end
#
#  trans-omega constraint for residue 9
 &rst iat=132,130,128,118, &end
#
#  trans-omega constraint for residue 10
 &rst iat=151,149,147,132, &end
#
#  trans-omega constraint for residue 11
 &rst iat=172,170,168,151, &end
#
#  trans-omega constraint for residue 12
 &rst iat=191,189,187,172, &end
#
#  trans-omega constraint for residue 13
 &rst iat=205,203,201,191, &end
#
#  trans-omega constraint for residue 14
 &rst iat=219,217,215,205, &end
#
#  trans-omega constraint for residue 15
 &rst iat=238,236,234,219, &end
#
#  trans-omega constraint for residue 16
 &rst iat=252,250,248,238, &end
#
#  trans-omega constraint for residue 17
 &rst iat=267,265,263,252, &end
#
#  trans-omega constraint for residue 18
 &rst iat=289,287,285,267, &end
#
#  trans-omega constraint for residue 19
 &rst iat=308,306,304,289, &end
#
#  trans-omega constraint for residue 20
 &rst iat=330,328,326,308, &end
#
#  trans-omega constraint for residue 21
 &rst iat=352,350,348,330, &end
#
#  trans-omega constraint for residue 22
 &rst iat=367,365,363,352, &end
#
#  trans-omega constraint for residue 23
 &rst iat=382,380,378,367, &end
#
#  trans-omega constraint for residue 24
 &rst iat=401,399,397,382, &end
#
#  trans-omega constraint for residue 25
 &rst iat=423,421,419,401, &end
#
#  trans-omega constraint for residue 26
 &rst iat=445,443,441,423, &end
#
#  trans-omega constraint for residue 27
 &rst iat=456,454,452,445, &end
#
#  trans-omega constraint for residue 28
 &rst iat=475,473,471,456, &end
#
#  trans-omega constraint for residue 29
 &rst iat=496,494,492,475, &end
#
#  trans-omega constraint for residue 30
 &rst iat=506,504,502,496, &end
#
#  trans-omega constraint for residue 31
 &rst iat=525,523,521,506, &end
#
#  trans-omega constraint for residue 32
 &rst iat=545,543,541,525, &end
#
#  trans-omega constraint for residue 33
 &rst iat=556,554,552,545, &end
#
#  trans-omega constraint for residue 34
 &rst iat=573,571,569,556, &end
#
#  trans-omega constraint for residue 35
 &rst iat=593,591,589,573, &end
#
#  trans-omega constraint for residue 36
 &rst iat=600,598,596,593, &end
#
#  trans-omega constraint for residue 37
 &rst iat=617,615,613,600, &end
#
#  trans-omega constraint for residue 38
 &rst iat=636,634,632,617, &end
#
#  trans-omega constraint for residue 39
 &rst iat=655,653,651,636, &end
#
#  trans-omega constraint for residue 40
 &rst iat=667,665,663,655, &end
#
#  trans-omega constraint for residue 41
 &rst iat=686,684,682,667, &end
#
#  trans-omega constraint for residue 42
 &rst iat=702,700,698,686, &end
#
#  trans-omega constraint for residue 43
 &rst iat=712,710,708,702, &end
#
#  trans-omega constraint for residue 44
 &rst iat=731,729,727,712, &end
#
#  trans-omega constraint for residue 45
 &rst iat=753,751,749,731, &end
#
#  trans-omega constraint for residue 46
 &rst iat=767,765,763,753, &end
#
#  trans-omega constraint for residue 47
 &rst iat=786,784,782,767, &end
#
#  trans-omega constraint for residue 48
 &rst iat=808,806,804,786, &end
#
#  trans-omega constraint for residue 49
 &rst iat=825,823,821,808, &end
#
#  trans-omega constraint for residue 50
 &rst iat=849,847,845,825, &end
#
#  trans-omega constraint for residue 51
 &rst iat=856,854,852,849, &end
#
#  trans-omega constraint for residue 52
 &rst iat=873,871,869,856, &end
#
#  trans-omega constraint for residue 53
 &rst iat=883,881,879,873, &end
#
#  trans-omega constraint for residue 54
 &rst iat=903,901,899,883, &end
#
#  trans-omega constraint for residue 55
 &rst iat=919,917,915,903, &end
#
#  trans-omega constraint for residue 56
 &rst iat=938,936,934,919, &end
#
#  trans-omega constraint for residue 57
 &rst iat=958,956,954,938, &end
#
#  trans-omega constraint for residue 58
 &rst iat=980,978,976,958, &end
#
#  trans-omega constraint for residue 59
 &rst iat=995,993,991,980, &end
#
#  trans-omega constraint for residue 60
 &rst iat=1014,1012,1010,995, &end
#
#  trans-omega constraint for residue 61
 &rst iat=1021,1019,1017,1014, &end
#
#  trans-omega constraint for residue 62
 &rst iat=1032,1030,1028,1021, &end
#
#  trans-omega constraint for residue 63
 &rst iat=1042,1040,1038,1032, &end
#
#  trans-omega constraint for residue 64
 &rst iat=1053,1051,1049,1042, &end
#
#  trans-omega constraint for residue 65
 &rst iat=1067,1065,1063,1053, &end
#
#  trans-omega constraint for residue 66
 &rst iat=1077,1075,1073,1067, &end
#
#  trans-omega constraint for residue 67
 &rst iat=1096,1094,1092,1077, &end
#
#  trans-omega constraint for residue 68
 &rst iat=1120,1118,1116,1096, &end
#
#  trans-omega constraint for residue 69
 &rst iat=1134,1132,1130,1120, &end
#
#  trans-omega constraint for residue 70
 &rst iat=1151,1149,1147,1134, &end
#
#  trans-omega constraint for residue 71
 &rst iat=1168,1166,1164,1151, &end
#
#  trans-omega constraint for residue 72
 &rst iat=1175,1173,1171,1168, &end
#
#  trans-omega constraint for residue 73
 &rst iat=1203,1193,1191,1175, &end
#
#  trans-omega constraint for residue 74
 &rst iat=1209,1207,1205,1203, &end
#
#  trans-omega constraint for residue 75
 &rst iat=1229,1227,1225,1209, &end
#
#  trans-omega constraint for residue 76
 &rst iat=1250,1248,1246,1229, &end
#
#  trans-omega constraint for residue 77
 &rst iat=1262,1260,1258,1250, &end
#
#  trans-omega constraint for residue 78
 &rst iat=1292,1282,1280,1262, &end
#
#  trans-omega constraint for residue 79
 &rst iat=1298,1296,1294,1292, &end
#
#  trans-omega constraint for residue 80
 &rst iat=1315,1313,1311,1298, &end
#
#  trans-omega constraint for residue 81
 &rst iat=1332,1330,1328,1315, &end
#
#  trans-omega constraint for residue 82
 &rst iat=1351,1349,1347,1332, &end
#
#  trans-omega constraint for residue 83
 &rst iat=1361,1359,1357,1351, &end
#
#  trans-omega constraint for residue 84
 &rst iat=1382,1380,1378,1361, &end
#
#  trans-omega constraint for residue 85
 &rst iat=1393,1391,1389,1382, &end
#
#  trans-omega constraint for residue 86
 &rst iat=1415,1413,1411,1393, &end
#
#  trans-omega constraint for residue 87
 &rst iat=1426,1424,1422,1415, &end
#
#  trans-omega constraint for residue 88
 &rst iat=1438,1436,1434,1426, &end
#
#  trans-omega constraint for residue 89
 &rst iat=1449,1447,1445,1438, &end
#
#  trans-omega constraint for residue 90
 &rst iat=1461,1459,1457,1449, &end
#
#  trans-omega constraint for residue 91
 &rst iat=1480,1478,1476,1461, &end
#
#  trans-omega constraint for residue 92
 &rst iat=1496,1494,1492,1480, &end
#
#  trans-omega constraint for residue 93
 &rst iat=1506,1504,1502,1496, &end
#
#  trans-omega constraint for residue 94
 &rst iat=1528,1526,1524,1506, &end
#
#  trans-omega constraint for residue 95
 &rst iat=1547,1545,1543,1528, &end
#
#  trans-omega constraint for residue 96
 &rst iat=1569,1567,1565,1547, &end
#
#  trans-omega constraint for residue 97
 &rst iat=1576,1574,1572,1569, &end
#
#  trans-omega constraint for residue 98
 &rst iat=1590,1588,1586,1576, &end
#
#  trans-omega constraint for residue 99
 &rst iat=1610,1608,1606,1590, &end
#
#  trans-omega constraint for residue 100
 &rst iat=1632,1630,1628,1610, &end
#
#  trans-omega constraint for residue 101
 &rst iat=1647,1645,1643,1632, &end
#
#  trans-omega constraint for residue 102
 &rst iat=1679,1669,1667,1647, &end
#
#  trans-omega constraint for residue 103
 &rst iat=1685,1683,1681,1679, &end
#
#  trans-omega constraint for residue 104
 &rst iat=1707,1705,1703,1685, &end
#
# 8 THR PHI:  (7 GLN C)-(8 THR N)-(8 THR CA)-(8 THR C) -179.0 -99.0
 &rst     iat =   114,   116,   118,   128,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
   rk2 =   50.0, rk3 =   50.0,    &end

# 9 ILE PHI:  (8 THR C)-(9 ILE N)-(9 ILE CA)-(9 ILE C) -179.0 -99.0
 &rst     iat =   128,   130,   132,   147,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 10 TYR PHI:  (9 ILE C)-(10 TYR N)-(10 TYR CA)-(10 TYR C) -179.0 -99.0
 &rst     iat =   147,   149,   151,   168,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 11 ILE PHI:  (10 TYR C)-(11 ILE N)-(11 ILE CA)-(11 ILE C) -179.0 -99.0
 &rst     iat =   168,   170,   172,   187,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 20 LYS PHI:  (19 LYS C)-(20 LYS N)-(20 LYS CA)-(20 LYS C) -88.0 -28.0
 &rst     iat =   326,   328,   330,   348,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 21 GLU PHI:  (20 LYS C)-(21 GLU N)-(21 GLU CA)-(21 GLU C) -88.0 -28.0
 &rst     iat =   348,   350,   352,   363,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 22 GLU PHI:  (21 GLU C)-(22 GLU N)-(22 GLU CA)-(22 GLU C) -88.0 -28.0
 &rst     iat =   363,   365,   367,   378,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 23 LEU PHI:  (22 GLU C)-(23 LEU N)-(23 LEU CA)-(23 LEU C) -88.0 -28.0
 &rst     iat =   378,   380,   382,   397,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 24 LYS PHI:  (23 LEU C)-(24 LYS N)-(24 LYS CA)-(24 LYS C) -88.0 -28.0
 &rst     iat =   397,   399,   401,   419,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 25 LYS PHI:  (24 LYS C)-(25 LYS N)-(25 LYS CA)-(25 LYS C) -88.0 -28.0
 &rst     iat =   419,   421,   423,   441,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 26 SER PHI:  (25 LYS C)-(26 SER N)-(26 SER CA)-(26 SER C) -88.0 -28.0
 &rst     iat =   441,   443,   445,   452,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 27 LEU PHI:  (26 SER C)-(27 LEU N)-(27 LEU CA)-(27 LEU C) -88.0 -28.0
 &rst     iat =   452,   454,   456,   471,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 28 TYR PHI:  (27 LEU C)-(28 TYR N)-(28 TYR CA)-(28 TYR C) -88.0 -28.0
 &rst     iat =   471,   473,   475,   492,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 29 ALA PHI:  (28 TYR C)-(29 ALA N)-(29 ALA CA)-(29 ALA C) -107.0 -27.0
 &rst     iat =   492,   494,   496,   502,
   r1 = -108.0, r2 = -107.0, r3 = -27.0, r4 = -26.0,
 &end

# 38 LEU PHI:  (37 ILE C)-(38 LEU N)-(38 LEU CA)-(38 LEU C) -179.0 -99.0
 &rst     iat =   632,   634,   636,   651,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 39 ASP PHI:  (38 LEU C)-(39 ASP N)-(39 ASP CA)-(39 ASP C) -179.0 -99.0
 &rst     iat =   651,   653,   655,   663,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 40 ILE PHI:  (39 ASP C)-(40 ILE N)-(40 ILE CA)-(40 ILE C) -179.0 -99.0
 &rst     iat =   663,   665,   667,   682,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 41 VAL PHI:  (40 ILE C)-(41 VAL N)-(41 VAL CA)-(41 VAL C) -179.0 -99.0
 &rst     iat =   682,   684,   686,   698,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 42 ALA PHI:  (41 VAL C)-(42 ALA N)-(42 ALA CA)-(42 ALA C) -179.0 -99.0
 &rst     iat =   698,   700,   702,   708,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 43 LEU PHI:  (42 ALA C)-(43 LEU N)-(43 LEU CA)-(43 LEU C) -179.0 -99.0
 &rst     iat =   708,   710,   712,   727,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 48 MET PHI:  (47 LYS C)-(48 MET N)-(48 MET CA)-(48 MET C) -143.0 -63.0
 &rst     iat =   804,   806,   808,   821,
   r1 = -144.0, r2 = -143.0, r3 = -63.0, r4 = -62.0,
 &end

# 51 GLN PHI:  (50 GLY C)-(51 GLN N)-(51 GLN CA)-(51 GLN C) -179.0 -99.0
 &rst     iat =   852,   854,   856,   869,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 52 ALA PHI:  (51 GLN C)-(52 ALA N)-(52 ALA CA)-(52 ALA C) -179.0 -99.0
 &rst     iat =   869,   871,   873,   879,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 53 PHE PHI:  (52 ALA C)-(53 PHE N)-(53 PHE CA)-(53 PHE C) -179.0 -99.0
 &rst     iat =   879,   881,   883,   899,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 54 VAL PHI:  (53 PHE C)-(54 VAL N)-(54 VAL CA)-(54 VAL C) -179.0 -99.0
 &rst     iat =   899,   901,   903,   915,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 55 ILE PHI:  (54 VAL C)-(55 ILE N)-(55 ILE CA)-(55 ILE C) -179.0 -99.0
 &rst     iat =   915,   917,   919,   934,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 59 ILE PHI:  (58 GLU C)-(59 ILE N)-(59 ILE CA)-(59 ILE C) -88.0 -28.0
 &rst     iat =   991,   993,   995,  1010,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 60 GLY PHI:  (59 ILE C)-(60 GLY N)-(60 GLY CA)-(60 GLY C) -88.0 -28.0
 &rst     iat =  1010,  1012,  1014,  1017,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 61 SER PHI:  (60 GLY C)-(61 SER N)-(61 SER CA)-(61 SER C) -88.0 -28.0
 &rst     iat =  1017,  1019,  1021,  1028,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 62 ALA PHI:  (61 SER C)-(62 ALA N)-(62 ALA CA)-(62 ALA C) -88.0 -28.0
 &rst     iat =  1028,  1030,  1032,  1038,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 63 SER PHI:  (62 ALA C)-(63 SER N)-(63 SER CA)-(63 SER C) -88.0 -28.0
 &rst     iat =  1038,  1040,  1042,  1049,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 64 ASN PHI:  (63 SER C)-(64 ASN N)-(64 ASN CA)-(64 ASN C) -88.0 -28.0
 &rst     iat =  1049,  1051,  1053,  1063,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 65 ALA PHI:  (64 ASN C)-(65 ALA N)-(65 ALA CA)-(65 ALA C) -88.0 -28.0
 &rst     iat =  1063,  1065,  1067,  1073,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 66 LEU PHI:  (65 ALA C)-(66 LEU N)-(66 LEU CA)-(66 LEU C) -88.0 -28.0
 &rst     iat =  1073,  1075,  1077,  1092,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 67 ARG PHI:  (66 LEU C)-(67 ARG N)-(67 ARG CA)-(67 ARG C) -88.0 -28.0
 &rst     iat =  1092,  1094,  1096,  1116,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 68 THR PHI:  (67 ARG C)-(68 THR N)-(68 THR CA)-(68 THR C) -88.0 -28.0
 &rst     iat =  1116,  1118,  1120,  1130,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 80 GLN PHI:  (79 MET C)-(80 GLN N)-(80 GLN CA)-(80 GLN C) -179.0 -99.0
 &rst     iat =  1311,  1313,  1315,  1328,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 81 ILE PHI:  (80 GLN C)-(81 ILE N)-(81 ILE CA)-(81 ILE C) -179.0 -99.0
 &rst     iat =  1328,  1330,  1332,  1347,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 82 ALA PHI:  (81 ILE C)-(82 ALA N)-(82 ALA CA)-(82 ALA C) -179.0 -99.0
 &rst     iat =  1347,  1349,  1351,  1357,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 90 ILE PHI:  (89 ASP C)-(90 ILE N)-(90 ILE CA)-(90 ILE C) -88.0 -28.0
 &rst     iat =  1457,  1459,  1461,  1476,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 91 VAL PHI:  (90 ILE C)-(91 VAL N)-(91 VAL CA)-(91 VAL C) -88.0 -28.0
 &rst     iat =  1476,  1478,  1480,  1492,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 92 ALA PHI:  (91 VAL C)-(92 ALA N)-(92 ALA CA)-(92 ALA C) -88.0 -28.0
 &rst     iat =  1492,  1494,  1496,  1502,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 93 LYS PHI:  (92 ALA C)-(93 LYS N)-(93 LYS CA)-(93 LYS C) -88.0 -28.0
 &rst     iat =  1502,  1504,  1506,  1524,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 94 ILE PHI:  (93 LYS C)-(94 ILE N)-(94 ILE CA)-(94 ILE C) -88.0 -28.0
 &rst     iat =  1524,  1526,  1528,  1543,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 8 THR PSI:  (8 THR N)-(8 THR CA)-(8 THR C)-(9 ILE N)  95.0 175.0
 &rst     iat =   116,   118,   128,   130,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 9 ILE PSI:  (9 ILE N)-(9 ILE CA)-(9 ILE C)-(10 TYR N)  95.0 175.0
 &rst     iat =   130,   132,   147,   149,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 10 TYR PSI:  (10 TYR N)-(10 TYR CA)-(10 TYR C)-(11 ILE N)  95.0 175.0
 &rst     iat =   149,   151,   168,   170,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 11 ILE PSI:  (11 ILE N)-(11 ILE CA)-(11 ILE C)-(12 ASN N)  95.0 175.0
 &rst     iat =   170,   172,   187,   189,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 20 LYS PSI:  (20 LYS N)-(20 LYS CA)-(20 LYS C)-(21 GLU N) -77.0 -17.0
 &rst     iat =   328,   330,   348,   350,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 21 GLU PSI:  (21 GLU N)-(21 GLU CA)-(21 GLU C)-(22 GLU N) -77.0 -17.0
 &rst     iat =   350,   352,   363,   365,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 22 GLU PSI:  (22 GLU N)-(22 GLU CA)-(22 GLU C)-(23 LEU N) -77.0 -17.0
 &rst     iat =   365,   367,   378,   380,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 23 LEU PSI:  (23 LEU N)-(23 LEU CA)-(23 LEU C)-(24 LYS N) -77.0 -17.0
 &rst     iat =   380,   382,   397,   399,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 24 LYS PSI:  (24 LYS N)-(24 LYS CA)-(24 LYS C)-(25 LYS N) -77.0 -17.0
 &rst     iat =   399,   401,   419,   421,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 25 LYS PSI:  (25 LYS N)-(25 LYS CA)-(25 LYS C)-(26 SER N) -77.0 -17.0
 &rst     iat =   421,   423,   441,   443,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 26 SER PSI:  (26 SER N)-(26 SER CA)-(26 SER C)-(27 LEU N) -77.0 -17.0
 &rst     iat =   443,   445,   452,   454,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 27 LEU PSI:  (27 LEU N)-(27 LEU CA)-(27 LEU C)-(28 TYR N) -77.0 -17.0
 &rst     iat =   454,   456,   471,   473,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 28 TYR PSI:  (28 TYR N)-(28 TYR CA)-(28 TYR C)-(29 ALA N) -77.0 -17.0
 &rst     iat =   473,   475,   492,   494,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 29 ALA PSI:  (29 ALA N)-(29 ALA CA)-(29 ALA C)-(30 ILE N) -58.0  38.0
 &rst     iat =   494,   496,   502,   504,
   r1 = -59.0, r2 = -58.0, r3 =  38.0, r4 =  39.0,
 &end

# 37 ILE PSI:  (37 ILE N)-(37 ILE CA)-(37 ILE C)-(38 LEU N)  95.0 175.0
 &rst     iat =   615,   617,   632,   634,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 39 ASP PSI:  (39 ASP N)-(39 ASP CA)-(39 ASP C)-(40 ILE N)  95.0 175.0
 &rst     iat =   653,   655,   663,   665,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 40 ILE PSI:  (40 ILE N)-(40 ILE CA)-(40 ILE C)-(41 VAL N)  95.0 175.0
 &rst     iat =   665,   667,   682,   684,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 41 VAL PSI:  (41 VAL N)-(41 VAL CA)-(41 VAL C)-(42 ALA N)  95.0 175.0
 &rst     iat =   684,   686,   698,   700,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 42 ALA PSI:  (42 ALA N)-(42 ALA CA)-(42 ALA C)-(43 LEU N)  95.0 175.0
 &rst     iat =   700,   702,   708,   710,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 43 LEU PSI:  (43 LEU N)-(43 LEU CA)-(43 LEU C)-(44 LYS N)  95.0 175.0
 &rst     iat =   710,   712,   727,   729,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 51 GLN PSI:  (51 GLN N)-(51 GLN CA)-(51 GLN C)-(52 ALA N)  95.0 175.0
 &rst     iat =   854,   856,   869,   871,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 52 ALA PSI:  (52 ALA N)-(52 ALA CA)-(52 ALA C)-(53 PHE N)  95.0 175.0
 &rst     iat =   871,   873,   879,   881,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 53 PHE PSI:  (53 PHE N)-(53 PHE CA)-(53 PHE C)-(54 VAL N)  95.0 175.0
 &rst     iat =   881,   883,   899,   901,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 54 VAL PSI:  (54 VAL N)-(54 VAL CA)-(54 VAL C)-(55 ILE N)  95.0 175.0
 &rst     iat =   901,   903,   915,   917,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 55 ILE PSI:  (55 ILE N)-(55 ILE CA)-(55 ILE C)-(56 PHE N)  95.0 175.0
 &rst     iat =   917,   919,   934,   936,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 56 PHE PSI:  (56 PHE N)-(56 PHE CA)-(56 PHE C)-(57 LYS N)  95.0 175.0
 &rst     iat =   936,   938,   954,   956,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 59 ILE PSI:  (59 ILE N)-(59 ILE CA)-(59 ILE C)-(60 GLY N) -77.0 -17.0
 &rst     iat =   993,   995,  1010,  1012,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 60 GLY PSI:  (60 GLY N)-(60 GLY CA)-(60 GLY C)-(61 SER N) -77.0 -17.0
 &rst     iat =  1012,  1014,  1017,  1019,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 61 SER PSI:  (61 SER N)-(61 SER CA)-(61 SER C)-(62 ALA N) -77.0 -17.0
 &rst     iat =  1019,  1021,  1028,  1030,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 62 ALA PSI:  (62 ALA N)-(62 ALA CA)-(62 ALA C)-(63 SER N) -77.0 -17.0
 &rst     iat =  1030,  1032,  1038,  1040,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 63 SER PSI:  (63 SER N)-(63 SER CA)-(63 SER C)-(64 ASN N) -77.0 -17.0
 &rst     iat =  1040,  1042,  1049,  1051,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 64 ASN PSI:  (64 ASN N)-(64 ASN CA)-(64 ASN C)-(65 ALA N) -77.0 -17.0
 &rst     iat =  1051,  1053,  1063,  1065,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 65 ALA PSI:  (65 ALA N)-(65 ALA CA)-(65 ALA C)-(66 LEU N) -77.0 -17.0
 &rst     iat =  1065,  1067,  1073,  1075,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 66 LEU PSI:  (66 LEU N)-(66 LEU CA)-(66 LEU C)-(67 ARG N) -77.0 -17.0
 &rst     iat =  1075,  1077,  1092,  1094,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 67 ARG PSI:  (67 ARG N)-(67 ARG CA)-(67 ARG C)-(68 THR N) -77.0 -17.0
 &rst     iat =  1094,  1096,  1116,  1118,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 68 THR PSI:  (68 THR N)-(68 THR CA)-(68 THR C)-(69 MET N) -77.0 -17.0
 &rst     iat =  1118,  1120,  1130,  1132,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 80 GLN PSI:  (80 GLN N)-(80 GLN CA)-(80 GLN C)-(81 ILE N)  95.0 175.0
 &rst     iat =  1313,  1315,  1328,  1330,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 81 ILE PSI:  (81 ILE N)-(81 ILE CA)-(81 ILE C)-(82 ALA N)  95.0 175.0
 &rst     iat =  1330,  1332,  1347,  1349,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 82 ALA PSI:  (82 ALA N)-(82 ALA CA)-(82 ALA C)-(83 TYR N)  95.0 175.0
 &rst     iat =  1349,  1351,  1357,  1359,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 83 TYR PSI:  (83 TYR N)-(83 TYR CA)-(83 TYR C)-(84 SER N)  95.0 175.0
 &rst     iat =  1359,  1361,  1378,  1380,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 90 ILE PSI:  (90 ILE N)-(90 ILE CA)-(90 ILE C)-(91 VAL N) -77.0 -17.0
 &rst     iat =  1459,  1461,  1476,  1478,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 91 VAL PSI:  (91 VAL N)-(91 VAL CA)-(91 VAL C)-(92 ALA N) -77.0 -17.0
 &rst     iat =  1478,  1480,  1492,  1494,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 92 ALA PSI:  (92 ALA N)-(92 ALA CA)-(92 ALA C)-(93 LYS N) -77.0 -17.0
 &rst     iat =  1494,  1496,  1502,  1504,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 93 LYS PSI:  (93 LYS N)-(93 LYS CA)-(93 LYS C)-(94 ILE N) -77.0 -17.0
 &rst     iat =  1504,  1506,  1524,  1526,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 94 ILE PSI:  (94 ILE N)-(94 ILE CA)-(94 ILE C)-(95 LYS N) -77.0 -17.0
 &rst     iat =  1526,  1528,  1543,  1545,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 9 ILE CHI1:  (9 ILE N)-(9 ILE CA)-(9 ILE CB)-(9 ILE CG1)  30.0  90.0
 &rst     iat =   130,   132,   134,   140,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 11 ILE CHI1:  (11 ILE N)-(11 ILE CA)-(11 ILE CB)-(11 ILE CG1) -90.0 -30.0
 &rst     iat =   170,   172,   174,   180,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 22 GLU CHI1:  (22 GLU N)-(22 GLU CA)-(22 GLU CB)-(22 GLU CG) -90.0 -30.0
 &rst     iat =   365,   367,   369,   372,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 27 LEU CHI1:  (27 LEU N)-(27 LEU CA)-(27 LEU CB)-(27 LEU CG) -90.0 -30.0
 &rst     iat =   454,   456,   458,   461,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 31 PHE CHI1:  (31 PHE N)-(31 PHE CA)-(31 PHE CB)-(31 PHE CG) -90.0 -30.0
 &rst     iat =   523,   525,   527,   530,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 37 ILE CHI1:  (37 ILE N)-(37 ILE CA)-(37 ILE CB)-(37 ILE CG1) -90.0 -30.0
 &rst     iat =   615,   617,   619,   625,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 38 LEU CHI1:  (38 LEU N)-(38 LEU CA)-(38 LEU CB)-(38 LEU CG) 150.0 210.0
 &rst     iat =   634,   636,   638,   641,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 39 ASP CHI1:  (39 ASP N)-(39 ASP CA)-(39 ASP CB)-(39 ASP CG) 150.0 210.0
 &rst     iat =   653,   655,   657,   660,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 40 ILE CHI1:  (40 ILE N)-(40 ILE CA)-(40 ILE CB)-(40 ILE CG1) -90.0 -30.0
 &rst     iat =   665,   667,   669,   675,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 41 VAL CHI1:  (41 VAL N)-(41 VAL CA)-(41 VAL CB)-(41 VAL CG1) 150.0 210.0
 &rst     iat =   684,   686,   688,   690,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 55 ILE CHI1:  (55 ILE N)-(55 ILE CA)-(55 ILE CB)-(55 ILE CG1) -90.0 -30.0
 &rst     iat =   917,   919,   921,   927,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 61 SER CHI1:  (61 SER N)-(61 SER CA)-(61 SER CB)-(61 SER OG) -90.0 -30.0
 &rst     iat =  1019,  1021,  1023,  1026,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 64 ASN CHI1:  (64 ASN N)-(64 ASN CA)-(64 ASN CB)-(64 ASN CG) 150.0 210.0
 &rst     iat =  1051,  1053,  1055,  1058,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 66 LEU CHI1:  (66 LEU N)-(66 LEU CA)-(66 LEU CB)-(66 LEU CG) 150.0 210.0
 &rst     iat =  1075,  1077,  1079,  1082,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 68 THR CHI1:  (68 THR N)-(68 THR CA)-(68 THR CB)-(68 THR OG1) -90.0 -30.0
 &rst     iat =  1118,  1120,  1122,  1128,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 69 MET CHI1:  (69 MET N)-(69 MET CA)-(69 MET CB)-(69 MET CG) -90.0 -30.0
 &rst     iat =  1132,  1134,  1136,  1139,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 74 PHE CHI1:  (74 PHE N)-(74 PHE CA)-(74 PHE CB)-(74 PHE CG) 150.0 210.0
 &rst     iat =  1207,  1209,  1211,  1214,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 81 ILE CHI1:  (81 ILE N)-(81 ILE CA)-(81 ILE CB)-(81 ILE CG1) -90.0 -30.0
 &rst     iat =  1330,  1332,  1334,  1340,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 88 SER CHI1:  (88 SER N)-(88 SER CA)-(88 SER CB)-(88 SER OG) -90.0 -30.0
 &rst     iat =  1436,  1438,  1440,  1443,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 89 ASP CHI1:  (89 ASP N)-(89 ASP CA)-(89 ASP CB)-(89 ASP CG) 150.0 210.0
 &rst     iat =  1447,  1449,  1451,  1454,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 91 VAL CHI1:  (91 VAL N)-(91 VAL CA)-(91 VAL CB)-(91 VAL CG1) 150.0 210.0
 &rst     iat =  1478,  1480,  1482,  1484,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 91 VAL CHI1:  (91 VAL N)-(91 VAL CA)-(91 VAL CB)-(91 VAL CG1) 150.0 210.0
 &rst     iat =  1478,  1480,  1482,  1484,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 91 VAL CHI1:  (91 VAL N)-(91 VAL CA)-(91 VAL CB)-(91 VAL CG1) 150.0 210.0
 &rst     iat =  1478,  1480,  1482,  1484,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end
#
# 11 ILE N 52 ALA O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 880, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, 
      rk2=40.0, rk3=40.0, ir6=1, ialtd=0,
 &end
#
#  9 ILE N 54 VAL O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 130, 916, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 12 ASN N 80 GLN O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 189,1329, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 10 TYR N 82 ALA O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 149,1358, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 39 ASP- N 55 ILE O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 653, 935, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 41 VAL N 53 PHE O     3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 684, 900, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 25 LYS+ N 21 GLU- O     3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 421, 364, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 26 SER N 22 GLU- O     3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 443, 379, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 27 LEU N 23 LEU O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 454, 398, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 28 TYR N 24 LYS+ O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 473, 420, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 29 ALA N 25 LYS+ O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 494, 442, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 30 ILE N 26 SER O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 504, 453, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 63 SER N 59 ILE O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1040,1011, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 64 ASN N 60 GLY O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1051,1018, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 65 ALA N 61 SER O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1065,1029, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 66 LEU N 62 ALA O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1075,1039, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 67 ARG+ N 63 SER O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1094,1050, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 68 THR N 64 ASN O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1118,1064, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 69 MET N 65 ALA O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1132,1074, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 93 LYS+ N 89 ASP- O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1504,1458, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 94 ILE N 90 ILE O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1526,1477, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 95 LYS+ N 91 VAL O    3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1545,1493, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 11 ILE HN 52 ALA O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 171, 880, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  9 ILE HN 54 VAL O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 131, 916, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 12 ASN HN 80 GLN O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 190,1329, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 10 TYR HN 82 ALA O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 150,1358, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 39 ASP- HN 55 ILE O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 935, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 41 VAL HN 53 PHE O     2.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 685, 900, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 25 LYS+ HN 21 GLU- O     2.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 422, 364, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 26 SER HN 22 GLU- O     2.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 444, 379, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 27 LEU HN 23 LEU O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 455, 398, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 28 TYR HN 24 LYS+ O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 474, 420, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 29 ALA HN 25 LYS+ O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 495, 442, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 30 ILE HN 26 SER O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 453, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 63 SER HN 59 ILE O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1041,1011, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 64 ASN HN 60 GLY O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1052,1018, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 65 ALA HN 61 SER O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1066,1029, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 66 LEU HN 62 ALA O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1076,1039, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 67 ARG+ HN 63 SER O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1095,1050, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 68 THR HN 64 ASN O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1119,1064, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 69 MET HN 65 ALA O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1133,1074, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 93 LYS+ HN 89 ASP- O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1505,1458, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 94 ILE HN 90 ILE O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1527,1477, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 95 LYS+ HN 91 VAL O    2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1546,1493, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#
#    4 LEU  HN            3 MET  HA          2.80    (#      0:25  Unique         2.19, 2.33 A)
 &rst
  ixpk= 0, nxpk= 25, iat=  53,  38, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
#    0 AMB  25-3:2        3 MET  HA          3.50    (#      2:25  Single Ambig)
 &rst
  ixpk= 2, nxpk= 25, iat=  -1,  38, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  40,  41,  40,  41,
 &end
#
#    0 AMB  25-3:3        3 MET  HA          3.50    (#      3:25  Single Ambig)
 &rst
  ixpk= 3, nxpk= 25, iat=  -1,  38, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  43,  44,  43,  44,
 &end
#
#    4 LEU  HG            3 MET  HA          5.50    (#      4:25  Unique         3.27, 5.52 A)
 &rst
  ixpk= 4, nxpk= 25, iat=  60,  38, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:5        3 MET  HA          3.50    (#      5:25  Single Ambig)
 &rst
  ixpk= 5, nxpk= 25, iat=  -1,  38, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  62,  63,  64,  66,  67,  68,  62,  63,  64,  66,
        67,  68,
 &end
#
#    0 AMB  25-3:6        0 AMB  25-1:6      4.50    (#      6:25  Double Ambig)
 &rst
  ixpk= 6, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=  43,  44,  43,  44,
 igr2=  40,  41,  40,  41,
 &end
#
#    0 AMB  25-3:7        0 AMB  25-1:7      4.50    (#      7:25  Double Ambig)
 &rst
  ixpk= 7, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=  43,  44,  43,  44,  43,  44,
 igr2=  40,  41,  40,  41,  40,  41,
 &end
#
#    0 AMB  25-3:8        0 AMB  25-1:8      3.50    (#      8:25  Double Ambig)
 &rst
  ixpk= 8, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  38,1043,
 igr2=  40,  41,  40,  41,  40,  41,
 &end
#
#    0 AMB  25-3:9        0 AMB  25-1:9      4.50    (#      9:25  Double Ambig)
 &rst
  ixpk= 9, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=  40,  41,  40,  41,
 igr2=  43,  44,  43,  44,
 &end
#
#    0 AMB  25-3:10       0 AMB  25-1:10     3.50    (#     10:25  Double Ambig)
 &rst
  ixpk= 10, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=  40,  41,  40,  41,  25,  26,
 igr2=  43,  44,  43,  44,  43,  44,
 &end
#
#    5 PRO  HD-           4 LEU  HA          2.80    (#     11:25  Unique         2.02, 2.43 A)
 &rst
  ixpk= 11, nxpk= 25, iat=  -1,  55, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=  73,  74,
 &end
#
#    5 PRO  HD+           4 LEU  HA          3.50    (#     12:25  Unique         2.02, 2.43 A)
 &rst
  ixpk= 12, nxpk= 25, iat=  -1,  55, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  73,  74,
 &end
#
#    0 AMB  25-3:13       4 LEU  HA          2.80    (#     13:25  Single Ambig)
 &rst
  ixpk= 13, nxpk= 25, iat=  -1,  55, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=  62,  63,  64,  66,  67,  68,  62,  63,  64,  66,
        67,  68,
 &end
#
#    4 LEU  HB-           4 LEU  HA          3.50    (#     14:25  Unique         2.23, 2.71 A)
 &rst
  ixpk= 14, nxpk= 25, iat=  -1,  55, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  57,  58,
 &end
#
#    0 AMB  25-3:15       4 LEU  HA          3.50    (#     15:25  Single Ambig)
 &rst
  ixpk= 15, nxpk= 25, iat=  -1,  55, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  57,  58,  60,
 &end
#
#    4 LEU  HN            4 LEU  HA          5.50    (#     16:25  Unique         2.49, 2.84 A)
 &rst
  ixpk= 16, nxpk= 25, iat=  53,  55, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    4 LEU  HN            4 LEU  HB+         4.50    (#     17:25  Unique         2.19, 3.05 A)
 &rst
  ixpk= 17, nxpk= 25, iat=  53,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  57,  58,
 &end
#
#   70 GLN  HN           66 LEU  HB+         5.50    (#     18:25  Unique         5.71, 6.18 A)
 &rst
  ixpk= 18, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1080,1081,
 &end
#
#    0 AMB  25-3:19       0 AMB  25-1:19     4.50    (#     19:25  Double Ambig)
 &rst
  ixpk= 19, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1043,  55,
 igr2=1080,1081,  57,  58,
 &end
#
#    0 AMB  25-3:20       0 AMB  25-1:20     5.50    (#     20:25  Double Ambig)
 &rst
  ixpk= 20, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  73,  74,1078,
 igr2=  57,  58,1080,1081,
 &end
#
#    0 AMB  25-3:22       0 AMB  25-1:22     2.80    (#     22:25  Double Ambig)
 &rst
  ixpk= 22, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1=  62,  63,  64,  66,  67,  68,  62,  63,  64,  66,
        67,  68,
 igr2=  57,  58,  57,  58,
 &end
#
#    4 LEU  HA            4 LEU  HB-         4.50    (#     23:25  Unique         2.23, 2.71 A)
 &rst
  ixpk= 23, nxpk= 25, iat=  55,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  57,  58,
 &end
#
#    5 PRO  HD-           4 LEU  HB-         5.50    (#     25:25  Unique         2.25, 4.01 A)
 &rst
  ixpk= 25, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  73,  74,
 igr2=  57,  58,
 &end
#
#    0 AMB  25-3:27       4 LEU  HB-         2.80    (#     27:25  Single Ambig)
 &rst
  ixpk= 27, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=  62,  63,  64,  66,  67,  68,  62,  63,  64,  66,
        67,  68,
 igr2=  57,  58,
 &end
#
#    4 LEU  HN            4 LEU  HG          4.50    (#     28:25  Unique         2.20, 3.73 A)
 &rst
  ixpk= 28, nxpk= 25, iat=  53,  60, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:29       0 AMB  25-1:29     4.50    (#     29:25  Double Ambig)
 &rst
  ixpk= 29, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  55, 713,  38,
 igr2=  60, 718,
 &end
#
#    0 AMB  25-3:30       0 AMB  25-1:30     2.80    (#     30:25  Double Ambig)
 &rst
  ixpk= 30, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,  62,  63,  64,  66,  67,  68,  62,  63,
        64,  66,  67,  68,
 igr2= 718,  60,
 &end
#
#    0 AMB  25-3:31       4 LEU  HG          2.80    (#     31:25  Single Ambig)
 &rst
  ixpk= 31, nxpk= 25, iat=  -1,  60, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=  57,  58,  79,  80,
 &end
#
#    0 AMB  25-3:32       0 AMB  25-1:32     3.50    (#     32:25  Double Ambig)
 &rst
  ixpk= 32, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=  55, 713,
 igr2=  62,  63,  64,  66,  67,  68, 720, 721, 722, 724,
       725, 726,
 &end
#
#    5 PRO  HD-           4 LEU  MDX         5.50    (#     33:25  Unique         2.51, 5.26 A)
 &rst
  ixpk= 33, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  73,  74,
 igr2=  62,  63,  64,  66,  67,  68,
 &end
#
#    5 PRO  HD+           4 LEU  MDX         4.50    (#     34:25  Unique         2.51, 5.26 A)
 &rst
  ixpk= 34, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=  73,  74,
 igr2=  62,  63,  64,  66,  67,  68,
 &end
#
#    0 AMB  25-3:35       0 AMB  25-1:35     4.50    (#     35:25  Double Ambig)
 &rst
  ixpk= 35, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.42, r4= 9.92,
 igr1=  40,  41,  40,  41, 818, 819, 820,
 igr2=  62,  63,  64,  66,  67,  68, 720, 721, 722, 724,
       725, 726,
 &end
#
#    0 AMB  25-3:36       0 AMB  25-1:36     2.80    (#     36:25  Double Ambig)
 &rst
  ixpk= 36, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1=  57,  58,  57,  58, 737, 738,
 igr2=  62,  63,  64,  66,  67,  68, 720, 721, 722, 724,
       725, 726,
 &end
#
#    4 LEU  HG            4 LEU  MDX         2.80    (#     37:25  Unique         2.28, 2.65 A)
 &rst
  ixpk= 37, nxpk= 25, iat=  60,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=  62,  63,  64,  66,  67,  68,
 &end
#
#    0 AMB  25-3:40      55 ILE  QG2         2.80    (#     40:25  Single Ambig)
 &rst
  ixpk= 40, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 639, 640, 928, 929,
 igr2= 924, 925, 926,
 &end
#
#   55 ILE  HG1+         55 ILE  QG2         2.80    (#     41:25  Unique         2.28, 3.06 A)
 &rst
  ixpk= 41, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 928, 929,
 igr2= 924, 925, 926,
 &end
#
#   55 ILE  HB           55 ILE  QG2         2.80    (#     42:25  Unique         2.32, 2.66 A)
 &rst
  ixpk= 42, nxpk= 25, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 924, 925, 926,
 &end
#
#   55 ILE  HA           55 ILE  QG2         3.50    (#     43:25  Unique         2.42, 3.12 A)
 &rst
  ixpk= 43, nxpk= 25, iat= 920,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 924, 925, 926,
 &end
#
#   55 ILE  HN           55 ILE  QG2         5.50    (#     44:25  Unique         3.90, 4.54 A)
 &rst
  ixpk= 44, nxpk= 25, iat= 918,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 924, 925, 926,
 &end
#
#  102 PRO  HD+         101 ARG  HA          3.50    (#     45:25  Unique         2.00, 2.45 A)
 &rst
  ixpk= 45, nxpk= 25, iat=  -1,1648, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1671,1672,
 &end
#
#    0 AMB  25-3:60      22 GLU  HA          4.50    (#     60:25  Single Ambig)
 &rst
  ixpk= 60, nxpk= 25, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 358, 359, 358, 359,
 &end
#
#   46 LEU  QD2           0 AMB  25-1:62     4.50    (#     62:25  Single Ambig)
 &rst
  ixpk= 62, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 779, 780, 781,
 igr2= 768, 787,
 &end
#
#    7 GLN  HB-           7 GLN  HA          5.50    (#     64:25  Unique         2.26, 2.79 A)
 &rst
  ixpk= 64, nxpk= 25, iat=  -1, 102, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 104, 105,
 &end
#
#   19 LYS  HN           19 LYS  HB-         5.50    (#     78:25  Unique         2.36, 2.59 A)
 &rst
  ixpk= 78, nxpk= 25, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 311, 312,
 &end
#
#   97 THR  QG2          97 THR  HA          3.50    (#     82:25  Unique         2.06, 2.93 A)
 &rst
  ixpk= 82, nxpk= 25, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1581,1582,1583,
 &end
#
#   97 THR  QG2          97 THR  HB          2.80    (#     85:25  Unique         2.06, 2.66 A)
 &rst
  ixpk= 85, nxpk= 25, iat=  -1,1579, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1581,1582,1583,
 &end
#
#   97 THR  HA           97 THR  QG2         3.50    (#     96:25  Unique         2.06, 2.93 A)
 &rst
  ixpk= 96, nxpk= 25, iat=1577,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1581,1582,1583,
 &end
#
#    9 ILE  HB            9 ILE  HA          3.50    (#     98:25  Unique         2.02, 2.32 A)
 &rst
  ixpk= 98, nxpk= 25, iat= 135, 133, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  25-3:99       9 ILE  HA          5.50    (#     99:25  Single Ambig)
 &rst
  ixpk= 99, nxpk= 25, iat=  -1, 133, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1083, 123, 124, 125,
 &end
#
#    9 ILE  QG2           9 ILE  HA          3.50    (#    100:25  Unique         2.45, 3.20 A)
 &rst
  ixpk= 100, nxpk= 25, iat=  -1, 133, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 137, 138, 139,
 &end
#
#   84 SER  HN            9 ILE  HA          5.50    (#    102:25  Unique         2.18, 2.56 A)
 &rst
  ixpk= 102, nxpk= 25, iat=1381, 133, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   10 TYR  HN            9 ILE  HA          3.50    (#    103:25  Unique         2.04, 2.31 A)
 &rst
  ixpk= 103, nxpk= 25, iat= 150, 133, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    9 ILE  QD1           9 ILE  HB          4.50    (#    105:25  Unique         2.43, 3.27 A)
 &rst
  ixpk= 105, nxpk= 25, iat=  -1, 135, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 144, 145, 146,
 &end
#
#    9 ILE  QG2           9 ILE  HB          3.50    (#    106:25  Unique         2.06, 2.64 A)
 &rst
  ixpk= 106, nxpk= 25, iat=  -1, 135, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 137, 138, 139,
 &end
#
#   81 ILE  QG2           9 ILE  HB          3.50    (#    107:25  Unique         2.49, 3.20 A)
 &rst
  ixpk= 107, nxpk= 25, iat=  -1, 135, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1337,1338,1339,
 &end
#
#   66 LEU  HG            9 ILE  HB          5.50    (#    108:25  Unique         2.33, 2.72 A)
 &rst
  ixpk= 108, nxpk= 25, iat=1083, 135, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    9 ILE  HA            9 ILE  HB          4.50    (#    109:25  Unique         2.02, 2.32 A)
 &rst
  ixpk= 109, nxpk= 25, iat= 133, 135, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   10 TYR  HN            9 ILE  HB          5.50    (#    110:25  Unique         2.17, 2.50 A)
 &rst
  ixpk= 110, nxpk= 25, iat= 150, 135, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:111      0 AMB  25-1:111    4.50    (#    111:25  Double Ambig)
 &rst
  ixpk= 111, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 908, 909, 910, 912, 913, 914, 144, 145, 146,
 igr2= 141, 142, 141, 142,
 &end
#
#    0 AMB  25-3:112      9 ILE  HG1-        4.50    (#    112:25  Single Ambig)
 &rst
  ixpk= 112, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 908, 909, 910, 912, 913, 914, 144, 145, 146,
 igr2= 141, 142,
 &end
#
#   81 ILE  QG2           9 ILE  QD1         3.50    (#    115:25  Unique         2.16, 3.80 A)
 &rst
  ixpk= 115, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1337,1338,1339,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  25-3:116      9 ILE  QD1         2.80    (#    116:25  Single Ambig)
 &rst
  ixpk= 116, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 137, 138, 139,1344,1345,1346, 181, 182,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  25-3:117      9 ILE  QD1         3.50    (#    117:25  Single Ambig)
 &rst
  ixpk= 117, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1083,1070,1071,1072,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  25-3:118      9 ILE  QD1         3.50    (#    118:25  Single Ambig)
 &rst
  ixpk= 118, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 141, 142,1080,1081, 181, 182,
 igr2= 144, 145, 146,
 &end
#
#    9 ILE  HG1+          9 ILE  QD1         3.50    (#    119:25  Unique         2.24, 2.65 A)
 &rst
  ixpk= 119, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 141, 142,
 igr2= 144, 145, 146,
 &end
#
#    9 ILE  HB            9 ILE  QD1         3.50    (#    120:25  Unique         2.43, 3.27 A)
 &rst
  ixpk= 120, nxpk= 25, iat= 135,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 144, 145, 146,
 &end
#
#   31 PHE  QE            9 ILE  QD1         5.50    (#    121:25  Unique         2.27, 5.32 A)
 &rst
  ixpk= 121, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 534, 538,
 igr2= 144, 145, 146,
 &end
#
#   56 PHE  QE            9 ILE  QD1         3.50    (#    122:25  Unique         2.29, 4.40 A)
 &rst
  ixpk= 122, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 947, 951,
 igr2= 144, 145, 146,
 &end
#
#   56 PHE  QD            9 ILE  QD1         4.50    (#    123:25  Unique         3.57, 6.06 A)
 &rst
  ixpk= 123, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 945, 953,
 igr2= 144, 145, 146,
 &end
#
#    9 ILE  HN            9 ILE  QD1         4.50    (#    125:25  Unique         4.34, 4.88 A)
 &rst
  ixpk= 125, nxpk= 25, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  25-3:126      9 ILE  QD1         4.50    (#    126:25  Single Ambig)
 &rst
  ixpk= 126, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1080,1081,1335,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  25-3:127      9 ILE  QD1         2.80    (#    127:25  Single Ambig)
 &rst
  ixpk= 127, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 184, 185, 186,1085,1086,1087,1089,1090,1091,
 igr2= 144, 145, 146,
 &end
#
#   66 LEU  MDY           9 ILE  QG2         5.50    (#    128:25  Unique         2.30, 5.24 A)
 &rst
  ixpk= 128, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2= 137, 138, 139,
 &end
#
#    9 ILE  QD1           9 ILE  QG2         3.50    (#    129:25  Unique         2.26, 3.63 A)
 &rst
  ixpk= 129, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 144, 145, 146,
 igr2= 137, 138, 139,
 &end
#
#   66 LEU  MDX           9 ILE  QG2         5.50    (#    130:25  Unique         2.30, 5.24 A)
 &rst
  ixpk= 130, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2= 137, 138, 139,
 &end
#
#    9 ILE  HA            9 ILE  QG2         3.50    (#    131:25  Unique         2.45, 3.20 A)
 &rst
  ixpk= 131, nxpk= 25, iat= 133,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 137, 138, 139,
 &end
#
#    9 ILE  HN            9 ILE  QG2         4.50    (#    132:25  Unique         2.50, 3.62 A)
 &rst
  ixpk= 132, nxpk= 25, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 137, 138, 139,
 &end
#
#    0 AMB  25-3:133      9 ILE  QG2         5.50    (#    133:25  Single Ambig)
 &rst
  ixpk= 133, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1381,1360, 100,
 igr2= 137, 138, 139,
 &end
#
#   55 ILE  HN            0 AMB  25-1:134    5.50    (#    134:25  Single Ambig)
 &rst
  ixpk= 134, nxpk= 25, iat= 918,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 924, 925, 926, 137, 138, 139,
 &end
#
#   10 TYR  HN            9 ILE  QG2         5.50    (#    135:25  Unique         3.95, 4.70 A)
 &rst
  ixpk= 135, nxpk= 25, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 137, 138, 139,
 &end
#
#   56 PHE  QD            9 ILE  QG2         3.50    (#    136:25  Unique         2.66, 5.74 A)
 &rst
  ixpk= 136, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 945, 953,
 igr2= 137, 138, 139,
 &end
#
#    0 AMB  25-3:137      9 ILE  QG2         3.50    (#    137:25  Single Ambig)
 &rst
  ixpk= 137, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1083,1070,1071,1072,
 igr2= 137, 138, 139,
 &end
#
#    0 AMB  25-3:138      0 AMB  25-1:138    2.80    (#    138:25  Double Ambig)
 &rst
  ixpk= 138, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1080,1081, 928, 929, 141, 142,
 igr2= 137, 138, 139, 924, 925, 926,
 &end
#
#    0 AMB  25-3:139      0 AMB  25-1:139    2.80    (#    139:25  Double Ambig)
 &rst
  ixpk= 139, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 639, 640, 141, 142,
 igr2= 924, 925, 926, 137, 138, 139,
 &end
#
#    0 AMB  25-3:140      9 ILE  QG2         2.80    (#    140:25  Single Ambig)
 &rst
  ixpk= 140, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 135,1035,1036,1037,
 igr2= 137, 138, 139,
 &end
#
#   66 LEU  HN            9 ILE  QG2         5.50    (#    141:25  Unique         2.84, 4.47 A)
 &rst
  ixpk= 141, nxpk= 25, iat=1076,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 137, 138, 139,
 &end
#
#   53 PHE  HA           10 TYR  HA          5.50    (#    143:25  Unique         2.51, 2.91 A)
 &rst
  ixpk= 143, nxpk= 25, iat= 884, 152, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   12 ASN  HD2-         10 TYR  HA          5.50    (#    144:25  Unique         4.31, 5.81 A)
 &rst
  ixpk= 144, nxpk= 25, iat=  -1, 152, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 199, 200,
 &end
#
#   11 ILE  HN           10 TYR  HA          5.50    (#    145:25  Unique         2.00, 2.18 A)
 &rst
  ixpk= 145, nxpk= 25, iat= 171, 152, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   10 TYR  QD            0 AMB  25-1:158    5.50    (#    158:25  Single Ambig)
 &rst
  ixpk= 158, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 158, 167,
 igr2= 154, 155, 154, 155,
 &end
#
#    0 AMB  25-3:162      0 AMB  25-1:162    5.50    (#    162:25  Double Ambig)
 &rst
  ixpk= 162, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 152, 133,
 igr2= 154, 155, 154, 155,
 &end
#
#   91 VAL  HN           87 ASP  HB+         5.50    (#    163:25  Unique         5.11, 5.93 A)
 &rst
  ixpk= 163, nxpk= 25, iat=1479,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1429,1430,
 &end
#
#   10 TYR  HN            0 AMB  25-1:166    5.50    (#    166:25  Single Ambig)
 &rst
  ixpk= 166, nxpk= 25, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 154, 155, 154, 155,
 &end
#
#   11 ILE  QG2          11 ILE  HA          3.50    (#    168:25  Unique         2.32, 3.24 A)
 &rst
  ixpk= 168, nxpk= 25, iat=  -1, 173, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 177, 178, 179,
 &end
#
#   81 ILE  HA           11 ILE  HA          4.50    (#    172:25  Unique         2.32, 2.43 A)
 &rst
  ixpk= 172, nxpk= 25, iat=1333, 173, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   12 ASN  HN           11 ILE  HA          4.50    (#    173:25  Unique         2.16, 2.23 A)
 &rst
  ixpk= 173, nxpk= 25, iat= 190, 173, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   52 ALA  QB           11 ILE  HB          4.50    (#    178:25  Unique         2.22, 3.48 A)
 &rst
  ixpk= 178, nxpk= 25, iat=  -1, 175, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 876, 877, 878,
 &end
#
#   11 ILE  QG2          11 ILE  HB          3.50    (#    179:25  Unique         2.14, 2.66 A)
 &rst
  ixpk= 179, nxpk= 25, iat=  -1, 175, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 177, 178, 179,
 &end
#
#   11 ILE  QD1          11 ILE  HB          5.50    (#    181:25  Unique         2.49, 3.18 A)
 &rst
  ixpk= 181, nxpk= 25, iat=  -1, 175, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 184, 185, 186,
 &end
#
#   52 ALA  HN           11 ILE  HB          5.50    (#    182:25  Unique         2.56, 2.77 A)
 &rst
  ixpk= 182, nxpk= 25, iat= 872, 175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 ILE  HN           11 ILE  HB          5.50    (#    183:25  Unique         2.23, 2.37 A)
 &rst
  ixpk= 183, nxpk= 25, iat= 171, 175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 ILE  HG1+         11 ILE  HB          4.50    (#    185:25  Unique         2.47, 2.80 A)
 &rst
  ixpk= 185, nxpk= 25, iat=  -1, 175, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 181, 182,
 &end
#
#   11 ILE  QD1          11 ILE  HG1+        3.50    (#    192:25  Unique         2.23, 2.65 A)
 &rst
  ixpk= 192, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 184, 185, 186,
 igr2= 181, 182,
 &end
#
#   11 ILE  QD1          11 ILE  HG1-        4.50    (#    193:25  Unique         2.23, 2.65 A)
 &rst
  ixpk= 193, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 184, 185, 186,
 igr2= 181, 182,
 &end
#
#   11 ILE  HB           11 ILE  HG1+        4.50    (#    194:25  Unique         2.47, 2.80 A)
 &rst
  ixpk= 194, nxpk= 25, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 181, 182,
 &end
#
#   11 ILE  HB           11 ILE  HG1-        4.50    (#    195:25  Unique         2.47, 2.80 A)
 &rst
  ixpk= 195, nxpk= 25, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 181, 182,
 &end
#
#    0 AMB  25-3:196      0 AMB  25-1:196    5.50    (#    196:25  Double Ambig)
 &rst
  ixpk= 196, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1341,1342,1341,1342,
 igr2= 181, 182, 181, 182,
 &end
#
#    0 AMB  25-3:197     11 ILE  HG1-        4.50    (#    197:25  Single Ambig)
 &rst
  ixpk= 197, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1341,1342,1341,1342,
 igr2= 181, 182,
 &end
#
#   82 ALA  HN           11 ILE  HG1-        4.50    (#    198:25  Unique         4.44, 5.14 A)
 &rst
  ixpk= 198, nxpk= 25, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 181, 182,
 &end
#
#   11 ILE  HN           11 ILE  HG1+        5.50    (#    199:25  Unique         2.23, 3.12 A)
 &rst
  ixpk= 199, nxpk= 25, iat= 171,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 181, 182,
 &end
#
#    0 AMB  25-3:200     11 ILE  HG1-        5.50    (#    200:25  Single Ambig)
 &rst
  ixpk= 200, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1333, 152,
 igr2= 181, 182,
 &end
#
#    0 AMB  25-3:201      0 AMB  25-1:201    5.50    (#    201:25  Double Ambig)
 &rst
  ixpk= 201, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1333, 152,
 igr2= 181, 182, 181, 182,
 &end
#
#    0 AMB  25-3:202     11 ILE  QD1         2.80    (#    202:25  Single Ambig)
 &rst
  ixpk= 202, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 908, 909, 910, 912, 913, 914, 144, 145, 146,
 igr2= 184, 185, 186,
 &end
#
#   81 ILE  QG2          11 ILE  QD1         3.50    (#    203:25  Unique         3.10, 5.31 A)
 &rst
  ixpk= 203, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1337,1338,1339,
 igr2= 184, 185, 186,
 &end
#
#    0 AMB  25-3:204     11 ILE  QD1         3.50    (#    204:25  Single Ambig)
 &rst
  ixpk= 204, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 177, 178, 179,1344,1345,1346,
 igr2= 184, 185, 186,
 &end
#
#   52 ALA  QB           11 ILE  QD1         3.50    (#    205:25  Unique         2.35, 4.75 A)
 &rst
  ixpk= 205, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 876, 877, 878,
 igr2= 184, 185, 186,
 &end
#
#    0 AMB  25-3:206     11 ILE  QD1         3.50    (#    206:25  Single Ambig)
 &rst
  ixpk= 206, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 181, 182, 141, 142,
 igr2= 184, 185, 186,
 &end
#
#    0 AMB  25-3:207     11 ILE  QD1         2.80    (#    207:25  Single Ambig)
 &rst
  ixpk= 207, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 175, 906,
 igr2= 184, 185, 186,
 &end
#
#   31 PHE  QE           11 ILE  QD1         5.50    (#    208:25  Unique         2.59, 4.55 A)
 &rst
  ixpk= 208, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 534, 538,
 igr2= 184, 185, 186,
 &end
#
#   56 PHE  QE           11 ILE  QD1         4.50    (#    209:25  Unique         4.84, 6.80 A)
 &rst
  ixpk= 209, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 947, 951,
 igr2= 184, 185, 186,
 &end
#
#   31 PHE  QD           11 ILE  QD1         5.50    (#    210:25  Unique         3.55, 5.58 A)
 &rst
  ixpk= 210, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 532, 540,
 igr2= 184, 185, 186,
 &end
#
#    0 AMB  25-3:211     11 ILE  QD1         5.50    (#    211:25  Single Ambig)
 &rst
  ixpk= 211, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1350, 455,
 igr2= 184, 185, 186,
 &end
#
#    0 AMB  25-3:212     11 ILE  QD1         4.50    (#    212:25  Single Ambig)
 &rst
  ixpk= 212, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 902, 872, 131, 685,
 igr2= 184, 185, 186,
 &end
#
#   53 PHE  HA           11 ILE  QD1         5.50    (#    213:25  Unique         4.52, 5.90 A)
 &rst
  ixpk= 213, nxpk= 25, iat= 884,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 184, 185, 186,
 &end
#
#    0 AMB  25-3:214     11 ILE  QD1         5.50    (#    214:25  Single Ambig)
 &rst
  ixpk= 214, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 874, 133,
 igr2= 184, 185, 186,
 &end
#
#   69 MET  QE           11 ILE  QD1         5.50    (#    215:25  Unique         4.42, 7.87 A)
 &rst
  ixpk= 215, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1144,1145,1146,
 igr2= 184, 185, 186,
 &end
#
#   54 VAL  QG+          11 ILE  QD1         5.50    (#    217:25  Unique         2.33, 4.69 A)
 &rst
  ixpk= 217, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 184, 185, 186,
 &end
#
#   11 ILE  QD1          11 ILE  QG2         3.50    (#    218:25  Unique         2.25, 3.82 A)
 &rst
  ixpk= 218, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 184, 185, 186,
 igr2= 177, 178, 179,
 &end
#
#    0 AMB  25-3:219     11 ILE  QG2         3.50    (#    219:25  Single Ambig)
 &rst
  ixpk= 219, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 igr2= 177, 178, 179,
 &end
#
#    0 AMB  25-3:220     11 ILE  QG2         2.80    (#    220:25  Single Ambig)
 &rst
  ixpk= 220, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 225, 876, 877, 878,
 igr2= 177, 178, 179,
 &end
#
#    0 AMB  25-3:221     11 ILE  QG2         4.50    (#    221:25  Single Ambig)
 &rst
  ixpk= 221, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 181, 182, 222, 223,
 igr2= 177, 178, 179,
 &end
#
#   11 ILE  HB           11 ILE  QG2         2.80    (#    222:25  Unique         2.14, 2.66 A)
 &rst
  ixpk= 222, nxpk= 25, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 177, 178, 179,
 &end
#
#   79 MET  HB-          11 ILE  QG2         4.50    (#    224:25  Unique         3.12, 5.34 A)
 &rst
  ixpk= 224, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1301,1302,
 igr2= 177, 178, 179,
 &end
#
#    0 AMB  25-3:225     11 ILE  QG2         4.50    (#    225:25  Single Ambig)
 &rst
  ixpk= 225, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1301,1302, 859, 860, 859, 860, 208, 209,
 igr2= 177, 178, 179,
 &end
#
#   79 MET  HG-          11 ILE  QG2         5.50    (#    226:25  Unique         4.29, 5.53 A)
 &rst
  ixpk= 226, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1304,1305,
 igr2= 177, 178, 179,
 &end
#
#   11 ILE  HA           11 ILE  QG2         3.50    (#    227:25  Unique         2.32, 3.24 A)
 &rst
  ixpk= 227, nxpk= 25, iat= 173,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 177, 178, 179,
 &end
#
#    0 AMB  25-3:228     11 ILE  QG2         5.50    (#    228:25  Single Ambig)
 &rst
  ixpk= 228, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1314, 855,
 igr2= 177, 178, 179,
 &end
#
#   52 ALA  HN           11 ILE  QG2         4.50    (#    229:25  Unique         3.52, 4.54 A)
 &rst
  ixpk= 229, nxpk= 25, iat= 872,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 177, 178, 179,
 &end
#
#   12 ASN  HN           11 ILE  QG2         4.50    (#    230:25  Unique         2.25, 3.54 A)
 &rst
  ixpk= 230, nxpk= 25, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 177, 178, 179,
 &end
#
#   12 ASN  HB+          12 ASN  HA          4.50    (#    232:25  Unique         2.39, 2.66 A)
 &rst
  ixpk= 232, nxpk= 25, iat=  -1, 192, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 194, 195,
 &end
#
#   51 GLN  HA           12 ASN  HA          4.50    (#    233:25  Unique         2.05, 2.55 A)
 &rst
  ixpk= 233, nxpk= 25, iat= 857, 192, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13 ASN  HN           12 ASN  HA          4.50    (#    234:25  Unique         2.45, 2.96 A)
 &rst
  ixpk= 234, nxpk= 25, iat= 204, 192, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   41 VAL  HB            0 AMB  25-1:237    5.50    (#    237:25  Single Ambig)
 &rst
  ixpk= 237, nxpk= 25, iat= 689,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 886, 887, 886, 887,
 &end
#
#   12 ASN  HA           12 ASN  HB-         4.50    (#    240:25  Unique         2.39, 2.66 A)
 &rst
  ixpk= 240, nxpk= 25, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 194, 195,
 &end
#
#   12 ASN  HA           12 ASN  HB+         4.50    (#    241:25  Unique         2.39, 2.66 A)
 &rst
  ixpk= 241, nxpk= 25, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 194, 195,
 &end
#
#   53 PHE  QD            0 AMB  25-1:242    5.50    (#    242:25  Single Ambig)
 &rst
  ixpk= 242, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 890, 898,
 igr2= 886, 887, 886, 887,
 &end
#
#   12 ASN  HN           12 ASN  HB-         4.50    (#    243:25  Unique         2.46, 3.24 A)
 &rst
  ixpk= 243, nxpk= 25, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 194, 195,
 &end
#
#    0 AMB  25-3:244      0 AMB  25-1:244    3.50    (#    244:25  Double Ambig)
 &rst
  ixpk= 244, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 882, 190, 685,
 igr2= 886, 887, 886, 887, 194, 195, 886, 887,
 &end
#
#    8 THR  QG2           0 AMB  25-1:245    5.50    (#    245:25  Single Ambig)
 &rst
  ixpk= 245, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 123, 124, 125,
 igr2= 886, 887, 886, 887,
 &end
#
#    0 AMB  25-3:247     13 ASN  HA          5.50    (#    247:25  Single Ambig)
 &rst
  ixpk= 247, nxpk= 25, iat=  -1, 206, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1271,1272,1271,1272,
 &end
#
#    0 AMB  25-3:248     13 ASN  HA          4.50    (#    248:25  Single Ambig)
 &rst
  ixpk= 248, nxpk= 25, iat=  -1, 206, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1318,1319,1265,1266,
 &end
#
#   13 ASN  HB-          13 ASN  HA          4.50    (#    249:25  Unique         2.33, 2.77 A)
 &rst
  ixpk= 249, nxpk= 25, iat=  -1, 206, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 208, 209,
 &end
#
#   15 ASN  HB-          13 ASN  HA          7.00    (#    250:25  Unique         6.99, 7.77 A)
 &rst
  ixpk= 250, nxpk= 25, iat=  -1, 206, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 241, 242,
 &end
#
#   13 ASN  HB+          13 ASN  HA          5.50    (#    251:25  Unique         2.33, 2.77 A)
 &rst
  ixpk= 251, nxpk= 25, iat=  -1, 206, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 208, 209,
 &end
#
#    0 AMB  25-3:252     13 ASN  HA          5.50    (#    252:25  Single Ambig)
 &rst
  ixpk= 252, nxpk= 25, iat=  -1, 206, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 220,1299,
 &end
#
#   14 LEU  HN           13 ASN  HA          4.50    (#    255:25  Unique         2.44, 2.64 A)
 &rst
  ixpk= 255, nxpk= 25, iat= 218, 206, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13 ASN  HN           13 ASN  HA          3.50    (#    257:25  Unique         2.21, 2.68 A)
 &rst
  ixpk= 257, nxpk= 25, iat= 204, 206, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   80 GLN  HB-          13 ASN  HB-         5.50    (#    258:25  Unique         2.16, 3.44 A)
 &rst
  ixpk= 258, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1318,1319,
 igr2= 208, 209,
 &end
#
#    0 AMB  25-3:259      0 AMB  25-1:259    5.50    (#    259:25  Double Ambig)
 &rst
  ixpk= 259, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1318,1319,1318,1319,
 igr2= 208, 209, 208, 209,
 &end
#
#   13 ASN  HA           13 ASN  HB-         4.50    (#    260:25  Unique         2.33, 2.77 A)
 &rst
  ixpk= 260, nxpk= 25, iat= 206,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 208, 209,
 &end
#
#   13 ASN  HD2+         13 ASN  HB-         4.50    (#    261:25  Unique         2.00, 3.22 A)
 &rst
  ixpk= 261, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 213, 214,
 igr2= 208, 209,
 &end
#
#   13 ASN  HD2+         13 ASN  HB+         5.50    (#    262:25  Unique         2.00, 3.22 A)
 &rst
  ixpk= 262, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 213, 214,
 igr2= 208, 209,
 &end
#
#   13 ASN  HD2-         13 ASN  HB-         5.50    (#    263:25  Unique         2.00, 3.22 A)
 &rst
  ixpk= 263, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 213, 214,
 igr2= 208, 209,
 &end
#
#   80 GLN  HA           13 ASN  HB-         5.50    (#    264:25  Unique         4.33, 5.01 A)
 &rst
  ixpk= 264, nxpk= 25, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 208, 209,
 &end
#
#    0 AMB  25-3:265     14 LEU  HA          5.50    (#    265:25  Single Ambig)
 &rst
  ixpk= 265, nxpk= 25, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   14 LEU  HG           14 LEU  HA          3.50    (#    266:25  Unique         2.21, 2.47 A)
 &rst
  ixpk= 266, nxpk= 25, iat= 225, 220, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  25-3:267     14 LEU  HA          5.50    (#    267:25  Single Ambig)
 &rst
  ixpk= 267, nxpk= 25, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1271,1272, 292,
 &end
#
#   14 LEU  HB-          14 LEU  HA          4.50    (#    268:25  Unique         2.50, 2.87 A)
 &rst
  ixpk= 268, nxpk= 25, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 222, 223,
 &end
#
#    0 AMB  25-3:269     14 LEU  HA          5.50    (#    269:25  Single Ambig)
 &rst
  ixpk= 269, nxpk= 25, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 241, 242,1304,1305,
 &end
#
#   14 LEU  HN           14 LEU  HA          5.50    (#    273:25  Unique         2.85, 2.94 A)
 &rst
  ixpk= 273, nxpk= 25, iat= 218, 220, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 ASN  HN           14 LEU  HA          4.50    (#    274:25  Unique         2.05, 2.37 A)
 &rst
  ixpk= 274, nxpk= 25, iat= 237, 220, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:275     14 LEU  HB-         3.50    (#    275:25  Single Ambig)
 &rst
  ixpk= 275, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 igr2= 222, 223,
 &end
#
#    0 AMB  25-3:276      0 AMB  25-1:276    5.50    (#    276:25  Double Ambig)
 &rst
  ixpk= 276, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 igr2= 222, 223, 222, 223,
 &end
#
#   14 LEU  HN           14 LEU  HB+         5.50    (#    277:25  Unique         2.06, 2.64 A)
 &rst
  ixpk= 277, nxpk= 25, iat= 218,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 222, 223,
 &end
#
#    0 AMB  25-3:278      0 AMB  25-1:278    5.50    (#    278:25  Double Ambig)
 &rst
  ixpk= 278, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 532, 540,1216,1224,
 igr2= 459, 460, 222, 223,
 &end
#
#    0 AMB  25-3:279      0 AMB  25-1:279    5.50    (#    279:25  Double Ambig)
 &rst
  ixpk= 279, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 288, 534, 538, 484, 489,
 igr2= 222, 223, 459, 460,
 &end
#
#    0 AMB  25-3:280     14 LEU  HG          2.80    (#    280:25  Single Ambig)
 &rst
  ixpk= 280, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   11 ILE  QG2          14 LEU  HG          2.80    (#    281:25  Unique         2.56, 3.55 A)
 &rst
  ixpk= 281, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 177, 178, 179,
 &end
#
#   14 LEU  HB-          14 LEU  HG          2.80    (#    282:25  Unique         2.30, 2.77 A)
 &rst
  ixpk= 282, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 222, 223,
 &end
#
#   14 LEU  HB+          14 LEU  HG          2.80    (#    283:25  Unique         2.30, 2.77 A)
 &rst
  ixpk= 283, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 222, 223,
 &end
#
#   23 LEU  HB+          14 LEU  HG          5.50    (#    284:25  Unique         5.47, 6.49 A)
 &rst
  ixpk= 284, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 385, 386,
 &end
#
#   14 LEU  HA           14 LEU  HG          3.50    (#    285:25  Unique         2.21, 2.47 A)
 &rst
  ixpk= 285, nxpk= 25, iat= 220, 225, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   74 PHE  QE           14 LEU  HG          5.50    (#    287:25  Unique         2.85, 5.74 A)
 &rst
  ixpk= 287, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1218,1222,
 &end
#
#   74 PHE  QD           14 LEU  HG          4.50    (#    288:25  Unique         3.12, 5.63 A)
 &rst
  ixpk= 288, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1216,1224,
 &end
#
#    0 AMB  25-3:289     14 LEU  HG          5.50    (#    289:25  Single Ambig)
 &rst
  ixpk= 289, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1265,1266,1301,1302,
 &end
#
#    0 AMB  25-3:290     14 LEU  HG          5.50    (#    290:25  Single Ambig)
 &rst
  ixpk= 290, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1271,1272,1341,1342,1341,1342,
 &end
#
#    0 AMB  25-3:291      0 AMB  25-1:291    4.50    (#    291:25  Double Ambig)
 &rst
  ixpk= 291, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1= 294, 295, 296, 184, 185, 186,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#    0 AMB  25-3:292      0 AMB  25-1:292    3.50    (#    292:25  Double Ambig)
 &rst
  ixpk= 292, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 298, 299, 298, 299, 298, 299, 177, 178, 179,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#    0 AMB  25-3:293      0 AMB  25-1:293    2.80    (#    293:25  Double Ambig)
 &rst
  ixpk= 293, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 225, 876, 877, 878,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   14 LEU  HB-           0 AMB  25-1:294    3.50    (#    294:25  Single Ambig)
 &rst
  ixpk= 294, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 222, 223,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#    0 AMB  25-3:295      0 AMB  25-1:295    3.50    (#    295:25  Double Ambig)
 &rst
  ixpk= 295, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 222, 223, 222, 223,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#    0 AMB  25-3:296      0 AMB  25-1:296    4.50    (#    296:25  Double Ambig)
 &rst
  ixpk= 296, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 292, 388, 385, 386,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   12 ASN  HA            0 AMB  25-1:298    5.50    (#    298:25  Single Ambig)
 &rst
  ixpk= 298, nxpk= 25, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   52 ALA  HN            0 AMB  25-1:299    4.50    (#    299:25  Single Ambig)
 &rst
  ixpk= 299, nxpk= 25, iat= 872,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   15 ASN  HB+          15 ASN  HA          4.50    (#    301:25  Unique         2.31, 2.77 A)
 &rst
  ixpk= 301, nxpk= 25, iat=  -1, 239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 241, 242,
 &end
#
#    0 AMB  25-3:302     15 ASN  HA          4.50    (#    302:25  Single Ambig)
 &rst
  ixpk= 302, nxpk= 25, iat=  -1, 239, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1274,1275, 241, 242,
 &end
#
#   77 LYS  HD-          15 ASN  HA          4.50    (#    303:25  Unique         2.03, 3.08 A)
 &rst
  ixpk= 303, nxpk= 25, iat=  -1, 239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1271,1272,
 &end
#
#   77 LYS  HD+          15 ASN  HA          4.50    (#    304:25  Unique         2.03, 3.08 A)
 &rst
  ixpk= 304, nxpk= 25, iat=  -1, 239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1271,1272,
 &end
#
#    0 AMB  25-3:305     15 ASN  HA          2.80    (#    305:25  Single Ambig)
 &rst
  ixpk= 305, nxpk= 25, iat=  -1, 239, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 251, 237,
 &end
#
#   17 LYS  HN           15 ASN  HA          5.50    (#    306:25  Unique         4.03, 4.23 A)
 &rst
  ixpk= 306, nxpk= 25, iat= 266, 239, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 ASN  HA           15 ASN  HB+         5.50    (#    309:25  Unique         2.31, 2.77 A)
 &rst
  ixpk= 309, nxpk= 25, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 241, 242,
 &end
#
#   15 ASN  HA           15 ASN  HB-         5.50    (#    310:25  Unique         2.31, 2.77 A)
 &rst
  ixpk= 310, nxpk= 25, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 241, 242,
 &end
#
#    0 AMB  25-3:312      0 AMB  25-1:312    5.50    (#    312:25  Double Ambig)
 &rst
  ixpk= 312, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 237, 251,
 igr2= 241, 242, 241, 242,
 &end
#
#    0 AMB  25-3:313     15 ASN  HB-         5.50    (#    313:25  Single Ambig)
 &rst
  ixpk= 313, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 237, 251,
 igr2= 241, 242,
 &end
#
#   17 LYS  HN           15 ASN  HB+         5.50    (#    314:25  Unique         3.45, 4.49 A)
 &rst
  ixpk= 314, nxpk= 25, iat= 266,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 241, 242,
 &end
#
#   16 GLU  HN           16 GLU  HA          4.50    (#    315:25  Unique         2.22, 2.69 A)
 &rst
  ixpk= 315, nxpk= 25, iat= 251, 253, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:317     16 GLU  HA          2.80    (#    317:25  Single Ambig)
 &rst
  ixpk= 317, nxpk= 25, iat=  -1, 253, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 255, 256, 258, 259,
 &end
#
#   17 LYS  HN           16 GLU  HA          5.50    (#    320:25  Unique         2.93, 3.37 A)
 &rst
  ixpk= 320, nxpk= 25, iat= 266, 253, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:321      0 AMB  25-1:321    3.50    (#    321:25  Double Ambig)
 &rst
  ixpk= 321, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 102, 368,
 igr2= 104, 105, 370, 371,
 &end
#
#    0 AMB  25-3:323      0 AMB  25-1:323    5.50    (#    323:25  Double Ambig)
 &rst
  ixpk= 323, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.76, r4=11.26,
 igr1= 385, 386, 928, 929, 292, 429, 430,
 igr2= 370, 371, 104, 105, 370, 371, 370, 371,
 &end
#
#   18 ILE  QG2          22 GLU  HB+         5.50    (#    324:25  Unique         2.27, 3.25 A)
 &rst
  ixpk= 324, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 294, 295, 296,
 igr2= 370, 371,
 &end
#
#   22 GLU  HN           22 GLU  HB+         3.50    (#    325:25  Unique         2.07, 2.97 A)
 &rst
  ixpk= 325, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 370, 371,
 &end
#
#    0 AMB  25-3:326      0 AMB  25-1:326    4.50    (#    326:25  Double Ambig)
 &rst
  ixpk= 326, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 100, 381,
 igr2= 104, 105, 370, 371,
 &end
#
#    0 AMB  25-3:327      0 AMB  25-1:327    4.50    (#    327:25  Double Ambig)
 &rst
  ixpk= 327, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 102, 368,
 igr2= 104, 105, 370, 371,
 &end
#
#    0 AMB  25-3:328      0 AMB  25-1:328    4.50    (#    328:25  Double Ambig)
 &rst
  ixpk= 328, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1316, 981,
 igr2=1318,1319, 104, 105,
 &end
#
#   22 GLU  HN           22 GLU  HB-         4.50    (#    329:25  Unique         2.07, 2.97 A)
 &rst
  ixpk= 329, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 370, 371,
 &end
#
#    0 AMB  25-3:330      0 AMB  25-1:330    5.50    (#    330:25  Double Ambig)
 &rst
  ixpk= 330, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1314,1162,1163,
 igr2=1318,1319,1318,1319,
 &end
#
#   36 GLN  HA           36 GLN  HB+         4.50    (#    331:25  Unique         2.22, 2.74 A)
 &rst
  ixpk= 331, nxpk= 25, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 603, 604,
 &end
#
#   36 GLN  HA           36 GLN  HB-         4.50    (#    332:25  Unique         2.22, 2.74 A)
 &rst
  ixpk= 332, nxpk= 25, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 603, 604,
 &end
#
#    0 AMB  25-3:334      0 AMB  25-1:334    5.50    (#    334:25  Double Ambig)
 &rst
  ixpk= 334, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 268, 768, 787,
 igr2= 255, 256, 255, 256, 255, 256,
 &end
#
#    0 AMB  25-3:335      0 AMB  25-1:335    5.50    (#    335:25  Double Ambig)
 &rst
  ixpk= 335, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 599, 266,
 igr2= 603, 604, 255, 256,
 &end
#
#    0 AMB  25-3:336      0 AMB  25-1:336    4.50    (#    336:25  Double Ambig)
 &rst
  ixpk= 336, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 599, 266,
 igr2= 603, 604, 255, 256,
 &end
#
#   36 GLN  HG-          36 GLN  HB+         5.50    (#    337:25  Unique         2.32, 2.60 A)
 &rst
  ixpk= 337, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 606, 607,
 igr2= 603, 604,
 &end
#
#   36 GLN  HG-          36 GLN  HB-         5.50    (#    338:25  Unique         2.32, 2.60 A)
 &rst
  ixpk= 338, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 606, 607,
 igr2= 603, 604,
 &end
#
#    0 AMB  25-3:339      0 AMB  25-1:339    4.50    (#    339:25  Double Ambig)
 &rst
  ixpk= 339, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 601, 239,
 igr2= 603, 604, 255, 256,
 &end
#
#    0 AMB  25-3:340      0 AMB  25-1:340    5.50    (#    340:25  Double Ambig)
 &rst
  ixpk= 340, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1314,1162,1163,
 igr2=1318,1319,1318,1319,
 &end
#
#    0 AMB  25-3:341      0 AMB  25-1:341    4.50    (#    341:25  Double Ambig)
 &rst
  ixpk= 341, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.02, r4= 8.52,
 igr1= 967, 968, 967, 968, 831, 832, 831, 832,
 igr2= 603, 604, 255, 256,
 &end
#
#   16 GLU  HB+          16 GLU  HG+         2.80    (#    342:25  Unique         2.17, 2.70 A)
 &rst
  ixpk= 342, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 255, 256,
 igr2= 258, 259,
 &end
#
#   16 GLU  HB+          16 GLU  HG-         2.80    (#    343:25  Unique         2.17, 2.70 A)
 &rst
  ixpk= 343, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 255, 256,
 igr2= 258, 259,
 &end
#
#    0 AMB  25-3:344      0 AMB  25-1:344    4.50    (#    344:25  Double Ambig)
 &rst
  ixpk= 344, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 850, 851, 253,
 igr2= 258, 259, 258, 259,
 &end
#
#    0 AMB  25-3:345     16 GLU  HG-         3.50    (#    345:25  Single Ambig)
 &rst
  ixpk= 345, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 850, 851, 253,
 igr2= 258, 259,
 &end
#
#   16 GLU  HN           16 GLU  HG+         5.50    (#    346:25  Unique         2.08, 3.20 A)
 &rst
  ixpk= 346, nxpk= 25, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 258, 259,
 &end
#
#   16 GLU  HN           16 GLU  HG-         5.50    (#    347:25  Unique         2.08, 3.20 A)
 &rst
  ixpk= 347, nxpk= 25, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 258, 259,
 &end
#
#   17 LYS  HN           17 LYS  HA          3.50    (#    350:25  Unique         2.79, 2.90 A)
 &rst
  ixpk= 350, nxpk= 25, iat= 266, 268, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  25-3:351      0 AMB  25-1:351    4.50    (#    351:25  Double Ambig)
 &rst
  ixpk= 351, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 311, 312, 255, 256, 333, 334,
 igr2= 309, 268,
 &end
#
#    0 AMB  25-3:352      0 AMB  25-1:352    2.80    (#    352:25  Double Ambig)
 &rst
  ixpk= 352, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 270, 271, 311, 312,
 igr2= 268, 309,
 &end
#
#    0 AMB  25-3:353     17 LYS  HA          3.50    (#    353:25  Single Ambig)
 &rst
  ixpk= 353, nxpk= 25, iat=  -1, 268, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 831, 832, 831, 832, 276, 277, 276, 277,
 &end
#
#   17 LYS  HG-          17 LYS  HA          3.50    (#    354:25  Unique         3.66, 3.89 A)
 &rst
  ixpk= 354, nxpk= 25, iat=  -1, 268, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 273, 274,
 &end
#
#    0 AMB  25-3:356      0 AMB  25-1:356    4.50    (#    356:25  Double Ambig)
 &rst
  ixpk= 356, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 402, 290,
 igr2= 404, 405, 270, 271,
 &end
#
#   17 LYS  HN           17 LYS  HB-         4.50    (#    357:25  Unique         2.05, 3.35 A)
 &rst
  ixpk= 357, nxpk= 25, iat= 266,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 270, 271,
 &end
#
#    0 AMB  25-3:358      0 AMB  25-1:358    4.50    (#    358:25  Double Ambig)
 &rst
  ixpk= 358, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.63, r4=10.13,
 igr1= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726, 298, 299, 298, 299,
 igr2= 342, 343, 279, 280, 279, 280,
 &end
#
#    0 AMB  25-3:361      0 AMB  25-1:361    3.50    (#    361:25  Double Ambig)
 &rst
  ixpk= 361, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
 igr1= 426, 427, 426, 427, 426, 427, 961, 962, 961, 962,
      
 igr2= 435, 436, 435, 436, 435, 436, 970, 971, 970, 971,
      
 &end
#
#    0 AMB  25-3:363      0 AMB  25-1:363    3.50    (#    363:25  Double Ambig)
 &rst
  ixpk= 363, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 258, 259, 258, 259, 358, 359,
 igr2= 279, 280, 279, 280, 413, 414, 413, 414, 435, 436,
      
 &end
#
#    0 AMB  25-3:364      0 AMB  25-1:364    3.50    (#    364:25  Double Ambig)
 &rst
  ixpk= 364, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
 igr1=1364,1365,  90,  91,  90,  91,  90,  91,
 igr2=1405,1406,1405,1406,1405,1406,1405,1406,
 &end
#
#   18 ILE  QD1          18 ILE  HA          3.50    (#    369:25  Unique         2.13, 3.11 A)
 &rst
  ixpk= 369, nxpk= 25, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 301, 302, 303,
 &end
#
#   18 ILE  QG2          18 ILE  HA          3.50    (#    370:25  Unique         2.57, 3.25 A)
 &rst
  ixpk= 370, nxpk= 25, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 294, 295, 296,
 &end
#
#    0 AMB  25-3:371     18 ILE  HA          4.50    (#    371:25  Single Ambig)
 &rst
  ixpk= 371, nxpk= 25, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 292, 314, 315,
 &end
#
#   19 LYS  HN           18 ILE  HA          2.80    (#    372:25  Unique         1.94, 2.17 A)
 &rst
  ixpk= 372, nxpk= 25, iat= 307, 290, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   18 ILE  QD1          18 ILE  HB          4.50    (#    373:25  Unique         2.41, 3.94 A)
 &rst
  ixpk= 373, nxpk= 25, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 301, 302, 303,
 &end
#
#   18 ILE  QG2          18 ILE  HB          3.50    (#    374:25  Unique         2.28, 2.65 A)
 &rst
  ixpk= 374, nxpk= 25, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 294, 295, 296,
 &end
#
#    0 AMB  25-3:375     18 ILE  HB          3.50    (#    375:25  Single Ambig)
 &rst
  ixpk= 375, nxpk= 25, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 298, 299, 298, 299,
 &end
#
#   23 LEU  QD2          18 ILE  HB          5.50    (#    376:25  Unique         4.48, 5.97 A)
 &rst
  ixpk= 376, nxpk= 25, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 394, 395, 396,
 &end
#
#   18 ILE  HN           18 ILE  HB          4.50    (#    377:25  Unique         2.29, 2.44 A)
 &rst
  ixpk= 377, nxpk= 25, iat= 288, 292, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   18 ILE  QD1           0 AMB  25-1:379    3.50    (#    379:25  Single Ambig)
 &rst
  ixpk= 379, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 301, 302, 303,
 igr2= 298, 299, 298, 299,
 &end
#
#   18 ILE  QD1          18 ILE  HG1+        3.50    (#    380:25  Unique         2.22, 2.66 A)
 &rst
  ixpk= 380, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 301, 302, 303,
 igr2= 298, 299,
 &end
#
#   18 ILE  HB            0 AMB  25-1:381    3.50    (#    381:25  Single Ambig)
 &rst
  ixpk= 381, nxpk= 25, iat= 292,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 298, 299, 298, 299,
 &end
#
#    0 AMB  25-3:382      0 AMB  25-1:382    2.80    (#    382:25  Double Ambig)
 &rst
  ixpk= 382, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr1= 388, 292, 385, 386,
 igr2= 390, 391, 392, 298, 299,
 &end
#
#   18 ILE  QG2          18 ILE  QD1         2.80    (#    383:25  Unique         2.25, 3.75 A)
 &rst
  ixpk= 383, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 294, 295, 296,
 igr2= 301, 302, 303,
 &end
#
#    0 AMB  25-3:384     18 ILE  QD1         3.50    (#    384:25  Single Ambig)
 &rst
  ixpk= 384, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 298, 299, 298, 299,
 igr2= 301, 302, 303,
 &end
#
#   18 ILE  HB           18 ILE  QD1         4.50    (#    385:25  Unique         2.41, 3.94 A)
 &rst
  ixpk= 385, nxpk= 25, iat= 292,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 301, 302, 303,
 &end
#
#    0 AMB  25-3:386     18 ILE  QD1         5.50    (#    386:25  Single Ambig)
 &rst
  ixpk= 386, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 385, 386, 270, 271,
 igr2= 301, 302, 303,
 &end
#
#   15 ASN  HB-          18 ILE  QD1         5.50    (#    387:25  Unique         2.39, 4.75 A)
 &rst
  ixpk= 387, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 241, 242,
 igr2= 301, 302, 303,
 &end
#
#   18 ILE  HA           18 ILE  QD1         3.50    (#    388:25  Unique         2.13, 3.11 A)
 &rst
  ixpk= 388, nxpk= 25, iat= 290,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 301, 302, 303,
 &end
#
#   75 TYR  QD           18 ILE  QD1         4.50    (#    389:25  Unique         2.90, 4.47 A)
 &rst
  ixpk= 389, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1236,1245,
 igr2= 301, 302, 303,
 &end
#
#   75 TYR  QE           18 ILE  QD1         5.50    (#    390:25  Unique         2.83, 4.61 A)
 &rst
  ixpk= 390, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1238,1243,
 igr2= 301, 302, 303,
 &end
#
#   18 ILE  HN           18 ILE  QD1         4.50    (#    391:25  Unique         3.32, 4.18 A)
 &rst
  ixpk= 391, nxpk= 25, iat= 288,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 301, 302, 303,
 &end
#
#   19 LYS  HN           18 ILE  QD1         5.50    (#    392:25  Unique         3.66, 4.86 A)
 &rst
  ixpk= 392, nxpk= 25, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 301, 302, 303,
 &end
#
#    0 AMB  25-3:395     18 ILE  QG2         3.50    (#    395:25  Single Ambig)
 &rst
  ixpk= 395, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 298, 299, 298, 299,
 igr2= 294, 295, 296,
 &end
#
#   23 LEU  QD2          18 ILE  QG2         4.50    (#    396:25  Unique         3.56, 5.49 A)
 &rst
  ixpk= 396, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 394, 395, 396,
 igr2= 294, 295, 296,
 &end
#
#    0 AMB  25-3:397     18 ILE  QG2         2.80    (#    397:25  Single Ambig)
 &rst
  ixpk= 397, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 292, 385, 386,
 igr2= 294, 295, 296,
 &end
#
#   23 LEU  HB+          18 ILE  QG2         4.50    (#    398:25  Unique         2.31, 3.71 A)
 &rst
  ixpk= 398, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 385, 386,
 igr2= 294, 295, 296,
 &end
#
#   22 GLU  HB-          18 ILE  QG2         3.50    (#    399:25  Unique         2.27, 3.25 A)
 &rst
  ixpk= 399, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 370, 371,
 igr2= 294, 295, 296,
 &end
#
#   22 GLU  HG-          18 ILE  QG2         5.50    (#    400:25  Unique         4.04, 5.45 A)
 &rst
  ixpk= 400, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 373, 374,
 igr2= 294, 295, 296,
 &end
#
#   18 ILE  HA           18 ILE  QG2         3.50    (#    401:25  Unique         2.57, 3.25 A)
 &rst
  ixpk= 401, nxpk= 25, iat= 290,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 294, 295, 296,
 &end
#
#   23 LEU  HA           18 ILE  QG2         5.50    (#    402:25  Unique         2.98, 3.66 A)
 &rst
  ixpk= 402, nxpk= 25, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 294, 295, 296,
 &end
#
#    0 AMB  25-3:403     18 ILE  QG2         5.50    (#    403:25  Single Ambig)
 &rst
  ixpk= 403, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 309, 368,
 igr2= 294, 295, 296,
 &end
#
#   75 TYR  QE           18 ILE  QG2         4.50    (#    405:25  Unique         2.39, 4.95 A)
 &rst
  ixpk= 405, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1238,1243,
 igr2= 294, 295, 296,
 &end
#
#   23 LEU  HN           18 ILE  QG2         3.50    (#    406:25  Unique         2.58, 3.42 A)
 &rst
  ixpk= 406, nxpk= 25, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 294, 295, 296,
 &end
#
#    0 AMB  25-3:408     18 ILE  QG2         5.50    (#    408:25  Single Ambig)
 &rst
  ixpk= 408, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 329, 455,
 igr2= 294, 295, 296,
 &end
#
#   15 ASN  HN           18 ILE  QG2         5.50    (#    409:25  Unique         4.72, 6.13 A)
 &rst
  ixpk= 409, nxpk= 25, iat= 237,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 294, 295, 296,
 &end
#
#   18 ILE  HN           18 ILE  QG2         5.50    (#    410:25  Unique         4.31, 4.54 A)
 &rst
  ixpk= 410, nxpk= 25, iat= 288,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 294, 295, 296,
 &end
#
#   18 ILE  QD1          18 ILE  QG2         2.80    (#    411:25  Unique         2.25, 3.75 A)
 &rst
  ixpk= 411, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 301, 302, 303,
 igr2= 294, 295, 296,
 &end
#
#   19 LYS  HN           18 ILE  QG2         4.50    (#    412:25  Unique         3.00, 3.72 A)
 &rst
  ixpk= 412, nxpk= 25, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 294, 295, 296,
 &end
#
#   37 ILE  HN           36 GLN  HA          4.50    (#    413:25  Unique         2.01, 2.08 A)
 &rst
  ixpk= 413, nxpk= 25, iat= 616, 601, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   36 GLN  HG-          36 GLN  HA          4.50    (#    414:25  Unique         2.31, 3.43 A)
 &rst
  ixpk= 414, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 606, 607,
 &end
#
#   36 GLN  HB-          36 GLN  HA          3.50    (#    415:25  Unique         2.22, 2.74 A)
 &rst
  ixpk= 415, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 603, 604,
 &end
#
#   36 GLN  HG+          36 GLN  HA          4.50    (#    416:25  Unique         2.31, 3.43 A)
 &rst
  ixpk= 416, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 606, 607,
 &end
#
#   36 GLN  HB+          36 GLN  HA          5.50    (#    417:25  Unique         2.22, 2.74 A)
 &rst
  ixpk= 417, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 603, 604,
 &end
#
#   37 ILE  HB           36 GLN  HA          5.50    (#    418:25  Unique         4.15, 4.31 A)
 &rst
  ixpk= 418, nxpk= 25, iat= 620, 601, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:420      0 AMB  25-1:420    2.80    (#    420:25  Double Ambig)
 &rst
  ixpk= 420, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 429, 430, 429, 430, 314, 315, 432, 433, 432, 433,
       432, 433,
 igr2= 426, 427, 426, 427, 311, 312, 426, 427, 426, 427,
      
 &end
#
#    0 AMB  25-3:422      0 AMB  25-1:422    3.50    (#    422:25  Double Ambig)
 &rst
  ixpk= 422, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 424, 309, 368,
 igr2= 426, 427, 426, 427, 311, 312, 426, 427,
 &end
#
#   22 GLU  HN           19 LYS  HB+         4.50    (#    424:25  Unique         2.04, 3.24 A)
 &rst
  ixpk= 424, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 311, 312,
 &end
#
#    0 AMB  25-3:425      0 AMB  25-1:425    5.50    (#    425:25  Double Ambig)
 &rst
  ixpk= 425, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 307, 444,
 igr2= 311, 312, 426, 427, 426, 427,
 &end
#
#   20 LYS  HN           19 LYS  HB+         5.50    (#    426:25  Unique         2.12, 3.76 A)
 &rst
  ixpk= 426, nxpk= 25, iat= 329,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 311, 312,
 &end
#
#    0 AMB  25-3:427      0 AMB  25-1:427    2.80    (#    427:25  Double Ambig)
 &rst
  ixpk= 427, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 317, 318, 317, 318,
 igr2= 314, 315, 314, 315,
 &end
#
#    0 AMB  25-3:428     19 LYS  HG-         2.80    (#    428:25  Single Ambig)
 &rst
  ixpk= 428, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 317, 318, 317, 318,
 igr2= 314, 315,
 &end
#
#    0 AMB  25-3:429     19 LYS  HG-         3.50    (#    429:25  Single Ambig)
 &rst
  ixpk= 429, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 311, 312, 355, 356, 355, 356,
 igr2= 314, 315,
 &end
#
#    0 AMB  25-3:430      0 AMB  25-1:430    2.80    (#    430:25  Double Ambig)
 &rst
  ixpk= 430, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 426, 427, 426, 427, 311, 312, 355, 356, 355, 356,
      
 igr2= 429, 430, 429, 430, 314, 315, 314, 315, 314, 315,
      
 &end
#
#    0 AMB  25-3:431     19 LYS  HG-         4.50    (#    431:25  Single Ambig)
 &rst
  ixpk= 431, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 320, 321, 320, 321,
 igr2= 314, 315,
 &end
#
#    0 AMB  25-3:432      0 AMB  25-1:432    5.50    (#    432:25  Double Ambig)
 &rst
  ixpk= 432, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 320, 321, 320, 321,
 igr2= 314, 315, 314, 315,
 &end
#
#   19 LYS  HA           19 LYS  HG-         4.50    (#    433:25  Unique         2.37, 2.84 A)
 &rst
  ixpk= 433, nxpk= 25, iat= 309,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 314, 315,
 &end
#
#    0 AMB  25-3:434      0 AMB  25-1:434    4.50    (#    434:25  Double Ambig)
 &rst
  ixpk= 434, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 424, 309,
 igr2= 429, 430, 314, 315,
 &end
#
#   19 LYS  HN           19 LYS  HG-         5.50    (#    436:25  Unique         2.35, 4.22 A)
 &rst
  ixpk= 436, nxpk= 25, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 314, 315,
 &end
#
#    0 AMB  25-3:437      0 AMB  25-1:437    5.50    (#    437:25  Double Ambig)
 &rst
  ixpk= 437, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 307, 444,
 igr2= 314, 315, 429, 430,
 &end
#
#    0 AMB  25-3:438      0 AMB  25-1:438    2.80    (#    438:25  Double Ambig)
 &rst
  ixpk= 438, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 311, 312, 311, 312, 355, 356, 355, 356,
 igr2= 317, 318, 317, 318, 317, 318,
 &end
#
#    0 AMB  25-3:439      0 AMB  25-1:439    2.80    (#    439:25  Double Ambig)
 &rst
  ixpk= 439, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 320, 321, 320, 321, 320, 321,
 igr2= 317, 318, 317, 318, 317, 318,
 &end
#
#   19 LYS  HA            0 AMB  25-1:440    5.50    (#    440:25  Single Ambig)
 &rst
  ixpk= 440, nxpk= 25, iat= 309,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 317, 318, 317, 318,
 &end
#
#   19 LYS  HN            0 AMB  25-1:441    5.50    (#    441:25  Single Ambig)
 &rst
  ixpk= 441, nxpk= 25, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 317, 318, 317, 318,
 &end
#
#    0 AMB  25-3:446      0 AMB  25-1:446    2.80    (#    446:25  Double Ambig)
 &rst
  ixpk= 446, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 317, 318, 317, 318, 317, 318,
 igr2= 320, 321, 320, 321, 320, 321,
 &end
#
#   98 PHE  HN           99 LYS  HE-         7.00    (#    451:25  Unique         5.96, 7.56 A)
 &rst
  ixpk= 451, nxpk= 25, iat=1589,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1622,1623,
 &end
#
#    0 AMB  25-3:453     20 LYS  HA          3.50    (#    453:25  Single Ambig)
 &rst
  ixpk= 453, nxpk= 25, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 336, 337, 388,
 &end
#
#    0 AMB  25-3:454     20 LYS  HA          4.50    (#    454:25  Single Ambig)
 &rst
  ixpk= 454, nxpk= 25, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 339, 340, 407, 408, 314, 315,
 &end
#
#    0 AMB  25-3:455     20 LYS  HA          3.50    (#    455:25  Single Ambig)
 &rst
  ixpk= 455, nxpk= 25, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 385, 386, 333, 334,
 &end
#
#   20 LYS  HB+          20 LYS  HA          4.50    (#    456:25  Unique         2.36, 2.79 A)
 &rst
  ixpk= 456, nxpk= 25, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 333, 334,
 &end
#
#    0 AMB  25-3:457     20 LYS  HA          5.50    (#    457:25  Single Ambig)
 &rst
  ixpk= 457, nxpk= 25, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 311, 312, 370, 371, 370, 371, 355, 356, 355, 356,
      
 &end
#
#    0 AMB  25-3:458     20 LYS  HA          5.50    (#    458:25  Single Ambig)
 &rst
  ixpk= 458, nxpk= 25, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 381, 400,
 &end
#
#    0 AMB  25-3:459      0 AMB  25-1:459    4.50    (#    459:25  Double Ambig)
 &rst
  ixpk= 459, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 314, 315, 407, 408, 715, 716,
 igr2= 333, 334, 333, 334, 333, 334,
 &end
#
#    0 AMB  25-3:460      0 AMB  25-1:460    4.50    (#    460:25  Double Ambig)
 &rst
  ixpk= 460, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 336, 337, 737, 738,
 igr2= 333, 334, 333, 334,
 &end
#
#    0 AMB  25-3:461     20 LYS  HB-         3.50    (#    461:25  Single Ambig)
 &rst
  ixpk= 461, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 336, 337, 314, 315,
 igr2= 333, 334,
 &end
#
#   20 LYS  HA           20 LYS  HB-         4.50    (#    462:25  Unique         2.36, 2.79 A)
 &rst
  ixpk= 462, nxpk= 25, iat= 331,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 333, 334,
 &end
#
#   20 LYS  HA           20 LYS  HB+         5.50    (#    464:25  Unique         2.36, 2.79 A)
 &rst
  ixpk= 464, nxpk= 25, iat= 331,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 333, 334,
 &end
#
#    0 AMB  25-3:466     58 GLU  HB-         4.50    (#    466:25  Single Ambig)
 &rst
  ixpk= 466, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1004,1005,1007,1008,1009,
 igr2= 983, 984,
 &end
#
#   23 LEU  QD2          20 LYS  HG+         5.50    (#    468:25  Unique         6.72, 7.57 A)
 &rst
  ixpk= 468, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 394, 395, 396,
 igr2= 336, 337,
 &end
#
#    0 AMB  25-3:469      0 AMB  25-1:469    3.50    (#    469:25  Double Ambig)
 &rst
  ixpk= 469, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 333, 334, 404, 405,
 igr2= 336, 337, 336, 337,
 &end
#
#    0 AMB  25-3:470      0 AMB  25-1:470    3.50    (#    470:25  Double Ambig)
 &rst
  ixpk= 470, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 342, 343, 413, 414, 413, 414,
 igr2= 336, 337, 336, 337, 336, 337,
 &end
#
#   77 LYS  HA            0 AMB  25-1:474    5.50    (#    474:25  Single Ambig)
 &rst
  ixpk= 474, nxpk= 25, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1268,1269,1268,1269,
 &end
#
#    0 AMB  25-3:478      0 AMB  25-1:478    5.50    (#    478:25  Double Ambig)
 &rst
  ixpk= 478, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 258, 259, 258, 259,
 igr2= 276, 277, 276, 277,
 &end
#
#    0 AMB  25-3:480      0 AMB  25-1:480    3.50    (#    480:25  Double Ambig)
 &rst
  ixpk= 480, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 687, 309, 268,
 igr2= 339, 340, 339, 340, 339, 340, 276, 277, 276, 277,
      
 &end
#
#   15 ASN  HB-           0 AMB  25-1:483    5.50    (#    483:25  Single Ambig)
 &rst
  ixpk= 483, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 241, 242,
 igr2= 276, 277, 276, 277,
 &end
#
#   72 PHE  HB-          74 PHE  HB-         4.50    (#    485:25  Unique         3.41, 5.48 A)
 &rst
  ixpk= 485, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1178,1179,
 igr2=1212,1213,
 &end
#
#    0 AMB  25-3:486      0 AMB  25-1:486    2.80    (#    486:25  Double Ambig)
 &rst
  ixpk= 486, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 743, 744, 743, 744, 743, 744,
 igr2= 320, 321, 320, 321, 320, 321,
 &end
#
#    0 AMB  25-3:488      0 AMB  25-1:488    2.80    (#    488:25  Double Ambig)
 &rst
  ixpk= 488, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 317, 318, 317, 318, 317, 318,
 igr2= 320, 321, 320, 321, 320, 321,
 &end
#
#  100 GLU  HB-          99 LYS  HE-         4.50    (#    489:25  Unique         2.25, 5.67 A)
 &rst
  ixpk= 489, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1635,1636,
 igr2=1622,1623,
 &end
#
#   21 GLU  HG+          21 GLU  HA          4.50    (#    490:25  Unique         1.99, 3.02 A)
 &rst
  ixpk= 490, nxpk= 25, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 358, 359,
 &end
#
#    0 AMB  25-3:491     21 GLU  HA          2.80    (#    491:25  Single Ambig)
 &rst
  ixpk= 491, nxpk= 25, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 355, 356, 355, 356,
 &end
#
#   24 LYS  HB-          21 GLU  HA          4.50    (#    492:25  Unique         1.88, 3.28 A)
 &rst
  ixpk= 492, nxpk= 25, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 404, 405,
 &end
#
#   21 GLU  HN           21 GLU  HA          5.50    (#    493:25  Unique         2.79, 2.83 A)
 &rst
  ixpk= 493, nxpk= 25, iat= 351, 353, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 LEU  HN           21 GLU  HA          5.50    (#    494:25  Unique         4.19, 4.64 A)
 &rst
  ixpk= 494, nxpk= 25, iat= 381, 353, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:495     21 GLU  HB-         2.80    (#    495:25  Single Ambig)
 &rst
  ixpk= 495, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 358, 359, 358, 359,
 igr2= 355, 356,
 &end
#
#    0 AMB  25-3:496      0 AMB  25-1:496    2.80    (#    496:25  Double Ambig)
 &rst
  ixpk= 496, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 358, 359, 358, 359,
 igr2= 355, 356, 355, 356,
 &end
#
#    0 AMB  25-3:497      0 AMB  25-1:497    2.80    (#    497:25  Double Ambig)
 &rst
  ixpk= 497, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 311, 312, 404, 405, 333, 334,
 igr2= 370, 371, 355, 356, 355, 356, 355, 356,
 &end
#
#    0 AMB  25-3:498      0 AMB  25-1:498    3.50    (#    498:25  Double Ambig)
 &rst
  ixpk= 498, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 404, 405, 333, 334,
 igr2= 355, 356, 370, 371,
 &end
#
#   21 GLU  HA           21 GLU  HB-         2.80    (#    499:25  Unique         2.14, 2.72 A)
 &rst
  ixpk= 499, nxpk= 25, iat= 353,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 355, 356,
 &end
#
#   21 GLU  HA           21 GLU  HB+         2.80    (#    500:25  Unique         2.14, 2.72 A)
 &rst
  ixpk= 500, nxpk= 25, iat= 353,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 355, 356,
 &end
#
#   22 GLU  HN           21 GLU  HB+         4.50    (#    501:25  Unique         2.44, 3.35 A)
 &rst
  ixpk= 501, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 355, 356,
 &end
#
#   21 GLU  HN           21 GLU  HB+         5.50    (#    503:25  Unique         2.11, 2.41 A)
 &rst
  ixpk= 503, nxpk= 25, iat= 351,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 355, 356,
 &end
#
#   21 GLU  HN            0 AMB  25-1:504    5.50    (#    504:25  Single Ambig)
 &rst
  ixpk= 504, nxpk= 25, iat= 351,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 355, 356, 355, 356,
 &end
#
#    0 AMB  25-3:505     21 GLU  HG-         2.80    (#    505:25  Single Ambig)
 &rst
  ixpk= 505, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 355, 356, 355, 356,
 igr2= 358, 359,
 &end
#
#    0 AMB  25-3:506      0 AMB  25-1:506    2.80    (#    506:25  Double Ambig)
 &rst
  ixpk= 506, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 355, 356, 355, 356,
 igr2= 358, 359, 358, 359,
 &end
#
#   22 GLU  HG-          21 GLU  HG-         4.50    (#    509:25  Unique         3.64, 4.99 A)
 &rst
  ixpk= 509, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 373, 374,
 igr2= 358, 359,
 &end
#
#   22 GLU  HG-          21 GLU  HG+         3.50    (#    510:25  Unique         3.64, 4.99 A)
 &rst
  ixpk= 510, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 373, 374,
 igr2= 358, 359,
 &end
#
#   21 GLU  HA           21 GLU  HG-         3.50    (#    511:25  Unique         1.99, 3.02 A)
 &rst
  ixpk= 511, nxpk= 25, iat= 353,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 358, 359,
 &end
#
#    0 AMB  25-3:512      0 AMB  25-1:512    3.50    (#    512:25  Double Ambig)
 &rst
  ixpk= 512, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 353, 850, 851, 253,
 igr2= 358, 359, 258, 259, 258, 259,
 &end
#
#    0 AMB  25-3:516      0 AMB  25-1:516    3.50    (#    516:25  Double Ambig)
 &rst
  ixpk= 516, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1035,1036,1037, 432, 433, 432, 433, 429, 430,
 igr2= 102, 368,
 &end
#
#    0 AMB  25-3:517     22 GLU  HA          2.80    (#    517:25  Single Ambig)
 &rst
  ixpk= 517, nxpk= 25, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 370, 371, 370, 371, 426, 427, 426, 427,
 &end
#
#   22 GLU  HG-          22 GLU  HA          4.50    (#    518:25  Unique         2.51, 2.89 A)
 &rst
  ixpk= 518, nxpk= 25, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 373, 374,
 &end
#
#    0 AMB  25-3:519     22 GLU  HA          3.50    (#    519:25  Single Ambig)
 &rst
  ixpk= 519, nxpk= 25, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 373, 374, 358, 359,
 &end
#
#   22 GLU  HN           22 GLU  HA          4.50    (#    520:25  Unique         2.86, 2.87 A)
 &rst
  ixpk= 520, nxpk= 25, iat= 366, 368, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   23 LEU  HN           22 GLU  HA          4.50    (#    521:25  Unique         3.56, 3.58 A)
 &rst
  ixpk= 521, nxpk= 25, iat= 381, 368, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   25 LYS  HN           22 GLU  HA          4.50    (#    522:25  Unique         3.32, 3.54 A)
 &rst
  ixpk= 522, nxpk= 25, iat= 422, 368, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   20 LYS  HN           22 GLU  HA          7.00    (#    523:25  Unique         6.89, 7.06 A)
 &rst
  ixpk= 523, nxpk= 25, iat= 329, 368, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   18 ILE  QG2          22 GLU  HB+         5.50    (#    524:25  Unique         2.27, 3.25 A)
 &rst
  ixpk= 524, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 294, 295, 296,
 igr2= 370, 371,
 &end
#
#   18 ILE  QG2          22 GLU  HB-         5.50    (#    525:25  Unique         2.27, 3.25 A)
 &rst
  ixpk= 525, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 294, 295, 296,
 igr2= 370, 371,
 &end
#
#    0 AMB  25-3:526      0 AMB  25-1:526    4.50    (#    526:25  Double Ambig)
 &rst
  ixpk= 526, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.80, r4= 9.30,
 igr1= 385, 386, 336, 337, 292, 429, 430,
 igr2= 370, 371, 355, 356, 370, 371, 370, 371,
 &end
#
#    0 AMB  25-3:527      0 AMB  25-1:527    4.50    (#    527:25  Double Ambig)
 &rst
  ixpk= 527, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.49, r4= 9.99,
 igr1= 385, 386, 292,1271,1272,1335, 429, 430,  79,  80,
       388,
 igr2= 370, 371, 255, 256,1318,1319, 104, 105,
 &end
#
#    0 AMB  25-3:528      0 AMB  25-1:528    2.80    (#    528:25  Double Ambig)
 &rst
  ixpk= 528, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 373, 374, 107, 108,
 igr2= 370, 371, 104, 105,
 &end
#
#    0 AMB  25-3:529      0 AMB  25-1:529    2.80    (#    529:25  Double Ambig)
 &rst
  ixpk= 529, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 358, 359, 373, 374, 107, 108,
 igr2= 355, 356, 370, 371, 104, 105,
 &end
#
#    0 AMB  25-3:530      0 AMB  25-1:530    2.80    (#    530:25  Double Ambig)
 &rst
  ixpk= 530, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 358, 359, 373, 374, 107, 108,
 igr2= 355, 356, 370, 371, 104, 105,
 &end
#
#    0 AMB  25-3:531      0 AMB  25-1:531    2.80    (#    531:25  Double Ambig)
 &rst
  ixpk= 531, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 373, 374, 107, 108,
 igr2= 370, 371, 104, 105,
 &end
#
#    0 AMB  25-3:532      0 AMB  25-1:532    3.50    (#    532:25  Double Ambig)
 &rst
  ixpk= 532, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.44, r4= 8.94,
 igr1= 314, 315, 831, 832,1035,1036,1037, 276, 277, 276,
       277, 998, 314, 315,
 igr2= 355, 356, 255, 256, 104, 105, 255, 256, 255, 256,
       104, 105, 370, 371,
 &end
#
#    0 AMB  25-3:533      0 AMB  25-1:533    4.50    (#    533:25  Double Ambig)
 &rst
  ixpk= 533, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 314, 315,1035,1036,1037, 998, 314, 315,
 igr2= 355, 356, 104, 105, 370, 371,
 &end
#
#    0 AMB  25-3:534      0 AMB  25-1:534    3.50    (#    534:25  Double Ambig)
 &rst
  ixpk= 534, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 102, 368,
 igr2= 104, 105, 370, 371,
 &end
#
#    0 AMB  25-3:535      0 AMB  25-1:535    4.50    (#    535:25  Double Ambig)
 &rst
  ixpk= 535, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 102, 368, 268,
 igr2= 104, 105, 370, 371, 255, 256,
 &end
#
#   22 GLU  HN           22 GLU  HB+         3.50    (#    538:25  Unique         2.07, 2.97 A)
 &rst
  ixpk= 538, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 370, 371,
 &end
#
#   22 GLU  HN            0 AMB  25-1:539    4.50    (#    539:25  Single Ambig)
 &rst
  ixpk= 539, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 370, 371, 355, 356,
 &end
#
#    0 AMB  25-3:540      0 AMB  25-1:540    5.50    (#    540:25  Double Ambig)
 &rst
  ixpk= 540, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 100, 381, 266,
 igr2= 104, 105, 370, 371, 255, 256,
 &end
#
#    0 AMB  25-3:541      0 AMB  25-1:541    4.50    (#    541:25  Double Ambig)
 &rst
  ixpk= 541, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 100, 381, 266,
 igr2= 104, 105, 370, 371, 255, 256,
 &end
#
#    8 THR  HN            7 GLN  HB+         5.50    (#    542:25  Unique         2.78, 3.78 A)
 &rst
  ixpk= 542, nxpk= 25, iat= 117,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 104, 105,
 &end
#
#    0 AMB  25-3:543     23 LEU  HA          4.50    (#    543:25  Single Ambig)
 &rst
  ixpk= 543, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 381, 400,
 &end
#
#   75 TYR  QE           23 LEU  HA          5.50    (#    545:25  Unique         3.35, 5.42 A)
 &rst
  ixpk= 545, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1238,1243,
 &end
#
#    0 AMB  25-3:547     23 LEU  HA          5.50    (#    547:25  Single Ambig)
 &rst
  ixpk= 547, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 457, 424, 309,
 &end
#
#   23 LEU  HB+          23 LEU  HA          3.50    (#    548:25  Unique         1.97, 2.70 A)
 &rst
  ixpk= 548, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 385, 386,
 &end
#
#   23 LEU  HB-          23 LEU  HA          3.50    (#    549:25  Unique         1.97, 2.70 A)
 &rst
  ixpk= 549, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 385, 386,
 &end
#
#   23 LEU  QD1          23 LEU  HA          4.50    (#    551:25  Unique         3.67, 4.36 A)
 &rst
  ixpk= 551, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 390, 391, 392,
 &end
#
#   23 LEU  QD2          23 LEU  HA          4.50    (#    552:25  Unique         2.47, 3.17 A)
 &rst
  ixpk= 552, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 394, 395, 396,
 &end
#
#   18 ILE  QG2          23 LEU  HA          4.50    (#    553:25  Unique         2.98, 3.66 A)
 &rst
  ixpk= 553, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 294, 295, 296,
 &end
#
#   57 LYS  HB+          57 LYS  HA          5.50    (#    554:25  Unique         2.35, 2.49 A)
 &rst
  ixpk= 554, nxpk= 25, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 961, 962,
 &end
#
#   26 SER  HA           23 LEU  HA          5.50    (#    555:25  Unique         5.36, 5.56 A)
 &rst
  ixpk= 555, nxpk= 25, iat= 446, 383, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 LEU  QD1          23 LEU  HB+         4.50    (#    556:25  Unique         2.37, 3.51 A)
 &rst
  ixpk= 556, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 390, 391, 392,
 igr2= 385, 386,
 &end
#
#   23 LEU  QD1          23 LEU  HB-         4.50    (#    557:25  Unique         2.37, 3.51 A)
 &rst
  ixpk= 557, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 390, 391, 392,
 igr2= 385, 386,
 &end
#
#   20 LYS  HA           23 LEU  HB+         4.50    (#    558:25  Unique         2.28, 3.17 A)
 &rst
  ixpk= 558, nxpk= 25, iat= 331,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 385, 386,
 &end
#
#   23 LEU  HA           23 LEU  HB+         5.50    (#    559:25  Unique         1.97, 2.70 A)
 &rst
  ixpk= 559, nxpk= 25, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 385, 386,
 &end
#
#   23 LEU  HA           23 LEU  HB-         4.50    (#    560:25  Unique         1.97, 2.70 A)
 &rst
  ixpk= 560, nxpk= 25, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 385, 386,
 &end
#
#   20 LYS  HA           23 LEU  HB-         5.50    (#    561:25  Unique         2.28, 3.17 A)
 &rst
  ixpk= 561, nxpk= 25, iat= 331,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 385, 386,
 &end
#
#   23 LEU  HN           23 LEU  HB-         4.50    (#    562:25  Unique         1.86, 2.40 A)
 &rst
  ixpk= 562, nxpk= 25, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 385, 386,
 &end
#
#   23 LEU  HN           23 LEU  HB+         4.50    (#    563:25  Unique         1.86, 2.40 A)
 &rst
  ixpk= 563, nxpk= 25, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 385, 386,
 &end
#
#    0 AMB  25-3:564     23 LEU  HB-         5.50    (#    564:25  Single Ambig)
 &rst
  ixpk= 564, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.21, r4= 9.71,
 igr1= 370, 371, 370, 371, 462, 311, 312, 355, 356, 355,
       356,
 igr2= 385, 386,
 &end
#
#   23 LEU  QD2          23 LEU  HB-         5.50    (#    565:25  Unique         2.35, 3.57 A)
 &rst
  ixpk= 565, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 394, 395, 396,
 igr2= 385, 386,
 &end
#
#   23 LEU  QD2          23 LEU  HB+         5.50    (#    566:25  Unique         2.35, 3.57 A)
 &rst
  ixpk= 566, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 394, 395, 396,
 igr2= 385, 386,
 &end
#
#   23 LEU  QD1          23 LEU  HG          2.80    (#    567:25  Unique         2.05, 2.62 A)
 &rst
  ixpk= 567, nxpk= 25, iat=  -1, 388, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 390, 391, 392,
 &end
#
#   23 LEU  QD2          23 LEU  HG          4.50    (#    568:25  Unique         2.26, 2.65 A)
 &rst
  ixpk= 568, nxpk= 25, iat=  -1, 388, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 394, 395, 396,
 &end
#
#    0 AMB  25-3:569     23 LEU  HG          5.50    (#    569:25  Single Ambig)
 &rst
  ixpk= 569, nxpk= 25, iat=  -1, 388, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 294, 295, 296, 184, 185, 186,
 &end
#
#   23 LEU  HB+          23 LEU  HG          4.50    (#    570:25  Unique         2.28, 2.40 A)
 &rst
  ixpk= 570, nxpk= 25, iat=  -1, 388, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 385, 386,
 &end
#
#   23 LEU  HA           23 LEU  HG          5.50    (#    571:25  Unique         3.78, 3.89 A)
 &rst
  ixpk= 571, nxpk= 25, iat= 383, 388, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 LEU  HN           23 LEU  HG          5.50    (#    572:25  Unique         4.09, 4.43 A)
 &rst
  ixpk= 572, nxpk= 25, iat= 381, 388, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   42 ALA  HN           23 LEU  HG          5.50    (#    573:25  Unique         5.40, 5.57 A)
 &rst
  ixpk= 573, nxpk= 25, iat= 701, 388, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:574      0 AMB  25-1:574    2.80    (#    574:25  Double Ambig)
 &rst
  ixpk= 574, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 igr2= 298, 299, 298, 299, 390, 391, 392,
 &end
#
#   42 ALA  QB           23 LEU  QD1         3.50    (#    575:25  Unique         2.31, 3.58 A)
 &rst
  ixpk= 575, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 705, 706, 707,
 igr2= 390, 391, 392,
 &end
#
#   17 LYS  HG-          18 ILE  HG1+        3.50    (#    576:25  Unique         2.77, 4.83 A)
 &rst
  ixpk= 576, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 273, 274,
 igr2= 298, 299,
 &end
#
#    0 AMB  25-3:577      0 AMB  25-1:577    2.80    (#    577:25  Double Ambig)
 &rst
  ixpk= 577, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr1= 388, 292, 336, 337,
 igr2= 390, 391, 392, 298, 299,
 &end
#
#    0 AMB  25-3:578     23 LEU  QD1         3.50    (#    578:25  Single Ambig)
 &rst
  ixpk= 578, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 385, 386, 333, 334, 410, 411,
 igr2= 390, 391, 392,
 &end
#
#    0 AMB  25-3:579      0 AMB  25-1:579    4.50    (#    579:25  Double Ambig)
 &rst
  ixpk= 579, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 462, 818, 819, 820,
 igr2= 390, 391, 392, 720, 721, 722, 724, 725, 726,
 &end
#
#    0 AMB  25-3:580      0 AMB  25-1:580    5.50    (#    580:25  Double Ambig)
 &rst
  ixpk= 580, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 290, 331,
 igr2= 298, 299, 390, 391, 392,
 &end
#
#    0 AMB  25-3:581      0 AMB  25-1:581    4.50    (#    581:25  Double Ambig)
 &rst
  ixpk= 581, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
 igr1= 383, 850, 851,
 igr2= 390, 391, 392, 298, 299, 298, 299,
 &end
#
#   18 ILE  HN           18 ILE  HG1+        5.50    (#    583:25  Unique         2.04, 2.89 A)
 &rst
  ixpk= 583, nxpk= 25, iat= 288,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 298, 299,
 &end
#
#    0 AMB  25-3:584      0 AMB  25-1:584    4.50    (#    584:25  Double Ambig)
 &rst
  ixpk= 584, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 400, 266,
 igr2= 390, 391, 392, 298, 299,
 &end
#
#   74 PHE  QD           18 ILE  HG1+        5.50    (#    585:25  Unique         3.88, 7.53 A)
 &rst
  ixpk= 585, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1216,1224,
 igr2= 298, 299,
 &end
#
#   74 PHE  QE            0 AMB  25-1:586    5.50    (#    586:25  Single Ambig)
 &rst
  ixpk= 586, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1218,1222,
 igr2= 298, 299, 390, 391, 392,
 &end
#
#    0 AMB  25-3:587     23 LEU  QD2         4.50    (#    587:25  Single Ambig)
 &rst
  ixpk= 587, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 181, 182, 298, 299,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:588     23 LEU  QD2         3.50    (#    588:25  Single Ambig)
 &rst
  ixpk= 588, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:589     23 LEU  QD2         4.50    (#    589:25  Single Ambig)
 &rst
  ixpk= 589, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 184, 185, 186, 294, 295, 296,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:591     23 LEU  QD2         3.50    (#    591:25  Single Ambig)
 &rst
  ixpk= 591, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 705, 706, 707, 222, 223,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:592     23 LEU  QD2         4.50    (#    592:25  Single Ambig)
 &rst
  ixpk= 592, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 459, 460, 222, 223,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:593      0 AMB  25-1:593    2.80    (#    593:25  Double Ambig)
 &rst
  ixpk= 593, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 388, 792, 793, 795, 796, 795, 796,
 igr2= 394, 395, 396, 775, 776, 777,
 &end
#
#    0 AMB  25-3:594     46 LEU  QD1         2.80    (#    594:25  Single Ambig)
 &rst
  ixpk= 594, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 770, 771, 773,
 igr2= 775, 776, 777,
 &end
#
#   23 LEU  HA           23 LEU  QD2         3.50    (#    595:25  Unique         2.47, 3.17 A)
 &rst
  ixpk= 595, nxpk= 25, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:596     23 LEU  QD2         5.50    (#    596:25  Single Ambig)
 &rst
  ixpk= 596, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 402, 331,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:597     46 LEU  QD1         4.50    (#    597:25  Single Ambig)
 &rst
  ixpk= 597, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 768, 787,
 igr2= 775, 776, 777,
 &end
#
#   74 PHE  QE           23 LEU  QD2         3.50    (#    599:25  Unique         2.33, 4.66 A)
 &rst
  ixpk= 599, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1218,1222,
 igr2= 394, 395, 396,
 &end
#
#   23 LEU  HN           23 LEU  QD2         5.50    (#    601:25  Unique         4.65, 5.19 A)
 &rst
  ixpk= 601, nxpk= 25, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 394, 395, 396,
 &end
#
#   27 LEU  HN           23 LEU  QD2         5.50    (#    602:25  Unique         3.33, 4.85 A)
 &rst
  ixpk= 602, nxpk= 25, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:604      0 AMB  25-1:604    5.50    (#    604:25  Double Ambig)
 &rst
  ixpk= 604, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 462, 255, 256,
 igr2= 394, 395, 396, 775, 776, 777,
 &end
#
#    0 AMB  25-3:605     24 LYS  HA          4.50    (#    605:25  Single Ambig)
 &rst
  ixpk= 605, nxpk= 25, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 679, 680, 681, 672, 673, 674,
 &end
#
#   27 LEU  HB-          24 LYS  HA          5.50    (#    606:25  Unique         2.59, 3.64 A)
 &rst
  ixpk= 606, nxpk= 25, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 459, 460,
 &end
#
#   24 LYS  HG-          24 LYS  HA          4.50    (#    607:25  Unique         2.31, 2.77 A)
 &rst
  ixpk= 607, nxpk= 25, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 407, 408,
 &end
#
#   24 LYS  HG+          24 LYS  HA          4.50    (#    608:25  Unique         2.31, 2.77 A)
 &rst
  ixpk= 608, nxpk= 25, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 407, 408,
 &end
#
#    0 AMB  25-3:609     24 LYS  HA          3.50    (#    609:25  Single Ambig)
 &rst
  ixpk= 609, nxpk= 25, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 404, 405, 404, 405,
 &end
#
#    0 AMB  25-3:610     24 LYS  HA          5.50    (#    610:25  Single Ambig)
 &rst
  ixpk= 610, nxpk= 25, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 410, 411, 410, 411, 385, 386, 626, 627,
 &end
#
#   27 LEU  HB+          24 LYS  HA          5.50    (#    611:25  Unique         2.59, 3.64 A)
 &rst
  ixpk= 611, nxpk= 25, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 459, 460,
 &end
#
#   25 LYS  HN           24 LYS  HA          5.50    (#    612:25  Unique         3.58, 3.64 A)
 &rst
  ixpk= 612, nxpk= 25, iat= 422, 402, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 LYS  HN           24 LYS  HA          4.50    (#    613:25  Unique         2.71, 2.82 A)
 &rst
  ixpk= 613, nxpk= 25, iat= 400, 402, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 LEU  HN           24 LYS  HA          5.50    (#    614:25  Unique         3.57, 3.69 A)
 &rst
  ixpk= 614, nxpk= 25, iat= 455, 402, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 LYS  HA           24 LYS  HB+         4.50    (#    615:25  Unique         2.45, 2.81 A)
 &rst
  ixpk= 615, nxpk= 25, iat= 402,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 404, 405,
 &end
#
#    0 AMB  25-3:617      0 AMB  25-1:617    5.50    (#    617:25  Double Ambig)
 &rst
  ixpk= 617, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.17, r4=10.67,
 igr1= 424, 368, 768, 687,
 igr2= 404, 405, 404, 405, 811, 812, 811, 812, 404, 405,
      
 &end
#
#    0 AMB  25-3:618      0 AMB  25-1:618    4.50    (#    618:25  Double Ambig)
 &rst
  ixpk= 618, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 787, 268,
 igr2= 789, 790, 270, 271,
 &end
#
#    0 AMB  25-3:619      0 AMB  25-1:619    4.50    (#    619:25  Double Ambig)
 &rst
  ixpk= 619, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 867, 868, 422,
 igr2= 789, 790, 404, 405,
 &end
#
#   25 LYS  HN           24 LYS  HB+         4.50    (#    620:25  Unique         2.43, 3.08 A)
 &rst
  ixpk= 620, nxpk= 25, iat= 422,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 404, 405,
 &end
#
#    0 AMB  25-3:621      0 AMB  25-1:621    4.50    (#    621:25  Double Ambig)
 &rst
  ixpk= 621, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 266, 400,
 igr2= 270, 271, 404, 405,
 &end
#
#   24 LYS  HN           24 LYS  HB+         4.50    (#    622:25  Unique         2.32, 2.71 A)
 &rst
  ixpk= 622, nxpk= 25, iat= 400,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 404, 405,
 &end
#
#    0 AMB  25-3:623     24 LYS  HG-         3.50    (#    623:25  Single Ambig)
 &rst
  ixpk= 623, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 410, 411, 410, 411,
 igr2= 407, 408,
 &end
#
#    0 AMB  25-3:625      0 AMB  25-1:625    5.50    (#    625:25  Double Ambig)
 &rst
  ixpk= 625, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 413, 414, 413, 414,
 igr2= 407, 408, 407, 408,
 &end
#
#    0 AMB  25-3:627     24 LYS  HG-         5.50    (#    627:25  Single Ambig)
 &rst
  ixpk= 627, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 402, 331,
 igr2= 407, 408,
 &end
#
#    0 AMB  25-3:628     24 LYS  HG-         4.50    (#    628:25  Single Ambig)
 &rst
  ixpk= 628, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 672, 673, 674, 679, 680, 681,
 igr2= 407, 408,
 &end
#
#    0 AMB  25-3:629      0 AMB  25-1:629    2.80    (#    629:25  Double Ambig)
 &rst
  ixpk= 629, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 320, 321, 320, 321, 320, 321,
 igr2= 317, 318, 317, 318, 317, 318,
 &end
#
#   21 GLU  HB-           0 AMB  25-1:630    3.50    (#    630:25  Single Ambig)
 &rst
  ixpk= 630, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 355, 356,
 igr2= 317, 318, 317, 318,
 &end
#
#   24 LYS  HG-           0 AMB  25-1:631    3.50    (#    631:25  Single Ambig)
 &rst
  ixpk= 631, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 407, 408,
 igr2= 410, 411, 410, 411,
 &end
#
#   42 ALA  HN            0 AMB  25-1:633    5.50    (#    633:25  Single Ambig)
 &rst
  ixpk= 633, nxpk= 25, iat= 701,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 410, 411, 410, 411,
 &end
#
#   24 LYS  HN            0 AMB  25-1:634    5.50    (#    634:25  Single Ambig)
 &rst
  ixpk= 634, nxpk= 25, iat= 400,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 410, 411, 410, 411,
 &end
#
#   21 GLU  HA            0 AMB  25-1:636    5.50    (#    636:25  Single Ambig)
 &rst
  ixpk= 636, nxpk= 25, iat= 353,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 410, 411, 410, 411,
 &end
#
#   21 GLU  HA            0 AMB  25-1:637    5.50    (#    637:25  Single Ambig)
 &rst
  ixpk= 637, nxpk= 25, iat= 353,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 413, 414, 413, 414,
 &end
#
#    0 AMB  25-3:639      0 AMB  25-1:639    4.50    (#    639:25  Double Ambig)
 &rst
  ixpk= 639, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 941, 942, 941, 942,
 igr2= 970, 971, 970, 971,
 &end
#
#    0 AMB  25-3:641      0 AMB  25-1:641    5.50    (#    641:25  Double Ambig)
 &rst
  ixpk= 641, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 679, 680, 681, 672, 673, 674,
 igr2= 413, 414, 413, 414, 413, 414,
 &end
#
#   24 LYS  HG-           0 AMB  25-1:642    4.50    (#    642:25  Single Ambig)
 &rst
  ixpk= 642, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 407, 408,
 igr2= 413, 414, 413, 414,
 &end
#
#   25 LYS  HN           25 LYS  HA          4.50    (#    643:25  Unique         2.75, 2.81 A)
 &rst
  ixpk= 643, nxpk= 25, iat= 422, 424, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   25 LYS  HG-           0 AMB  25-1:644    4.50    (#    644:25  Single Ambig)
 &rst
  ixpk= 644, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 429, 430,
 igr2= 426, 427, 426, 427,
 &end
#
#    0 AMB  25-3:645      0 AMB  25-1:645    5.50    (#    645:25  Double Ambig)
 &rst
  ixpk= 645, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 381, 400, 524,
 igr2= 311, 312, 426, 427, 426, 427,1140,1141, 426, 427,
       311, 312,
 &end
#
#    0 AMB  25-3:646      0 AMB  25-1:646    3.50    (#    646:25  Double Ambig)
 &rst
  ixpk= 646, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 422, 532, 540,
 igr2= 426, 427, 426, 427,1140,1141,
 &end
#
#    0 AMB  25-3:647      0 AMB  25-1:647    3.50    (#    647:25  Double Ambig)
 &rst
  ixpk= 647, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 424, 309, 368,
 igr2= 426, 427, 426, 427, 311, 312, 426, 427,
 &end
#
#    0 AMB  25-3:648      0 AMB  25-1:648    2.80    (#    648:25  Double Ambig)
 &rst
  ixpk= 648, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 426, 427, 426, 427, 311, 312, 355, 356, 355, 356,
      
 igr2= 429, 430, 429, 430, 314, 315, 314, 315, 314, 315,
      
 &end
#
#    0 AMB  25-3:649     25 LYS  HG-         2.80    (#    649:25  Single Ambig)
 &rst
  ixpk= 649, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 426, 427, 426, 427,
 igr2= 429, 430,
 &end
#
#    0 AMB  25-3:650     25 LYS  HG-         4.50    (#    650:25  Single Ambig)
 &rst
  ixpk= 650, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 435, 436, 435, 436,
 igr2= 429, 430,
 &end
#
#    0 AMB  25-3:651      0 AMB  25-1:651    5.50    (#    651:25  Double Ambig)
 &rst
  ixpk= 651, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.00, r4=11.50,
 igr1= 435, 436, 435, 436, 743, 744, 743, 744,
 igr2= 429, 430, 429, 430, 314, 315, 314, 315,
 &end
#
#    0 AMB  25-3:652      0 AMB  25-1:652    4.50    (#    652:25  Double Ambig)
 &rst
  ixpk= 652, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 424, 309,
 igr2= 429, 430, 314, 315,
 &end
#
#    0 AMB  25-3:653     25 LYS  HG-         4.50    (#    653:25  Single Ambig)
 &rst
  ixpk= 653, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 424, 368,
 igr2= 429, 430,
 &end
#
#   25 LYS  HN           25 LYS  HG+         5.50    (#    654:25  Unique         2.45, 4.06 A)
 &rst
  ixpk= 654, nxpk= 25, iat= 422,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 429, 430,
 &end
#
#   25 LYS  HN           25 LYS  HG-         5.50    (#    655:25  Unique         2.45, 4.06 A)
 &rst
  ixpk= 655, nxpk= 25, iat= 422,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 429, 430,
 &end
#
#    0 AMB  25-3:659     25 LYS  HD-         2.80    (#    659:25  Single Ambig)
 &rst
  ixpk= 659, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 435, 436, 435, 436,
 igr2= 432, 433,
 &end
#
#    0 AMB  25-3:661      0 AMB  25-1:661    3.50    (#    661:25  Double Ambig)
 &rst
  ixpk= 661, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
 igr1= 961, 962, 961, 962, 603, 604, 426, 427,
 igr2= 967, 968, 967, 968, 967, 968, 432, 433,
 &end
#
#   25 LYS  HB+          25 LYS  HD-         2.80    (#    662:25  Unique         2.38, 3.17 A)
 &rst
  ixpk= 662, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 426, 427,
 igr2= 432, 433,
 &end
#
#    0 AMB  25-3:664      0 AMB  25-1:664    2.80    (#    664:25  Double Ambig)
 &rst
  ixpk= 664, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 737, 738, 429, 430,
 igr2= 740, 741, 740, 741, 432, 433,
 &end
#
#    0 AMB  25-3:665      0 AMB  25-1:665    4.50    (#    665:25  Double Ambig)
 &rst
  ixpk= 665, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 732, 446,
 igr2= 740, 741, 740, 741, 432, 433,
 &end
#
#    0 AMB  25-3:666      0 AMB  25-1:666    4.50    (#    666:25  Double Ambig)
 &rst
  ixpk= 666, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 424, 309,
 igr2= 432, 433, 740, 741, 740, 741,
 &end
#
#    0 AMB  25-3:669      0 AMB  25-1:669    4.50    (#    669:25  Double Ambig)
 &rst
  ixpk= 669, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.30, r4=10.80,
 igr1= 478, 479, 478, 479, 941, 942, 941, 942, 478, 479,
       478, 479,
 igr2= 435, 436, 435, 436, 970, 971, 970, 971, 413, 414,
       413, 414,
 &end
#
#   15 ASN  HB-           0 AMB  25-1:670    3.50    (#    670:25  Single Ambig)
 &rst
  ixpk= 670, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 241, 242,
 igr2= 279, 280, 279, 280,
 &end
#
#    0 AMB  25-3:673     26 SER  HA          4.50    (#    673:25  Single Ambig)
 &rst
  ixpk= 673, nxpk= 25, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 448, 449, 448, 449,
 &end
#
#   24 LYS  HA           26 SER  HA          7.00    (#    674:25  Unique         6.65, 6.74 A)
 &rst
  ixpk= 674, nxpk= 25, iat= 402, 446, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   75 TYR  QE           26 SER  HA          5.50    (#    675:25  Unique         4.84, 6.41 A)
 &rst
  ixpk= 675, nxpk= 25, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1238,1243,
 &end
#
#   26 SER  HN           26 SER  HA          5.50    (#    677:25  Unique         2.81, 2.84 A)
 &rst
  ixpk= 677, nxpk= 25, iat= 444, 446, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:679     26 SER  HA          5.50    (#    679:25  Single Ambig)
 &rst
  ixpk= 679, nxpk= 25, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 435, 436, 435, 436,
 &end
#
#   27 LEU  HB+          26 SER  HA          5.50    (#    680:25  Unique         5.67, 6.18 A)
 &rst
  ixpk= 680, nxpk= 25, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 459, 460,
 &end
#
#    0 AMB  25-3:681     26 SER  HA          4.50    (#    681:25  Single Ambig)
 &rst
  ixpk= 681, nxpk= 25, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 499, 500, 501, 432, 433, 429, 430,
 &end
#
#    0 AMB  25-3:682     26 SER  HA          5.50    (#    682:25  Single Ambig)
 &rst
  ixpk= 682, nxpk= 25, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 426, 427, 462, 370, 371,
 &end
#
#   26 SER  HA            0 AMB  25-1:684    3.50    (#    684:25  Single Ambig)
 &rst
  ixpk= 684, nxpk= 25, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 448, 449, 448, 449,
 &end
#
#   74 PHE  QE            0 AMB  25-1:688    4.50    (#    688:25  Single Ambig)
 &rst
  ixpk= 688, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1218,1222,
 igr2= 448, 449, 448, 449,
 &end
#
#   22 GLU  HN            0 AMB  25-1:689    7.00    (#    689:25  Single Ambig)
 &rst
  ixpk= 689, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2= 448, 449, 448, 449,
 &end
#
#   27 LEU  HN           27 LEU  HA          5.50    (#    693:25  Unique         2.84, 2.87 A)
 &rst
  ixpk= 693, nxpk= 25, iat= 455, 457, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   74 PHE  QE           27 LEU  HA          5.50    (#    694:25  Unique         2.41, 4.53 A)
 &rst
  ixpk= 694, nxpk= 25, iat=  -1, 457, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1218,1222,
 &end
#
#   27 LEU  HB+          27 LEU  HA          3.50    (#    695:25  Unique         2.56, 2.83 A)
 &rst
  ixpk= 695, nxpk= 25, iat=  -1, 457, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 459, 460,
 &end
#
#    0 AMB  25-3:696      0 AMB  25-1:696    3.50    (#    696:25  Double Ambig)
 &rst
  ixpk= 696, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 104, 105, 370, 371, 426, 427, 426, 427, 462,
 igr2= 102, 368, 457,
 &end
#
#   27 LEU  HB-          27 LEU  HA          5.50    (#    698:25  Unique         2.56, 2.83 A)
 &rst
  ixpk= 698, nxpk= 25, iat=  -1, 457, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 459, 460,
 &end
#
#   23 LEU  QD1          27 LEU  HA          7.00    (#    699:25  Unique         5.32, 6.95 A)
 &rst
  ixpk= 699, nxpk= 25, iat=  -1, 457, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 390, 391, 392,
 &end
#
#   27 LEU  QD2          27 LEU  HA          3.50    (#    700:25  Unique         1.98, 2.96 A)
 &rst
  ixpk= 700, nxpk= 25, iat=  -1, 457, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 468, 469, 470,
 &end
#
#    0 AMB  25-3:701      0 AMB  25-1:701    5.50    (#    701:25  Double Ambig)
 &rst
  ixpk= 701, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 994, 444,1013,
 igr2= 102, 457,
 &end
#
#    0 AMB  25-3:702      0 AMB  25-1:702    4.50    (#    702:25  Double Ambig)
 &rst
  ixpk= 702, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 468, 469, 470, 464, 465, 466,
 igr2= 459, 460, 459, 460,
 &end
#
#    0 AMB  25-3:703     27 LEU  HB-         4.50    (#    703:25  Single Ambig)
 &rst
  ixpk= 703, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 468, 469, 470, 464, 465, 466,
 igr2= 459, 460,
 &end
#
#    0 AMB  25-3:704      0 AMB  25-1:704    4.50    (#    704:25  Double Ambig)
 &rst
  ixpk= 704, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 402, 476,
 igr2= 459, 460, 459, 460,
 &end
#
#   27 LEU  HN           27 LEU  HB+         5.50    (#    705:25  Unique         2.22, 2.94 A)
 &rst
  ixpk= 705, nxpk= 25, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 459, 460,
 &end
#
#   27 LEU  HN           27 LEU  HB-         5.50    (#    706:25  Unique         2.22, 2.94 A)
 &rst
  ixpk= 706, nxpk= 25, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 459, 460,
 &end
#
#    0 AMB  25-3:707     27 LEU  HG          3.50    (#    707:25  Single Ambig)
 &rst
  ixpk= 707, nxpk= 25, iat=  -1, 462, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 468, 469, 470, 464, 465, 466,
 &end
#
#   74 PHE  QE           27 LEU  HG          5.50    (#    708:25  Unique         2.89, 4.12 A)
 &rst
  ixpk= 708, nxpk= 25, iat=  -1, 462, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1218,1222,
 &end
#
#   54 VAL  QG-          27 LEU  QD1         5.50    (#    709:25  Unique         2.19, 4.36 A)
 &rst
  ixpk= 709, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 464, 465, 466,
 &end
#
#    0 AMB  25-3:710     27 LEU  QD1         3.50    (#    710:25  Single Ambig)
 &rst
  ixpk= 710, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 672, 673, 674, 679, 680, 681,
 igr2= 464, 465, 466,
 &end
#
#   23 LEU  QD1          27 LEU  QD1         4.50    (#    711:25  Unique         2.10, 3.67 A)
 &rst
  ixpk= 711, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 390, 391, 392,
 igr2= 464, 465, 466,
 &end
#
#   52 ALA  QB           27 LEU  QD1         3.50    (#    712:25  Unique         3.09, 4.73 A)
 &rst
  ixpk= 712, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 876, 877, 878,
 igr2= 464, 465, 466,
 &end
#
#    0 AMB  25-3:713     27 LEU  QD1         5.50    (#    713:25  Single Ambig)
 &rst
  ixpk= 713, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 676, 677, 676, 677,
 igr2= 464, 465, 466,
 &end
#
#   27 LEU  HG           27 LEU  QD1         4.50    (#    714:25  Unique         2.38, 2.66 A)
 &rst
  ixpk= 714, nxpk= 25, iat= 462,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 464, 465, 466,
 &end
#
#   27 LEU  HB+          27 LEU  QD1         5.50    (#    715:25  Unique         2.28, 3.07 A)
 &rst
  ixpk= 715, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 459, 460,
 igr2= 464, 465, 466,
 &end
#
#   24 LYS  HA           27 LEU  QD1         5.50    (#    716:25  Unique         2.91, 4.22 A)
 &rst
  ixpk= 716, nxpk= 25, iat= 402,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 464, 465, 466,
 &end
#
#    0 AMB  25-3:717     27 LEU  QD1         5.50    (#    717:25  Single Ambig)
 &rst
  ixpk= 717, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 457, 687,
 igr2= 464, 465, 466,
 &end
#
#   74 PHE  QE           27 LEU  QD1         5.50    (#    718:25  Unique         4.08, 6.25 A)
 &rst
  ixpk= 718, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1218,1222,
 igr2= 464, 465, 466,
 &end
#
#    0 AMB  25-3:719     27 LEU  QD1         5.50    (#    719:25  Single Ambig)
 &rst
  ixpk= 719, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 455, 171,
 igr2= 464, 465, 466,
 &end
#
#    0 AMB  25-3:720     27 LEU  QD1         5.50    (#    720:25  Single Ambig)
 &rst
  ixpk= 720, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 532, 540, 422,
 igr2= 464, 465, 466,
 &end
#
#   54 VAL  QG-          27 LEU  QD2         4.50    (#    722:25  Unique         2.37, 4.62 A)
 &rst
  ixpk= 722, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 468, 469, 470,
 &end
#
#    0 AMB  25-3:723     27 LEU  QD2         4.50    (#    723:25  Single Ambig)
 &rst
  ixpk= 723, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 177, 178, 179, 390, 391, 392,
 igr2= 468, 469, 470,
 &end
#
#    0 AMB  25-3:724     27 LEU  QD2         4.50    (#    724:25  Single Ambig)
 &rst
  ixpk= 724, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 876, 877, 878, 225,
 igr2= 468, 469, 470,
 &end
#
#   27 LEU  HB-          27 LEU  QD2         3.50    (#    725:25  Unique         2.23, 3.55 A)
 &rst
  ixpk= 725, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 459, 460,
 igr2= 468, 469, 470,
 &end
#
#    0 AMB  25-3:726     27 LEU  QD2         5.50    (#    726:25  Single Ambig)
 &rst
  ixpk= 726, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1=1144,1145,1146, 626, 627,
 igr2= 468, 469, 470,
 &end
#
#    0 AMB  25-3:727     27 LEU  QD2         4.50    (#    727:25  Single Ambig)
 &rst
  ixpk= 727, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 462,1308,1309,1310,
 igr2= 468, 469, 470,
 &end
#
#   27 LEU  HB+          27 LEU  QD2         5.50    (#    728:25  Unique         2.23, 3.55 A)
 &rst
  ixpk= 728, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 459, 460,
 igr2= 468, 469, 470,
 &end
#
#   27 LEU  HA           27 LEU  QD2         3.50    (#    729:25  Unique         1.98, 2.96 A)
 &rst
  ixpk= 729, nxpk= 25, iat= 457,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 468, 469, 470,
 &end
#
#   31 PHE  QE           27 LEU  QD2         3.50    (#    730:25  Unique         2.45, 4.46 A)
 &rst
  ixpk= 730, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 534, 538,
 igr2= 468, 469, 470,
 &end
#
#   74 PHE  QE           27 LEU  QD2         3.50    (#    731:25  Unique         2.53, 4.87 A)
 &rst
  ixpk= 731, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1218,1222,
 igr2= 468, 469, 470,
 &end
#
#   31 PHE  QD           27 LEU  QD2         4.50    (#    732:25  Unique         2.46, 4.01 A)
 &rst
  ixpk= 732, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 532, 540,
 igr2= 468, 469, 470,
 &end
#
#   27 LEU  HN           27 LEU  QD2         5.50    (#    733:25  Unique         3.84, 4.64 A)
 &rst
  ixpk= 733, nxpk= 25, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 468, 469, 470,
 &end
#
#    0 AMB  25-3:734     27 LEU  QD2         3.50    (#    734:25  Single Ambig)
 &rst
  ixpk= 734, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 672, 673, 674, 679, 680, 681,
 igr2= 468, 469, 470,
 &end
#
#   37 ILE  QD1          28 TYR  HA          5.50    (#    736:25  Unique         2.19, 3.97 A)
 &rst
  ixpk= 736, nxpk= 25, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 629, 630, 631,
 &end
#
#   28 TYR  HB-          28 TYR  HA          3.50    (#    739:25  Unique         2.43, 2.79 A)
 &rst
  ixpk= 739, nxpk= 25, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 478, 479,
 &end
#
#   28 TYR  QD           28 TYR  HA          5.50    (#    741:25  Unique         2.15, 3.46 A)
 &rst
  ixpk= 741, nxpk= 25, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 482, 491,
 &end
#
#   28 TYR  HN           28 TYR  HA          5.50    (#    742:25  Unique         2.76, 2.83 A)
 &rst
  ixpk= 742, nxpk= 25, iat= 474, 476, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   29 ALA  HN           28 TYR  HA          5.50    (#    744:25  Unique         3.38, 3.56 A)
 &rst
  ixpk= 744, nxpk= 25, iat= 495, 476, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 ILE  QD1          28 TYR  HB-         4.50    (#    745:25  Unique         2.46, 5.07 A)
 &rst
  ixpk= 745, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 679, 680, 681,
 igr2= 478, 479,
 &end
#
#   40 ILE  QD1          28 TYR  HB+         5.50    (#    746:25  Unique         2.46, 5.07 A)
 &rst
  ixpk= 746, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 679, 680, 681,
 igr2= 478, 479,
 &end
#
#    0 AMB  25-3:747     28 TYR  HB-         4.50    (#    747:25  Single Ambig)
 &rst
  ixpk= 747, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 476, 548, 549,
 igr2= 478, 479,
 &end
#
#    0 AMB  25-3:748      0 AMB  25-1:748    4.50    (#    748:25  Double Ambig)
 &rst
  ixpk= 748, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 476, 548, 549,
 igr2= 478, 479, 478, 479,
 &end
#
#   25 LYS  HA           28 TYR  HB-         4.50    (#    749:25  Unique         2.68, 3.58 A)
 &rst
  ixpk= 749, nxpk= 25, iat= 424,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 478, 479,
 &end
#
#   25 LYS  HA           28 TYR  HB+         4.50    (#    750:25  Unique         2.68, 3.58 A)
 &rst
  ixpk= 750, nxpk= 25, iat= 424,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 478, 479,
 &end
#
#   28 TYR  QD           28 TYR  HB-         4.50    (#    751:25  Unique         2.28, 3.08 A)
 &rst
  ixpk= 751, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 482, 491,
 igr2= 478, 479,
 &end
#
#   28 TYR  QD           28 TYR  HB+         4.50    (#    752:25  Unique         2.28, 3.08 A)
 &rst
  ixpk= 752, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 482, 491,
 igr2= 478, 479,
 &end
#
#   29 ALA  HN           28 TYR  HB-         5.50    (#    753:25  Unique         2.66, 3.37 A)
 &rst
  ixpk= 753, nxpk= 25, iat= 495,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 478, 479,
 &end
#
#   29 ALA  HN           28 TYR  HB+         5.50    (#    754:25  Unique         2.66, 3.37 A)
 &rst
  ixpk= 754, nxpk= 25, iat= 495,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 478, 479,
 &end
#
#   28 TYR  HN           28 TYR  HB+         5.50    (#    755:25  Unique         1.94, 2.73 A)
 &rst
  ixpk= 755, nxpk= 25, iat= 474,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 478, 479,
 &end
#
#   28 TYR  HN           28 TYR  HB-         4.50    (#    756:25  Unique         1.94, 2.73 A)
 &rst
  ixpk= 756, nxpk= 25, iat= 474,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 478, 479,
 &end
#
#    0 AMB  25-3:757      0 AMB  25-1:757    4.50    (#    757:25  Double Ambig)
 &rst
  ixpk= 757, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 499, 500, 501,1035,1036,1037,
 igr2= 497,1033,
 &end
#
#   65 ALA  QB           62 ALA  HA          4.50    (#    758:25  Unique         2.55, 3.73 A)
 &rst
  ixpk= 758, nxpk= 25, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1070,1071,1072,
 &end
#
#    0 AMB  25-3:759      0 AMB  25-1:759    5.50    (#    759:25  Double Ambig)
 &rst
  ixpk= 759, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 144, 145, 146, 511, 512, 513,
 igr2=1033, 497,
 &end
#
#    0 AMB  25-3:760      0 AMB  25-1:760    4.50    (#    760:25  Double Ambig)
 &rst
  ixpk= 760, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 567, 568, 947, 951, 482, 491,
 igr2= 497,1033,
 &end
#
#   31 PHE  HA           31 PHE  HB-         5.50    (#    761:25  Unique         2.35, 2.82 A)
 &rst
  ixpk= 761, nxpk= 25, iat= 526,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 528, 529,
 &end
#
#   37 ILE  QD1          31 PHE  HB-         5.50    (#    762:25  Unique         2.15, 3.41 A)
 &rst
  ixpk= 762, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 629, 630, 631,
 igr2= 528, 529,
 &end
#
#   37 ILE  QD1          31 PHE  HB+         5.50    (#    763:25  Unique         2.15, 3.41 A)
 &rst
  ixpk= 763, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 629, 630, 631,
 igr2= 528, 529,
 &end
#
#   56 PHE  QE           31 PHE  HB-         5.50    (#    764:25  Unique         2.24, 4.96 A)
 &rst
  ixpk= 764, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 947, 951,
 igr2= 528, 529,
 &end
#
#   56 PHE  QE           31 PHE  HB+         5.50    (#    765:25  Unique         2.24, 4.96 A)
 &rst
  ixpk= 765, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 947, 951,
 igr2= 528, 529,
 &end
#
#   31 PHE  QD           31 PHE  HB-         5.50    (#    766:25  Unique         2.29, 3.09 A)
 &rst
  ixpk= 766, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 532, 540,
 igr2= 528, 529,
 &end
#
#   31 PHE  QD           31 PHE  HB+         5.50    (#    767:25  Unique         2.29, 3.09 A)
 &rst
  ixpk= 767, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 532, 540,
 igr2= 528, 529,
 &end
#
#   81 ILE  QD1          70 GLN  HA          3.50    (#    768:25  Unique         2.31, 3.51 A)
 &rst
  ixpk= 768, nxpk= 25, iat=  -1,1152, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1344,1345,1346,
 &end
#
#    0 AMB  25-3:769     33 GLN  HA          2.80    (#    769:25  Single Ambig)
 &rst
  ixpk= 769, nxpk= 25, iat=  -1, 557, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 559, 560, 559, 560,
 &end
#
#   70 GLN  HB-          70 GLN  HA          4.50    (#    770:25  Unique         2.13, 2.68 A)
 &rst
  ixpk= 770, nxpk= 25, iat=  -1,1152, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1154,1155,
 &end
#
#   33 GLN  HN           33 GLN  HA          4.50    (#    771:25  Unique         2.77, 2.89 A)
 &rst
  ixpk= 771, nxpk= 25, iat= 555, 557, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   33 GLN  HG+          33 GLN  HA          7.00    (#    772:25  Unique         2.32, 3.09 A)
 &rst
  ixpk= 772, nxpk= 25, iat=  -1, 557, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 562, 563,
 &end
#
#    0 AMB  25-3:777      0 AMB  25-1:777    3.50    (#    777:25  Double Ambig)
 &rst
  ixpk= 777, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 557,1152, 507,
 igr2= 559, 560,1341,1342,1341,1342,
 &end
#
#    0 AMB  25-3:779      0 AMB  25-1:779    3.50    (#    779:25  Double Ambig)
 &rst
  ixpk= 779, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 792, 793, 407, 408, 273, 274,
 igr2= 789, 790, 404, 405, 270, 271,
 &end
#
#    0 AMB  25-3:781      0 AMB  25-1:781    4.50    (#    781:25  Double Ambig)
 &rst
  ixpk= 781, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 290, 331,
 igr2= 311, 312, 270, 271,
 &end
#
#    0 AMB  25-3:782      0 AMB  25-1:782    3.50    (#    782:25  Double Ambig)
 &rst
  ixpk= 782, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 787, 268,
 igr2= 789, 790, 270, 271,
 &end
#
#   34 PHE  HB-          34 PHE  HA          4.50    (#    788:25  Unique         2.42, 2.74 A)
 &rst
  ixpk= 788, nxpk= 25, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 576, 577,
 &end
#
#   34 PHE  HB+          34 PHE  HA          4.50    (#    789:25  Unique         2.42, 2.74 A)
 &rst
  ixpk= 789, nxpk= 25, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 576, 577,
 &end
#
#    0 AMB  25-3:791     34 PHE  HA          2.80    (#    791:25  Single Ambig)
 &rst
  ixpk= 791, nxpk= 25, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 580, 588, 572, 592,
 &end
#
#   36 GLN  HN           34 PHE  HA          5.50    (#    792:25  Unique         4.90, 5.40 A)
 &rst
  ixpk= 792, nxpk= 25, iat= 599, 574, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   64 ASN  HD2-         34 PHE  HA          5.50    (#    794:25  Unique         2.61, 3.47 A)
 &rst
  ixpk= 794, nxpk= 25, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1061,1062,
 &end
#
#    0 AMB  25-3:795     34 PHE  HA          5.50    (#    795:25  Single Ambig)
 &rst
  ixpk= 795, nxpk= 25, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 567, 568, 582, 586,
 &end
#
#   83 TYR  QD           83 TYR  HB-         3.50    (#    796:25  Unique         2.34, 3.08 A)
 &rst
  ixpk= 796, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1368,1377,
 igr2=1364,1365,
 &end
#
#   83 TYR  QD           83 TYR  HB+         4.50    (#    797:25  Unique         2.34, 3.08 A)
 &rst
  ixpk= 797, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1368,1377,
 igr2=1364,1365,
 &end
#
#    0 AMB  25-3:798     83 TYR  HB-         4.50    (#    798:25  Single Ambig)
 &rst
  ixpk= 798, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1381,1360,
 igr2=1364,1365,
 &end
#
#    0 AMB  25-3:799      0 AMB  25-1:799    4.50    (#    799:25  Double Ambig)
 &rst
  ixpk= 799, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1381,1360,
 igr2=1364,1365,1364,1365,
 &end
#
#   83 TYR  HA           83 TYR  HB-         5.50    (#    800:25  Unique         2.33, 2.44 A)
 &rst
  ixpk= 800, nxpk= 25, iat=1362,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1364,1365,
 &end
#
#   83 TYR  HA           83 TYR  HB+         5.50    (#    801:25  Unique         2.33, 2.44 A)
 &rst
  ixpk= 801, nxpk= 25, iat=1362,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1364,1365,
 &end
#
#    0 AMB  25-3:803     35 GLY  HA-         4.50    (#    803:25  Single Ambig)
 &rst
  ixpk= 803, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 592, 572,
 igr2= 594, 595,
 &end
#
#   62 ALA  HN           35 GLY  HA-         5.50    (#    804:25  Unique         4.77, 5.39 A)
 &rst
  ixpk= 804, nxpk= 25, iat=1031,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 594, 595,
 &end
#
#   35 GLY  HN           35 GLY  HA+         4.50    (#    806:25  Unique         2.59, 2.82 A)
 &rst
  ixpk= 806, nxpk= 25, iat= 592,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 594, 595,
 &end
#
#   36 GLN  HG+          36 GLN  HA          4.50    (#    807:25  Unique         2.31, 3.43 A)
 &rst
  ixpk= 807, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 606, 607,
 &end
#
#    0 AMB  25-3:808     36 GLN  HA          5.50    (#    808:25  Single Ambig)
 &rst
  ixpk= 808, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 620, 967, 968, 967, 968,
 &end
#
#    0 AMB  25-3:809     36 GLN  HA          5.50    (#    809:25  Single Ambig)
 &rst
  ixpk= 809, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 618, 557,
 &end
#
#    0 AMB  25-3:812     36 GLN  HA          5.50    (#    812:25  Single Ambig)
 &rst
  ixpk= 812, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 599, 544,
 &end
#
#   37 ILE  HN           36 GLN  HA          4.50    (#    813:25  Unique         2.01, 2.08 A)
 &rst
  ixpk= 813, nxpk= 25, iat= 616, 601, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   37 ILE  HG1+         36 GLN  HG-         5.50    (#    814:25  Unique         5.26, 6.82 A)
 &rst
  ixpk= 814, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 626, 627,
 igr2= 606, 607,
 &end
#
#    0 AMB  25-3:815      0 AMB  25-1:815    5.50    (#    815:25  Double Ambig)
 &rst
  ixpk= 815, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 967, 968, 967, 968,
 igr2= 606, 607, 606, 607,
 &end
#
#   36 GLN  HA           36 GLN  HG+         5.50    (#    816:25  Unique         2.31, 3.43 A)
 &rst
  ixpk= 816, nxpk= 25, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 606, 607,
 &end
#
#   36 GLN  HA           36 GLN  HG-         4.50    (#    817:25  Unique         2.31, 3.43 A)
 &rst
  ixpk= 817, nxpk= 25, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 606, 607,
 &end
#
#   36 GLN  HE2+         36 GLN  HG+         5.50    (#    819:25  Unique         2.15, 3.33 A)
 &rst
  ixpk= 819, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 611, 612,
 igr2= 606, 607,
 &end
#
#   36 GLN  HB+          36 GLN  HG+         3.50    (#    822:25  Unique         2.32, 2.60 A)
 &rst
  ixpk= 822, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 603, 604,
 igr2= 606, 607,
 &end
#
#    0 AMB  25-3:823      0 AMB  25-1:823    2.80    (#    823:25  Double Ambig)
 &rst
  ixpk= 823, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 603, 604, 961, 962,
 igr2= 606, 607, 606, 607,
 &end
#
#   36 GLN  HB+          36 GLN  HG-         4.50    (#    824:25  Unique         2.32, 2.60 A)
 &rst
  ixpk= 824, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 603, 604,
 igr2= 606, 607,
 &end
#
#    0 AMB  25-3:825     36 GLN  HG-         3.50    (#    825:25  Single Ambig)
 &rst
  ixpk= 825, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 603, 604, 961, 962,
 igr2= 606, 607,
 &end
#
#   37 ILE  HG1-         37 ILE  HA          5.50    (#    827:25  Unique         2.31, 2.96 A)
 &rst
  ixpk= 827, nxpk= 25, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 627,
 &end
#
#    0 AMB  25-3:829     37 ILE  HA          5.50    (#    829:25  Single Ambig)
 &rst
  ixpk= 829, nxpk= 25, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 639, 640, 964, 965, 964, 965,
 &end
#
#   37 ILE  HG1+         37 ILE  HA          5.50    (#    830:25  Unique         2.31, 2.96 A)
 &rst
  ixpk= 830, nxpk= 25, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 627,
 &end
#
#   37 ILE  HB           37 ILE  HA          5.50    (#    831:25  Unique         2.85, 3.03 A)
 &rst
  ixpk= 831, nxpk= 25, iat= 620, 618, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   56 PHE  HA           37 ILE  HA          4.50    (#    832:25  Unique         2.06, 2.39 A)
 &rst
  ixpk= 832, nxpk= 25, iat= 939, 618, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   38 LEU  HN           37 ILE  HA          3.50    (#    833:25  Unique         2.04, 2.23 A)
 &rst
  ixpk= 833, nxpk= 25, iat= 635, 618, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   56 PHE  QE           37 ILE  HA          5.50    (#    834:25  Unique         3.76, 4.88 A)
 &rst
  ixpk= 834, nxpk= 25, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 947, 951,
 &end
#
#   37 ILE  QG2          37 ILE  HB          3.50    (#    836:25  Unique         2.34, 2.65 A)
 &rst
  ixpk= 836, nxpk= 25, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 622, 623, 624,
 &end
#
#   37 ILE  QD1          37 ILE  HB          5.50    (#    837:25  Unique         2.51, 3.46 A)
 &rst
  ixpk= 837, nxpk= 25, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 629, 630, 631,
 &end
#
#   37 ILE  HN           37 ILE  HB          4.50    (#    838:25  Unique         2.17, 2.35 A)
 &rst
  ixpk= 838, nxpk= 25, iat= 616, 620, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   32 SER  HA           37 ILE  HG1+        5.50    (#    842:25  Unique         2.35, 3.51 A)
 &rst
  ixpk= 842, nxpk= 25, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 626, 627,
 &end
#
#   37 ILE  HA           37 ILE  HG1+        5.50    (#    843:25  Unique         2.31, 2.96 A)
 &rst
  ixpk= 843, nxpk= 25, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 626, 627,
 &end
#
#   37 ILE  QD1          37 ILE  HG1+        4.50    (#    844:25  Unique         1.99, 2.63 A)
 &rst
  ixpk= 844, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 629, 630, 631,
 igr2= 626, 627,
 &end
#
#    0 AMB  25-3:846     37 ILE  QD1         2.80    (#    846:25  Single Ambig)
 &rst
  ixpk= 846, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 622, 623, 624, 464, 465, 466,
 igr2= 629, 630, 631,
 &end
#
#   40 ILE  QD1          37 ILE  QD1         3.50    (#    847:25  Unique         2.22, 4.36 A)
 &rst
  ixpk= 847, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 679, 680, 681,
 igr2= 629, 630, 631,
 &end
#
#   37 ILE  HB           37 ILE  QD1         3.50    (#    848:25  Unique         2.51, 3.46 A)
 &rst
  ixpk= 848, nxpk= 25, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 629, 630, 631,
 &end
#
#   31 PHE  HB-          37 ILE  QD1         5.50    (#    849:25  Unique         2.15, 3.41 A)
 &rst
  ixpk= 849, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 528, 529,
 igr2= 629, 630, 631,
 &end
#
#   54 VAL  QG+          37 ILE  QD1         3.50    (#    850:25  Unique         2.22, 4.67 A)
 &rst
  ixpk= 850, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 629, 630, 631,
 &end
#
#   37 ILE  HG1-         37 ILE  QD1         3.50    (#    851:25  Unique         1.99, 2.63 A)
 &rst
  ixpk= 851, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 626, 627,
 igr2= 629, 630, 631,
 &end
#
#   28 TYR  HA           37 ILE  QD1         4.50    (#    852:25  Unique         2.19, 3.97 A)
 &rst
  ixpk= 852, nxpk= 25, iat= 476,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 629, 630, 631,
 &end
#
#   37 ILE  HA           37 ILE  QD1         5.50    (#    853:25  Unique         2.25, 4.16 A)
 &rst
  ixpk= 853, nxpk= 25, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 629, 630, 631,
 &end
#
#   32 SER  HA           37 ILE  QD1         5.50    (#    854:25  Unique         2.82, 4.48 A)
 &rst
  ixpk= 854, nxpk= 25, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 629, 630, 631,
 &end
#
#    0 AMB  25-3:855     37 ILE  QD1         4.50    (#    855:25  Single Ambig)
 &rst
  ixpk= 855, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 947, 951, 482, 491,
 igr2= 629, 630, 631,
 &end
#
#    0 AMB  25-3:856     37 ILE  QD1         5.50    (#    856:25  Single Ambig)
 &rst
  ixpk= 856, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 947, 951, 482, 491,
 igr2= 629, 630, 631,
 &end
#
#   56 PHE  QD           37 ILE  QD1         4.50    (#    857:25  Unique         3.22, 6.22 A)
 &rst
  ixpk= 857, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 945, 953,
 igr2= 629, 630, 631,
 &end
#
#    0 AMB  25-3:858     37 ILE  QD1         5.50    (#    858:25  Single Ambig)
 &rst
  ixpk= 858, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 947, 951, 482, 491,
 igr2= 629, 630, 631,
 &end
#
#   32 SER  HN           37 ILE  QD1         4.50    (#    859:25  Unique         2.51, 3.97 A)
 &rst
  ixpk= 859, nxpk= 25, iat= 544,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 629, 630, 631,
 &end
#
#   31 PHE  QD           37 ILE  QD1         5.50    (#    860:25  Unique         2.66, 5.48 A)
 &rst
  ixpk= 860, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 532, 540,
 igr2= 629, 630, 631,
 &end
#
#   54 VAL  QG+          37 ILE  QG2         3.50    (#    861:25  Unique         2.18, 5.34 A)
 &rst
  ixpk= 861, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 622, 623, 624,
 &end
#
#   37 ILE  QD1          37 ILE  QG2         2.80    (#    862:25  Unique         2.11, 3.69 A)
 &rst
  ixpk= 862, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 629, 630, 631,
 igr2= 622, 623, 624,
 &end
#
#   40 ILE  QD1          37 ILE  QG2         2.80    (#    863:25  Unique         2.15, 4.01 A)
 &rst
  ixpk= 863, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 679, 680, 681,
 igr2= 622, 623, 624,
 &end
#
#   37 ILE  HB           37 ILE  QG2         2.80    (#    865:25  Unique         2.34, 2.65 A)
 &rst
  ixpk= 865, nxpk= 25, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 622, 623, 624,
 &end
#
#   37 ILE  HA           37 ILE  QG2         3.50    (#    866:25  Unique         2.26, 3.25 A)
 &rst
  ixpk= 866, nxpk= 25, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 622, 623, 624,
 &end
#
#   40 ILE  HA           37 ILE  QG2         5.50    (#    867:25  Unique         4.38, 5.01 A)
 &rst
  ixpk= 867, nxpk= 25, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 622, 623, 624,
 &end
#
#   28 TYR  QE           37 ILE  QG2         5.50    (#    868:25  Unique         2.55, 6.54 A)
 &rst
  ixpk= 868, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 484, 489,
 igr2= 622, 623, 624,
 &end
#
#    0 AMB  25-3:869     37 ILE  QG2         4.50    (#    869:25  Single Ambig)
 &rst
  ixpk= 869, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 482, 491, 947, 951,
 igr2= 622, 623, 624,
 &end
#
#   39 ASP  HN           37 ILE  QG2         3.50    (#    870:25  Unique         2.51, 3.35 A)
 &rst
  ixpk= 870, nxpk= 25, iat= 654,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 622, 623, 624,
 &end
#
#   55 ILE  HN           37 ILE  QG2         5.50    (#    871:25  Unique         3.23, 4.44 A)
 &rst
  ixpk= 871, nxpk= 25, iat= 918,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 622, 623, 624,
 &end
#
#    0 AMB  25-3:872     37 ILE  QG2         5.50    (#    872:25  Single Ambig)
 &rst
  ixpk= 872, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 666, 474,
 igr2= 622, 623, 624,
 &end
#
#   38 LEU  HN           37 ILE  QG2         4.50    (#    873:25  Unique         2.42, 3.19 A)
 &rst
  ixpk= 873, nxpk= 25, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 622, 623, 624,
 &end
#
#   38 LEU  QD-          38 LEU  HA          2.80    (#    874:25  Unique         2.24, 3.86 A)
 &rst
  ixpk= 874, nxpk= 25, iat=  -1, 637, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 644, 645, 646, 648, 649, 650,
 &end
#
#    0 AMB  25-3:876     38 LEU  HA          4.50    (#    876:25  Single Ambig)
 &rst
  ixpk= 876, nxpk= 25, iat=  -1, 637, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 639, 640, 642,
 &end
#
#   37 ILE  HA           38 LEU  HA          4.50    (#    878:25  Unique         4.38, 4.50 A)
 &rst
  ixpk= 878, nxpk= 25, iat= 618, 637, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   38 LEU  HN           38 LEU  HA          4.50    (#    881:25  Unique         2.79, 2.95 A)
 &rst
  ixpk= 881, nxpk= 25, iat= 635, 637, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:882     85 LYS  HA          4.50    (#    882:25  Single Ambig)
 &rst
  ixpk= 882, nxpk= 25, iat=  -1,1394, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1396,1397,1396,1397,
 &end
#
#    0 AMB  25-3:883      0 AMB  25-1:883    3.50    (#    883:25  Double Ambig)
 &rst
  ixpk= 883, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 644, 645, 646, 648, 649, 650, 924, 925, 926,
 igr2= 639, 640, 639, 640,
 &end
#
#    0 AMB  25-3:884     38 LEU  HB-         3.50    (#    884:25  Single Ambig)
 &rst
  ixpk= 884, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 644, 645, 646, 648, 649, 650, 924, 925, 926,
 igr2= 639, 640,
 &end
#
#   38 LEU  HN            0 AMB  25-1:885    5.50    (#    885:25  Single Ambig)
 &rst
  ixpk= 885, nxpk= 25, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 642, 928, 929,
 &end
#
#    0 AMB  25-3:887     24 LYS  HG-         5.50    (#    887:25  Single Ambig)
 &rst
  ixpk= 887, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 413, 414, 413, 414,
 igr2= 407, 408,
 &end
#
#    0 AMB  25-3:888     24 LYS  HG-         5.50    (#    888:25  Single Ambig)
 &rst
  ixpk= 888, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 333, 334, 426, 427, 355, 356,
 igr2= 407, 408,
 &end
#
#    0 AMB  25-3:889      0 AMB  25-1:889    2.80    (#    889:25  Double Ambig)
 &rst
  ixpk= 889, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 644, 645, 646, 648, 649, 650, 644, 645, 646, 648,
       649, 650, 931, 932, 933,
 igr2= 642, 928, 929,
 &end
#
#   67 ARG  HA           69 MET  HA          7.00    (#    898:25  Unique         6.65, 6.80 A)
 &rst
  ixpk= 898, nxpk= 25, iat=1097,1135, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   39 ASP  HB+          39 ASP  HA          4.50    (#    899:25  Unique         2.49, 2.78 A)
 &rst
  ixpk= 899, nxpk= 25, iat=  -1, 656, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 658, 659,
 &end
#
#   72 PHE  HB-          69 MET  HA          4.50    (#    900:25  Unique         2.33, 2.94 A)
 &rst
  ixpk= 900, nxpk= 25, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1178,1179,
 &end
#
#   40 ILE  HN           39 ASP  HA          4.50    (#    903:25  Unique         2.46, 2.50 A)
 &rst
  ixpk= 903, nxpk= 25, iat= 666, 656, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:906     69 MET  HA          5.50    (#    906:25  Single Ambig)
 &rst
  ixpk= 906, nxpk= 25, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1157,1158,1195,1196,
 &end
#
#   37 ILE  QG2          39 ASP  HA          5.50    (#    907:25  Unique         3.40, 4.10 A)
 &rst
  ixpk= 907, nxpk= 25, iat=  -1, 656, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 622, 623, 624,
 &end
#
#    0 AMB  25-3:908      0 AMB  25-1:908    4.50    (#    908:25  Double Ambig)
 &rst
  ixpk= 908, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1344,1345,1346, 924, 925, 926, 691, 692, 693, 695,
       696, 697,
 igr2=1135, 656,
 &end
#
#   69 MET  HG+          69 MET  HA          4.50    (#    909:25  Unique         2.71, 3.45 A)
 &rst
  ixpk= 909, nxpk= 25, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1140,1141,
 &end
#
#    0 AMB  25-3:911      0 AMB  25-1:911    3.50    (#    911:25  Double Ambig)
 &rst
  ixpk= 911, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 931, 932, 933, 644, 645, 646, 648, 649, 650, 924,
       925, 926,
 igr2= 658, 659, 658, 659, 658, 659,
 &end
#
#    0 AMB  25-3:912     39 ASP  HB-         3.50    (#    912:25  Single Ambig)
 &rst
  ixpk= 912, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 931, 932, 933, 644, 645, 646, 648, 649, 650, 924,
       925, 926,
 igr2= 658, 659,
 &end
#
#   39 ASP  HA           39 ASP  HB+         4.50    (#    913:25  Unique         2.49, 2.78 A)
 &rst
  ixpk= 913, nxpk= 25, iat= 656,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 658, 659,
 &end
#
#   39 ASP  HA           39 ASP  HB-         4.50    (#    914:25  Unique         2.49, 2.78 A)
 &rst
  ixpk= 914, nxpk= 25, iat= 656,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 658, 659,
 &end
#
#   40 ILE  HN           39 ASP  HB-         5.50    (#    915:25  Unique         3.08, 3.71 A)
 &rst
  ixpk= 915, nxpk= 25, iat= 666,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 658, 659,
 &end
#
#    0 AMB  25-3:916     40 ILE  HB          2.80    (#    916:25  Single Ambig)
 &rst
  ixpk= 916, nxpk= 25, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 672, 673, 674, 679, 680, 681,
 &end
#
#   23 LEU  QD2          40 ILE  HB          7.00    (#    917:25  Unique         6.47, 7.52 A)
 &rst
  ixpk= 917, nxpk= 25, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 394, 395, 396,
 &end
#
#    0 AMB  25-3:918     40 ILE  HB          5.50    (#    918:25  Single Ambig)
 &rst
  ixpk= 918, nxpk= 25, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 404, 405, 404, 405,
 &end
#
#    0 AMB  25-3:920     40 ILE  HB          5.50    (#    920:25  Single Ambig)
 &rst
  ixpk= 920, nxpk= 25, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 668, 656,
 &end
#
#   40 ILE  HN           40 ILE  HB          5.50    (#    921:25  Unique         2.67, 2.77 A)
 &rst
  ixpk= 921, nxpk= 25, iat= 666, 670, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   53 PHE  HN           40 ILE  HB          7.00    (#    922:25  Unique         6.90, 7.06 A)
 &rst
  ixpk= 922, nxpk= 25, iat= 882, 670, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   15 ASN  HA           77 LYS  HD-         5.50    (#    929:25  Unique         2.03, 3.08 A)
 &rst
  ixpk= 929, nxpk= 25, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1271,1272,
 &end
#
#   54 VAL  QG+          40 ILE  QD1         5.50    (#    930:25  Unique         3.15, 6.10 A)
 &rst
  ixpk= 930, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 679, 680, 681,
 &end
#
#   27 LEU  HB+          40 ILE  QD1         5.50    (#    931:25  Unique         2.16, 3.23 A)
 &rst
  ixpk= 931, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 459, 460,
 igr2= 679, 680, 681,
 &end
#
#   28 TYR  HB+          40 ILE  QD1         4.50    (#    932:25  Unique         2.46, 5.07 A)
 &rst
  ixpk= 932, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 478, 479,
 igr2= 679, 680, 681,
 &end
#
#    0 AMB  25-3:934     40 ILE  QD1         5.50    (#    934:25  Single Ambig)
 &rst
  ixpk= 934, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 668, 656,
 igr2= 679, 680, 681,
 &end
#
#   28 TYR  QD           40 ILE  QD1         5.50    (#    936:25  Unique         2.61, 5.37 A)
 &rst
  ixpk= 936, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 482, 491,
 igr2= 679, 680, 681,
 &end
#
#   36 GLN  HE2+         40 ILE  QD1         5.50    (#    938:25  Unique         6.58, 7.74 A)
 &rst
  ixpk= 938, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 611, 612,
 igr2= 679, 680, 681,
 &end
#
#    0 AMB  25-3:939     40 ILE  QD1         5.50    (#    939:25  Single Ambig)
 &rst
  ixpk= 939, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 544, 918,
 igr2= 679, 680, 681,
 &end
#
#    0 AMB  25-3:940     40 ILE  QD1         4.50    (#    940:25  Single Ambig)
 &rst
  ixpk= 940, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 474, 666,
 igr2= 679, 680, 681,
 &end
#
#    0 AMB  25-3:941     40 ILE  QG2         4.50    (#    941:25  Single Ambig)
 &rst
  ixpk= 941, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 622, 623, 624, 184, 185, 186,
 igr2= 672, 673, 674,
 &end
#
#   55 ILE  HN           40 ILE  QG2         5.50    (#    945:25  Unique         4.89, 6.23 A)
 &rst
  ixpk= 945, nxpk= 25, iat= 918,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 672, 673, 674,
 &end
#
#   42 ALA  HN           40 ILE  QG2         5.50    (#    946:25  Unique         3.69, 4.90 A)
 &rst
  ixpk= 946, nxpk= 25, iat= 701,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 672, 673, 674,
 &end
#
#   41 VAL  HN           40 ILE  QG2         4.50    (#    947:25  Unique         2.62, 3.34 A)
 &rst
  ixpk= 947, nxpk= 25, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 672, 673, 674,
 &end
#
#    0 AMB  25-3:949     40 ILE  QG2         5.50    (#    949:25  Single Ambig)
 &rst
  ixpk= 949, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 404, 405, 404, 405,
 igr2= 672, 673, 674,
 &end
#
#   54 VAL  QG-          40 ILE  QG2         4.50    (#    950:25  Unique         3.10, 5.87 A)
 &rst
  ixpk= 950, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 672, 673, 674,
 &end
#
#   42 ALA  HN           41 VAL  HA          3.50    (#    951:25  Unique         2.00, 2.13 A)
 &rst
  ixpk= 951, nxpk= 25, iat= 701, 687, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 VAL  QG-          41 VAL  HA          4.50    (#    955:25  Unique         2.17, 3.19 A)
 &rst
  ixpk= 955, nxpk= 25, iat=  -1, 687, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 691, 692, 693, 695, 696, 697,
 &end
#
#   57 LYS  HN           57 LYS  HB-         5.50    (#    957:25  Unique         2.41, 3.08 A)
 &rst
  ixpk= 957, nxpk= 25, iat= 957,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 961, 962,
 &end
#
#   41 VAL  QG-          41 VAL  HB          4.50    (#    959:25  Unique         2.34, 2.66 A)
 &rst
  ixpk= 959, nxpk= 25, iat=  -1, 689, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 691, 692, 693, 695, 696, 697,
 &end
#
#   55 ILE  HG1-         41 VAL  QG+         5.50    (#    961:25  Unique         4.10, 6.79 A)
 &rst
  ixpk= 961, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 928, 929,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#    0 AMB  25-3:962      0 AMB  25-1:962    3.50    (#    962:25  Double Ambig)
 &rst
  ixpk= 962, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 718, 689, 715, 716,
 igr2= 691, 692, 693, 695, 696, 697, 691, 692, 693, 695,
       696, 697, 691, 692, 693, 695, 696, 697,
 &end
#
#    0 AMB  25-3:963      0 AMB  25-1:963    4.50    (#    963:25  Double Ambig)
 &rst
  ixpk= 963, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 886, 887, 886, 887,
 igr2= 691, 692, 693, 695, 696, 697, 691, 692, 693, 695,
       696, 697,
 &end
#
#   41 VAL  HA           41 VAL  QG+         3.50    (#    964:25  Unique         2.17, 3.19 A)
 &rst
  ixpk= 964, nxpk= 25, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   41 VAL  HN           41 VAL  QG+         4.50    (#    966:25  Unique         2.26, 4.27 A)
 &rst
  ixpk= 966, nxpk= 25, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   42 ALA  HN           41 VAL  QG+         5.50    (#    969:25  Unique         2.67, 4.58 A)
 &rst
  ixpk= 969, nxpk= 25, iat= 701,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   42 ALA  QB           41 VAL  QG-         4.50    (#    973:25  Unique         5.17, 7.27 A)
 &rst
  ixpk= 973, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 705, 706, 707,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#    0 AMB  25-3:976     41 VAL  QG-         5.50    (#    976:25  Single Ambig)
 &rst
  ixpk= 976, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 886, 887, 886, 887,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   53 PHE  QD           41 VAL  QG-         5.50    (#    978:25  Unique         2.87, 6.08 A)
 &rst
  ixpk= 978, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 890, 898,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   42 ALA  HN           41 VAL  QG-         4.50    (#    979:25  Unique         2.67, 4.58 A)
 &rst
  ixpk= 979, nxpk= 25, iat= 701,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   41 VAL  HA           41 VAL  QG-         4.50    (#    980:25  Unique         2.17, 3.19 A)
 &rst
  ixpk= 980, nxpk= 25, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#    0 AMB  25-3:981     42 ALA  QB          3.50    (#    981:25  Single Ambig)
 &rst
  ixpk= 981, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 333, 334, 385, 386, 410, 411,
 igr2= 705, 706, 707,
 &end
#
#   23 LEU  HG           42 ALA  QB          2.80    (#    982:25  Unique         2.19, 2.85 A)
 &rst
  ixpk= 982, nxpk= 25, iat= 388,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 705, 706, 707,
 &end
#
#   27 LEU  QD1          42 ALA  QB          5.50    (#    983:25  Unique         4.95, 6.45 A)
 &rst
  ixpk= 983, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 464, 465, 466,
 igr2= 705, 706, 707,
 &end
#
#   23 LEU  QD1          42 ALA  QB          3.50    (#    984:25  Unique         2.31, 3.58 A)
 &rst
  ixpk= 984, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 390, 391, 392,
 igr2= 705, 706, 707,
 &end
#
#    0 AMB  25-3:985     42 ALA  QB          4.50    (#    985:25  Single Ambig)
 &rst
  ixpk= 985, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
 igr1= 672, 673, 674, 691, 692, 693, 695, 696, 697,
 igr2= 705, 706, 707,
 &end
#
#   20 LYS  HG-          42 ALA  QB          3.50    (#    986:25  Unique         2.20, 4.16 A)
 &rst
  ixpk= 986, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 336, 337,
 igr2= 705, 706, 707,
 &end
#
#   52 ALA  QB           42 ALA  QB          3.50    (#    987:25  Unique         2.50, 4.36 A)
 &rst
  ixpk= 987, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 876, 877, 878,
 igr2= 705, 706, 707,
 &end
#
#   42 ALA  HN           42 ALA  QB          4.50    (#    990:25  Unique         2.65, 3.39 A)
 &rst
  ixpk= 990, nxpk= 25, iat= 701,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 705, 706, 707,
 &end
#
#   20 LYS  QE           42 ALA  QB          5.50    (#    991:25  Unique         2.18, 5.94 A)
 &rst
  ixpk= 991, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 342, 343,
 igr2= 705, 706, 707,
 &end
#
#    0 AMB  25-3:992      0 AMB  25-1:992    5.50    (#    992:25  Double Ambig)
 &rst
  ixpk= 992, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 867, 868, 824, 807,
 igr2= 787, 768,
 &end
#
#    0 AMB  25-3:997      0 AMB  25-1:997    3.50    (#    997:25  Double Ambig)
 &rst
  ixpk= 997, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 770, 771, 795, 796, 795, 796,
 igr2= 768, 787,
 &end
#
#   22 GLU  HG-          19 LYS  HB-         5.50    (#   1002:25  Unique         2.01, 3.74 A)
 &rst
  ixpk= 1002, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 373, 374,
 igr2= 311, 312,
 &end
#
#   53 PHE  HN           48 MET  HA          7.00    (#   1007:25  Unique         5.47, 5.69 A)
 &rst
  ixpk= 1007, nxpk= 25, iat= 882, 809, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  25-3:1012     0 AMB  25-1:1012   5.50    (#   1012:25  Double Ambig)
 &rst
  ixpk= 1012, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 705, 706, 707, 758, 759, 760,
 igr2= 811, 812, 811, 812, 811, 812,
 &end
#
#    0 AMB  25-3:1013     0 AMB  25-1:1013   4.50    (#   1013:25  Double Ambig)
 &rst
  ixpk= 1013, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 737, 738, 737, 738,
 igr2= 734, 735, 734, 735,
 &end
#
#    0 AMB  25-3:1014     0 AMB  25-1:1014   3.50    (#   1014:25  Double Ambig)
 &rst
  ixpk= 1014, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
 igr1= 859, 860, 859, 860, 859, 860, 862, 863,
 igr2= 811, 812, 811, 812, 811, 812, 811, 812,
 &end
#
#    0 AMB  25-3:1015     0 AMB  25-1:1015   4.50    (#   1015:25  Double Ambig)
 &rst
  ixpk= 1015, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 814, 815, 814, 815,
 igr2= 811, 812, 811, 812,
 &end
#
#   24 LYS  HA           24 LYS  HB+         4.50    (#   1016:25  Unique         2.45, 2.81 A)
 &rst
  ixpk= 1016, nxpk= 25, iat= 402,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 404, 405,
 &end
#
#    0 AMB  25-3:1017     0 AMB  25-1:1017   4.50    (#   1017:25  Double Ambig)
 &rst
  ixpk= 1017, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 732, 809,
 igr2= 734, 735, 811, 812, 811, 812, 811, 812,
 &end
#
#    0 AMB  25-3:1021     0 AMB  25-1:1021   4.50    (#   1021:25  Double Ambig)
 &rst
  ixpk= 1021, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 807, 824,
 igr2= 811, 812, 811, 812,
 &end
#
#   24 LYS  HN           24 LYS  HB+         4.50    (#   1023:25  Unique         2.32, 2.71 A)
 &rst
  ixpk= 1023, nxpk= 25, iat= 400,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 404, 405,
 &end
#
#    0 AMB  25-3:1025    48 MET  HG-         4.50    (#   1025:25  Single Ambig)
 &rst
  ixpk= 1025, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 811, 812, 811, 812,
 igr2= 814, 815,
 &end
#
#    0 AMB  25-3:1026    48 MET  HG-         3.50    (#   1026:25  Single Ambig)
 &rst
  ixpk= 1026, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 859, 860, 859, 860, 862, 863,
 igr2= 814, 815,
 &end
#
#    0 AMB  25-3:1027     0 AMB  25-1:1027   3.50    (#   1027:25  Double Ambig)
 &rst
  ixpk= 1027, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 859, 860, 859, 860, 862, 863,
 igr2= 814, 815, 814, 815, 814, 815,
 &end
#
#    0 AMB  25-3:1028     0 AMB  25-1:1028   4.50    (#   1028:25  Double Ambig)
 &rst
  ixpk= 1028, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 811, 812, 811, 812,
 igr2= 814, 815, 814, 815,
 &end
#
#    0 AMB  25-3:1029    48 MET  HG-         5.50    (#   1029:25  Single Ambig)
 &rst
  ixpk= 1029, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,
 igr2= 814, 815,
 &end
#
#   48 MET  HA           48 MET  HG-         4.50    (#   1030:25  Unique         2.41, 3.24 A)
 &rst
  ixpk= 1030, nxpk= 25, iat= 809,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 814, 815,
 &end
#
#   48 MET  HA           48 MET  HG+         5.50    (#   1031:25  Unique         2.41, 3.24 A)
 &rst
  ixpk= 1031, nxpk= 25, iat= 809,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 814, 815,
 &end
#
#   43 LEU  HB+          48 MET  HG+         5.50    (#   1035:25  Unique         2.12, 4.24 A)
 &rst
  ixpk= 1035, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 715, 716,
 igr2= 814, 815,
 &end
#
#    0 AMB  25-3:1036    49 ARG  HA          5.50    (#   1036:25  Single Ambig)
 &rst
  ixpk= 1036, nxpk= 25, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 253, 850, 851, 268, 768,
 &end
#
#    0 AMB  25-3:1037    49 ARG  HA          4.50    (#   1037:25  Single Ambig)
 &rst
  ixpk= 1037, nxpk= 25, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 732, 809,
 &end
#
#    0 AMB  25-3:1039    49 ARG  HA          4.50    (#   1039:25  Single Ambig)
 &rst
  ixpk= 1039, nxpk= 25, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 834, 835, 834, 835,
 &end
#
#    0 AMB  25-3:1040    49 ARG  HA          3.50    (#   1040:25  Single Ambig)
 &rst
  ixpk= 1040, nxpk= 25, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 828, 829, 828, 829,
 &end
#
#   49 ARG  HG-          49 ARG  HA          5.50    (#   1041:25  Unique         2.26, 2.69 A)
 &rst
  ixpk= 1041, nxpk= 25, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 831, 832,
 &end
#
#   51 GLN  HN           49 ARG  HA          5.50    (#   1043:25  Unique         3.86, 4.19 A)
 &rst
  ixpk= 1043, nxpk= 25, iat= 855, 826, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 GLY  HN           49 ARG  HA          4.50    (#   1044:25  Unique         3.47, 3.57 A)
 &rst
  ixpk= 1044, nxpk= 25, iat= 848, 826, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   49 ARG  HN           49 ARG  HA          5.50    (#   1046:25  Unique         2.30, 2.88 A)
 &rst
  ixpk= 1046, nxpk= 25, iat= 824, 826, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   49 ARG  HG+          49 ARG  HA          5.50    (#   1047:25  Unique         2.26, 2.69 A)
 &rst
  ixpk= 1047, nxpk= 25, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 831, 832,
 &end
#
#    0 AMB  25-3:1048     0 AMB  25-1:1048   5.50    (#   1048:25  Double Ambig)
 &rst
  ixpk= 1048, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 775, 776, 777, 779, 780, 781,
 igr2= 828, 829, 828, 829, 828, 829,
 &end
#
#    0 AMB  25-3:1049     0 AMB  25-1:1049   3.50    (#   1049:25  Double Ambig)
 &rst
  ixpk= 1049, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.01, r4= 8.51,
 igr1= 834, 835, 834, 835, 834, 835,1105,1106,1105,1106,
      1105,1106,
 igr2= 828, 829, 828, 829, 828, 829,1099,1100,1099,1100,
        25,  26,
 &end
#
#   49 ARG  HA            0 AMB  25-1:1052   4.50    (#   1052:25  Single Ambig)
 &rst
  ixpk= 1052, nxpk= 25, iat= 826,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 828, 829, 828, 829,
 &end
#
#    0 AMB  25-3:1053     0 AMB  25-1:1053   4.50    (#   1053:25  Double Ambig)
 &rst
  ixpk= 1053, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 824,1095,
 igr2= 828, 829, 828, 829,1099,1100,
 &end
#
#    0 AMB  25-3:1055     0 AMB  25-1:1055   5.50    (#   1055:25  Double Ambig)
 &rst
  ixpk= 1055, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 814, 815, 814, 815,
 igr2= 828, 829, 828, 829,
 &end
#
#   99 LYS  HE-         100 GLU  HB-         5.50    (#   1056:25  Unique         2.25, 5.67 A)
 &rst
  ixpk= 1056, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1622,1623,
 igr2=1635,1636,
 &end
#
#    0 AMB  25-3:1057     0 AMB  25-1:1057   5.50    (#   1057:25  Double Ambig)
 &rst
  ixpk= 1057, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.17, r4=10.67,
 igr1=1097, 850, 851,1045,1046,
 igr2=1099,1100, 828, 829, 828, 829,1099,1100,
 &end
#
#    0 AMB  25-3:1058     0 AMB  25-1:1058   4.50    (#   1058:25  Double Ambig)
 &rst
  ixpk= 1058, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1097, 850, 851,1045,1046,
 igr2=1099,1100, 828, 829, 828, 829,1099,1100,
 &end
#
#   96 GLY  HN          100 GLU  HB-         5.50    (#   1059:25  Unique         4.95, 6.25 A)
 &rst
  ixpk= 1059, nxpk= 25, iat=1568,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1635,1636,
 &end
#
#  100 GLU  HN          100 GLU  HB-         5.50    (#   1060:25  Unique         2.05, 3.01 A)
 &rst
  ixpk= 1060, nxpk= 25, iat=1631,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1635,1636,
 &end
#
#    0 AMB  25-3:1062     0 AMB  25-1:1062   3.50    (#   1062:25  Double Ambig)
 &rst
  ixpk= 1062, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 834, 835, 834, 835,
 igr2= 831, 832, 831, 832,
 &end
#
#   49 ARG  HA           49 ARG  HG+         5.50    (#   1063:25  Unique         2.26, 2.69 A)
 &rst
  ixpk= 1063, nxpk= 25, iat= 826,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 831, 832,
 &end
#
#    0 AMB  25-3:1064     0 AMB  25-1:1064   4.50    (#   1064:25  Double Ambig)
 &rst
  ixpk= 1064, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 824, 807,
 igr2= 831, 832, 831, 832,
 &end
#
#    0 AMB  25-3:1068     0 AMB  25-1:1068   2.80    (#   1068:25  Double Ambig)
 &rst
  ixpk= 1068, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
 igr1= 828, 829, 828, 829, 828, 829,1099,1100,1099,1100,
        25,  26,
 igr2= 834, 835, 834, 835, 834, 835,1105,1106,1105,1106,
      1105,1106,
 &end
#
#    0 AMB  25-3:1070     0 AMB  25-1:1070   5.50    (#   1070:25  Double Ambig)
 &rst
  ixpk= 1070, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.64, r4=12.14,
 igr1= 775, 776, 777,  47,  48,  49, 779, 780, 781,
 igr2= 834, 835, 834, 835,1105,1106,1105,1106, 834, 835,
      
 &end
#
#   64 ASN  HA            0 AMB  25-1:1072   4.50    (#   1072:25  Single Ambig)
 &rst
  ixpk= 1072, nxpk= 25, iat=1054,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1105,1106,1105,1106,
 &end
#
#    0 AMB  25-3:1073     0 AMB  25-1:1073   4.50    (#   1073:25  Double Ambig)
 &rst
  ixpk= 1073, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.80, r4= 9.30,
 igr1=1045,1046,1045,1046,1045,1046,1097,
 igr2=1105,1106,1105,1106,1105,1106,1105,1106,
 &end
#
#    0 AMB  25-3:1078     0 AMB  25-1:1078   4.50    (#   1078:25  Double Ambig)
 &rst
  ixpk= 1078, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1290,1291,1301,1302,
 igr2=1169,1170,1169,1170,
 &end
#
#    0 AMB  25-3:1079     0 AMB  25-1:1079   5.50    (#   1079:25  Double Ambig)
 &rst
  ixpk= 1079, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1290,1291,1154,1155,
 igr2=1169,1170,1169,1170,
 &end
#
#    0 AMB  25-3:1080    71 GLY  HA-         5.50    (#   1080:25  Single Ambig)
 &rst
  ixpk= 1080, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1290,1291,1154,1155,
 igr2=1169,1170,
 &end
#
#    0 AMB  25-3:1081    71 GLY  HA-         5.50    (#   1081:25  Single Ambig)
 &rst
  ixpk= 1081, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1290,1291,1301,1302,
 igr2=1169,1170,
 &end
#
#   72 PHE  HN           71 GLY  HA+         5.50    (#   1082:25  Unique         3.05, 3.40 A)
 &rst
  ixpk= 1082, nxpk= 25, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1169,1170,
 &end
#
#   72 PHE  HN           71 GLY  HA-         5.50    (#   1083:25  Unique         3.05, 3.40 A)
 &rst
  ixpk= 1083, nxpk= 25, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1169,1170,
 &end
#
#    0 AMB  25-3:1084    71 GLY  HA-         4.50    (#   1084:25  Single Ambig)
 &rst
  ixpk= 1084, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1167,1297,
 igr2=1169,1170,
 &end
#
#    0 AMB  25-3:1085     0 AMB  25-1:1085   4.50    (#   1085:25  Double Ambig)
 &rst
  ixpk= 1085, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1167,1297,
 igr2=1169,1170,1169,1170,
 &end
#
#   12 ASN  HA           51 GLN  HA          4.50    (#   1086:25  Unique         2.05, 2.55 A)
 &rst
  ixpk= 1086, nxpk= 25, iat= 192, 857, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:1087    51 GLN  HA          4.50    (#   1087:25  Single Ambig)
 &rst
  ixpk= 1087, nxpk= 25, iat=  -1, 857, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 859, 860, 859, 860, 862, 863,
 &end
#
#    0 AMB  25-3:1089    51 GLN  HA          5.50    (#   1089:25  Single Ambig)
 &rst
  ixpk= 1089, nxpk= 25, iat=  -1, 857, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 160, 165, 158, 167,
 &end
#
#   52 ALA  HN           51 GLN  HA          3.50    (#   1090:25  Unique         2.31, 2.48 A)
 &rst
  ixpk= 1090, nxpk= 25, iat= 872, 857, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   51 GLN  HN           51 GLN  HA          5.50    (#   1091:25  Unique         2.80, 2.93 A)
 &rst
  ixpk= 1091, nxpk= 25, iat= 855, 857, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   48 MET  QE            0 AMB  25-1:1093   3.50    (#   1093:25  Single Ambig)
 &rst
  ixpk= 1093, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 818, 819, 820,
 igr2= 859, 860, 859, 860, 862, 863,
 &end
#
#    0 AMB  25-3:1094     0 AMB  25-1:1094   3.50    (#   1094:25  Double Ambig)
 &rst
  ixpk= 1094, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr1= 789, 790, 811, 812, 811, 812, 811, 812,
 igr2= 859, 860, 859, 860, 862, 863, 859, 860, 859, 860,
      
 &end
#
#   12 ASN  HA            0 AMB  25-1:1096   4.50    (#   1096:25  Single Ambig)
 &rst
  ixpk= 1096, nxpk= 25, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 862, 863, 859, 860, 859, 860,
 &end
#
#   51 GLN  HE2-          0 AMB  25-1:1097   5.50    (#   1097:25  Single Ambig)
 &rst
  ixpk= 1097, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 867, 868,
 igr2= 859, 860, 859, 860, 862, 863,
 &end
#
#   51 GLN  HN            0 AMB  25-1:1098   5.50    (#   1098:25  Single Ambig)
 &rst
  ixpk= 1098, nxpk= 25, iat= 855,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 859, 860, 859, 860, 862, 863,
 &end
#
#   51 GLN  HA            0 AMB  25-1:1100   5.50    (#   1100:25  Single Ambig)
 &rst
  ixpk= 1100, nxpk= 25, iat= 857,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 859, 860, 859, 860, 862, 863,
 &end
#
#    0 AMB  25-3:1101     0 AMB  25-1:1101   5.50    (#   1101:25  Double Ambig)
 &rst
  ixpk= 1101, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.88, r4=11.38,
 igr1= 194, 195, 154, 155, 154, 155, 194, 195, 194, 195,
      
 igr2= 862, 863, 859, 860, 859, 860,
 &end
#
#   11 ILE  HB            0 AMB  25-1:1102   5.50    (#   1102:25  Single Ambig)
 &rst
  ixpk= 1102, nxpk= 25, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 862, 863, 859, 860, 859, 860,
 &end
#
#    0 AMB  25-3:1103     0 AMB  25-1:1103   5.50    (#   1103:25  Double Ambig)
 &rst
  ixpk= 1103, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.77, r4=12.27,
 igr1= 792, 793, 792, 793, 792, 793, 222, 223, 222, 223,
       222, 223,
 igr2= 859, 860, 859, 860, 862, 863, 859, 860,
 &end
#
#   42 ALA  QB           52 ALA  HA          5.50    (#   1107:25  Unique         3.14, 4.30 A)
 &rst
  ixpk= 1107, nxpk= 25, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 705, 706, 707,
 &end
#
#   53 PHE  HN           52 ALA  HA          3.50    (#   1108:25  Unique         2.01, 2.31 A)
 &rst
  ixpk= 1108, nxpk= 25, iat= 882, 874, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   10 TYR  QD           52 ALA  HA          7.00    (#   1110:25  Unique         4.86, 7.57 A)
 &rst
  ixpk= 1110, nxpk= 25, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 158, 167,
 &end
#
#    0 AMB  25-3:1112    52 ALA  QB          3.50    (#   1112:25  Single Ambig)
 &rst
  ixpk= 1112, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233, 464, 465, 466,
 igr2= 876, 877, 878,
 &end
#
#    0 AMB  25-3:1113    52 ALA  QB          3.50    (#   1113:25  Single Ambig)
 &rst
  ixpk= 1113, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233, 464, 465, 466,
 igr2= 876, 877, 878,
 &end
#
#    0 AMB  25-3:1114    52 ALA  QB          2.80    (#   1114:25  Single Ambig)
 &rst
  ixpk= 1114, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 igr2= 876, 877, 878,
 &end
#
#    0 AMB  25-3:1115    52 ALA  QB          2.80    (#   1115:25  Single Ambig)
 &rst
  ixpk= 1115, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 390, 391, 392, 177, 178, 179,
 igr2= 876, 877, 878,
 &end
#
#    0 AMB  25-3:1116     0 AMB  25-1:1116   3.50    (#   1116:25  Double Ambig)
 &rst
  ixpk= 1116, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 928, 929, 175,
 igr2= 123, 124, 125, 876, 877, 878,
 &end
#
#    0 AMB  25-3:1117     8 THR  QG2         4.50    (#   1117:25  Single Ambig)
 &rst
  ixpk= 1117, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 886, 887, 886, 887,
 igr2= 123, 124, 125,
 &end
#
#    8 THR  HB            8 THR  QG2         5.50    (#   1118:25  Unique         2.32, 2.67 A)
 &rst
  ixpk= 1118, nxpk= 25, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 123, 124, 125,
 &end
#
#   52 ALA  HA           52 ALA  QB          3.50    (#   1120:25  Unique         2.35, 2.66 A)
 &rst
  ixpk= 1120, nxpk= 25, iat= 874,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 876, 877, 878,
 &end
#
#    0 AMB  25-3:1121     0 AMB  25-1:1121   2.80    (#   1121:25  Double Ambig)
 &rst
  ixpk= 1121, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 131, 882,
 igr2= 123, 124, 125, 876, 877, 878,
 &end
#
#   54 VAL  QG-          52 ALA  QB          5.50    (#   1123:25  Unique         3.17, 6.58 A)
 &rst
  ixpk= 1123, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 876, 877, 878,
 &end
#
#    0 AMB  25-3:1124    52 ALA  QB          3.50    (#   1124:25  Single Ambig)
 &rst
  ixpk= 1124, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 705, 706, 707, 181, 182,
 igr2= 876, 877, 878,
 &end
#
#    0 AMB  25-3:1125    52 ALA  QB          5.50    (#   1125:25  Single Ambig)
 &rst
  ixpk= 1125, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.14, r4= 9.64,
 igr1= 818, 819, 820,1308,1309,1310, 462,
 igr2= 876, 877, 878,
 &end
#
#   23 LEU  HG           52 ALA  QB          5.50    (#   1126:25  Unique         2.54, 3.70 A)
 &rst
  ixpk= 1126, nxpk= 25, iat= 388,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 876, 877, 878,
 &end
#
#   53 PHE  QE            8 THR  QG2         5.50    (#   1128:25  Unique         4.32, 6.75 A)
 &rst
  ixpk= 1128, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 892, 896,
 igr2= 123, 124, 125,
 &end
#
#   10 TYR  HA           53 PHE  HA          5.50    (#   1129:25  Unique         2.51, 2.91 A)
 &rst
  ixpk= 1129, nxpk= 25, iat= 152, 884, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1130    53 PHE  HA          3.50    (#   1130:25  Single Ambig)
 &rst
  ixpk= 1130, nxpk= 25, iat=  -1, 884, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 886, 887, 886, 887,
 &end
#
#    0 AMB  25-3:1131    53 PHE  HA          5.50    (#   1131:25  Single Ambig)
 &rst
  ixpk= 1131, nxpk= 25, iat=  -1, 884, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 906, 676, 677, 676, 677,
 &end
#
#    0 AMB  25-3:1132    53 PHE  HA          5.50    (#   1132:25  Single Ambig)
 &rst
  ixpk= 1132, nxpk= 25, iat=  -1, 884, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 908, 909, 910, 912, 913, 914, 144, 145, 146,
 &end
#
#   54 VAL  HN           53 PHE  HA          3.50    (#   1134:25  Unique         2.09, 2.24 A)
 &rst
  ixpk= 1134, nxpk= 25, iat= 902, 884, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   11 ILE  HN           53 PHE  HA          5.50    (#   1135:25  Unique         3.13, 3.38 A)
 &rst
  ixpk= 1135, nxpk= 25, iat= 171, 884, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    9 ILE  HG1+         53 PHE  HA          5.50    (#   1136:25  Unique         3.89, 4.73 A)
 &rst
  ixpk= 1136, nxpk= 25, iat=  -1, 884, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 141, 142,
 &end
#
#    0 AMB  25-3:1137     0 AMB  25-1:1137   5.50    (#   1137:25  Double Ambig)
 &rst
  ixpk= 1137, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 882, 190, 685,
 igr2= 886, 887, 886, 887, 194, 195, 886, 887,
 &end
#
#    0 AMB  25-3:1138     0 AMB  25-1:1138   4.50    (#   1138:25  Double Ambig)
 &rst
  ixpk= 1138, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 204, 902,
 igr2= 194, 195, 886, 887, 886, 887,
 &end
#
#    8 THR  HA            0 AMB  25-1:1141   5.50    (#   1141:25  Single Ambig)
 &rst
  ixpk= 1141, nxpk= 25, iat= 119,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 886, 887, 886, 887,
 &end
#
#   53 PHE  HA            0 AMB  25-1:1142   5.50    (#   1142:25  Single Ambig)
 &rst
  ixpk= 1142, nxpk= 25, iat= 884,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 886, 887, 886, 887,
 &end
#
#   41 VAL  HB            0 AMB  25-1:1145   5.50    (#   1145:25  Single Ambig)
 &rst
  ixpk= 1145, nxpk= 25, iat= 689,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 886, 887, 886, 887,
 &end
#
#   61 SER  HB-          61 SER  HA          4.50    (#   1147:25  Unique         2.35, 2.74 A)
 &rst
  ixpk= 1147, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1024,1025,
 &end
#
#   64 ASN  HB-          61 SER  HA          4.50    (#   1148:25  Unique         2.25, 3.17 A)
 &rst
  ixpk= 1148, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1056,1057,
 &end
#
#    0 AMB  25-3:1150    61 SER  HA          4.50    (#   1150:25  Single Ambig)
 &rst
  ixpk= 1150, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1020,1061,1062,
 &end
#
#   55 ILE  HN           54 VAL  HA          4.50    (#   1151:25  Unique         1.84, 2.07 A)
 &rst
  ixpk= 1151, nxpk= 25, iat= 918, 904, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   62 ALA  HN           61 SER  HA          5.50    (#   1152:25  Unique         3.59, 3.61 A)
 &rst
  ixpk= 1152, nxpk= 25, iat=1031,1022, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1153    54 VAL  HB          5.50    (#   1153:25  Single Ambig)
 &rst
  ixpk= 1153, nxpk= 25, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 666, 474,
 &end
#
#    0 AMB  25-3:1155    54 VAL  HB          5.50    (#   1155:25  Single Ambig)
 &rst
  ixpk= 1155, nxpk= 25, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1= 141, 142, 181, 182, 705, 706, 707,
 &end
#
#    0 AMB  25-3:1156    54 VAL  HB          5.50    (#   1156:25  Single Ambig)
 &rst
  ixpk= 1156, nxpk= 25, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 876, 877, 878, 123, 124, 125,
 &end
#
#   54 VAL  QG+          54 VAL  HB          4.50    (#   1158:25  Unique         2.18, 2.64 A)
 &rst
  ixpk= 1158, nxpk= 25, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 908, 909, 910, 912, 913, 914,
 &end
#
#   37 ILE  QD1          54 VAL  QG+         3.50    (#   1160:25  Unique         2.22, 4.67 A)
 &rst
  ixpk= 1160, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 629, 630, 631,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1161     0 AMB  25-1:1161   3.50    (#   1161:25  Double Ambig)
 &rst
  ixpk= 1161, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.17, r4= 8.67,
 igr1= 622, 623, 624, 464, 465, 466, 468, 469, 470,
 igr2= 908, 909, 910, 912, 913, 914, 908, 909, 910, 912,
       913, 914, 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1162     0 AMB  25-1:1162   3.50    (#   1162:25  Double Ambig)
 &rst
  ixpk= 1162, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 672, 673, 674, 679, 680, 681,
 igr2= 908, 909, 910, 912, 913, 914, 908, 909, 910, 912,
       913, 914,
 &end
#
#    0 AMB  25-3:1163     0 AMB  25-1:1163   4.50    (#   1163:25  Double Ambig)
 &rst
  ixpk= 1163, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.30, r4=10.80,
 igr1= 181, 182, 137, 138, 139, 390, 391, 392,
 igr2= 908, 909, 910, 912, 913, 914, 908, 909, 910, 912,
       913, 914, 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1164     0 AMB  25-1:1164   5.50    (#   1164:25  Double Ambig)
 &rst
  ixpk= 1164, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.59, r4=13.09,
 igr1= 181, 182, 137, 138, 139, 390, 391, 392,
 igr2= 908, 909, 910, 912, 913, 914, 908, 909, 910, 912,
       913, 914, 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1165     0 AMB  25-1:1165   3.50    (#   1165:25  Double Ambig)
 &rst
  ixpk= 1165, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 676, 677, 676, 677, 906,
 igr2= 908, 909, 910, 912, 913, 914, 908, 909, 910, 912,
       913, 914, 908, 909, 910, 912, 913, 914,
 &end
#
#   37 ILE  HG1+         54 VAL  QG+         5.50    (#   1166:25  Unique         2.39, 5.33 A)
 &rst
  ixpk= 1166, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 626, 627,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   31 PHE  HB-          54 VAL  QG+         5.50    (#   1167:25  Unique         3.75, 5.57 A)
 &rst
  ixpk= 1167, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 528, 529,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   54 VAL  HA           54 VAL  QG+         4.50    (#   1168:25  Unique         2.29, 3.59 A)
 &rst
  ixpk= 1168, nxpk= 25, iat= 904,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   56 PHE  QE           54 VAL  QG+         4.50    (#   1169:25  Unique         2.26, 4.48 A)
 &rst
  ixpk= 1169, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 947, 951,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   55 ILE  HN           54 VAL  QG+         4.50    (#   1171:25  Unique         1.98, 4.15 A)
 &rst
  ixpk= 1171, nxpk= 25, iat= 918,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1172     0 AMB  25-1:1172   5.50    (#   1172:25  Double Ambig)
 &rst
  ixpk= 1172, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 902, 131,
 igr2= 908, 909, 910, 912, 913, 914, 908, 909, 910, 912,
       913, 914,
 &end
#
#   40 ILE  HA           54 VAL  QG+         5.50    (#   1173:25  Unique         2.33, 4.77 A)
 &rst
  ixpk= 1173, nxpk= 25, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   56 PHE  QD           54 VAL  QG+         4.50    (#   1174:25  Unique         2.58, 5.81 A)
 &rst
  ixpk= 1174, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 945, 953,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   39 ASP  HN           54 VAL  QG+         5.50    (#   1175:25  Unique         3.79, 6.11 A)
 &rst
  ixpk= 1175, nxpk= 25, iat= 654,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   27 LEU  HB-          54 VAL  QG+         5.50    (#   1176:25  Unique         3.01, 5.42 A)
 &rst
  ixpk= 1176, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 459, 460,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   37 ILE  HG1-         54 VAL  QG-         4.50    (#   1178:25  Unique         2.39, 5.33 A)
 &rst
  ixpk= 1178, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 626, 627,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1179    54 VAL  QG-         2.80    (#   1179:25  Single Ambig)
 &rst
  ixpk= 1179, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 622, 623, 624, 184, 185, 186,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1180    54 VAL  QG-         3.50    (#   1180:25  Single Ambig)
 &rst
  ixpk= 1180, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 672, 673, 674, 679, 680, 681,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   23 LEU  QD2          54 VAL  QG-         4.50    (#   1181:25  Unique         4.53, 7.38 A)
 &rst
  ixpk= 1181, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 394, 395, 396,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   27 LEU  HB-          54 VAL  QG-         4.50    (#   1182:25  Unique         3.01, 5.42 A)
 &rst
  ixpk= 1182, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 459, 460,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1183    54 VAL  QG-         3.50    (#   1183:25  Single Ambig)
 &rst
  ixpk= 1183, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 676, 677, 906,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   54 VAL  HA           54 VAL  QG-         3.50    (#   1184:25  Unique         2.29, 3.59 A)
 &rst
  ixpk= 1184, nxpk= 25, iat= 904,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1185    54 VAL  QG-         4.50    (#   1185:25  Single Ambig)
 &rst
  ixpk= 1185, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 902, 131, 882,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   40 ILE  HA           54 VAL  QG-         5.50    (#   1186:25  Unique         2.33, 4.77 A)
 &rst
  ixpk= 1186, nxpk= 25, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   55 ILE  QG2          55 ILE  HA          4.50    (#   1188:25  Unique         2.42, 3.12 A)
 &rst
  ixpk= 1188, nxpk= 25, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 924, 925, 926,
 &end
#
#   55 ILE  HG1-         55 ILE  HA          4.50    (#   1189:25  Unique         2.15, 3.32 A)
 &rst
  ixpk= 1189, nxpk= 25, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 928, 929,
 &end
#
#   56 PHE  HA           55 ILE  HA          5.50    (#   1191:25  Unique         4.30, 4.51 A)
 &rst
  ixpk= 1191, nxpk= 25, iat= 939, 920, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    8 THR  HA           55 ILE  HA          4.50    (#   1193:25  Unique         2.12, 2.26 A)
 &rst
  ixpk= 1193, nxpk= 25, iat= 119, 920, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   66 LEU  HN           63 SER  HA          4.50    (#   1194:25  Unique         2.30, 3.52 A)
 &rst
  ixpk= 1194, nxpk= 25, iat=1076,1043, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   56 PHE  HN           55 ILE  HA          4.50    (#   1196:25  Unique         2.16, 2.28 A)
 &rst
  ixpk= 1196, nxpk= 25, iat= 937, 920, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:1197    55 ILE  HA          5.50    (#   1197:25  Single Ambig)
 &rst
  ixpk= 1197, nxpk= 25, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 131, 902,
 &end
#
#    0 AMB  25-3:1198    55 ILE  HA          5.50    (#   1198:25  Single Ambig)
 &rst
  ixpk= 1198, nxpk= 25, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 141, 142, 639, 640,
 &end
#
#   38 LEU  HB+          55 ILE  HB          4.50    (#   1199:25  Unique         2.98, 4.23 A)
 &rst
  ixpk= 1199, nxpk= 25, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 639, 640,
 &end
#
#    0 AMB  25-3:1200    55 ILE  HB          2.80    (#   1200:25  Single Ambig)
 &rst
  ixpk= 1200, nxpk= 25, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 924, 925, 926, 931, 932, 933, 644, 645, 646, 648,
       649, 650,
 &end
#
#   39 ASP  HN           55 ILE  HB          4.50    (#   1201:25  Unique         2.31, 2.48 A)
 &rst
  ixpk= 1201, nxpk= 25, iat= 654, 922, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   55 ILE  HN           55 ILE  HB          5.50    (#   1202:25  Unique         2.20, 2.47 A)
 &rst
  ixpk= 1202, nxpk= 25, iat= 918, 922, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1203     0 AMB  25-1:1203   2.80    (#   1203:25  Double Ambig)
 &rst
  ixpk= 1203, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 931, 932, 933, 924, 925, 926,
 igr2= 928, 929, 928, 929,
 &end
#
#    0 AMB  25-3:1204     0 AMB  25-1:1204   2.80    (#   1204:25  Double Ambig)
 &rst
  ixpk= 1204, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 644, 645, 646, 648, 649, 650, 931, 932, 933, 924,
       925, 926,
 igr2= 642, 928, 929,
 &end
#
#    8 THR  QG2          55 ILE  HG1+        5.50    (#   1205:25  Unique         1.90, 3.71 A)
 &rst
  ixpk= 1205, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 123, 124, 125,
 igr2= 928, 929,
 &end
#
#    8 THR  QG2          55 ILE  HG1-        4.50    (#   1206:25  Unique         1.90, 3.71 A)
 &rst
  ixpk= 1206, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 123, 124, 125,
 igr2= 928, 929,
 &end
#
#   39 ASP  HN            0 AMB  25-1:1209   5.50    (#   1209:25  Single Ambig)
 &rst
  ixpk= 1209, nxpk= 25, iat= 654,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 642, 928, 929,
 &end
#
#    8 THR  QG2          55 ILE  QD1         3.50    (#   1210:25  Unique         2.29, 3.98 A)
 &rst
  ixpk= 1210, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 123, 124, 125,
 igr2= 931, 932, 933,
 &end
#
#   55 ILE  HG1-         55 ILE  QD1         3.50    (#   1211:25  Unique         2.23, 2.66 A)
 &rst
  ixpk= 1211, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 928, 929,
 igr2= 931, 932, 933,
 &end
#
#   55 ILE  HG1+         55 ILE  QD1         3.50    (#   1212:25  Unique         2.23, 2.66 A)
 &rst
  ixpk= 1212, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 928, 929,
 igr2= 931, 932, 933,
 &end
#
#    0 AMB  25-3:1213    55 ILE  QD1         3.50    (#   1213:25  Single Ambig)
 &rst
  ixpk= 1213, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 689, 676, 677, 670,
 igr2= 931, 932, 933,
 &end
#
#   55 ILE  HB           55 ILE  QD1         3.50    (#   1214:25  Unique         2.35, 3.28 A)
 &rst
  ixpk= 1214, nxpk= 25, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 931, 932, 933,
 &end
#
#   39 ASP  HB-          55 ILE  QD1         4.50    (#   1215:25  Unique         2.48, 4.41 A)
 &rst
  ixpk= 1215, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 658, 659,
 igr2= 931, 932, 933,
 &end
#
#    0 AMB  25-3:1216    55 ILE  QD1         4.50    (#   1216:25  Single Ambig)
 &rst
  ixpk= 1216, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 886, 887, 886, 887,
 igr2= 931, 932, 933,
 &end
#
#   39 ASP  HB+          55 ILE  QD1         4.50    (#   1217:25  Unique         2.48, 4.41 A)
 &rst
  ixpk= 1217, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 658, 659,
 igr2= 931, 932, 933,
 &end
#
#   55 ILE  HN           55 ILE  QD1         5.50    (#   1218:25  Unique         2.41, 3.17 A)
 &rst
  ixpk= 1218, nxpk= 25, iat= 918,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 931, 932, 933,
 &end
#
#   56 PHE  HN           55 ILE  QD1         5.50    (#   1219:25  Unique         5.49, 6.23 A)
 &rst
  ixpk= 1219, nxpk= 25, iat= 937,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 931, 932, 933,
 &end
#
#    0 AMB  25-3:1220    55 ILE  QD1         5.50    (#   1220:25  Single Ambig)
 &rst
  ixpk= 1220, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 622, 623, 624, 464, 465, 466,
 igr2= 931, 932, 933,
 &end
#
#   56 PHE  HN           55 ILE  QG2         5.50    (#   1224:25  Unique         2.54, 3.45 A)
 &rst
  ixpk= 1224, nxpk= 25, iat= 937,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 924, 925, 926,
 &end
#
#    7 GLN  HE2-         55 ILE  QG2         5.50    (#   1226:25  Unique         2.76, 4.52 A)
 &rst
  ixpk= 1226, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 112, 113,
 igr2= 924, 925, 926,
 &end
#
#    0 AMB  25-3:1227    55 ILE  QG2         5.50    (#   1227:25  Single Ambig)
 &rst
  ixpk= 1227, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 107, 108, 658, 659,
 igr2= 924, 925, 926,
 &end
#
#   32 SER  HA           56 PHE  HB-         7.00    (#   1229:25  Unique         6.13, 7.41 A)
 &rst
  ixpk= 1229, nxpk= 25, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 941, 942,
 &end
#
#    0 AMB  25-3:1230     0 AMB  25-1:1230   4.50    (#   1230:25  Double Ambig)
 &rst
  ixpk= 1230, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1182,1190, 945, 953,
 igr2=1178,1179, 941, 942,
 &end
#
#   72 PHE  HN           72 PHE  HB-         5.50    (#   1231:25  Unique         2.14, 2.50 A)
 &rst
  ixpk= 1231, nxpk= 25, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1178,1179,
 &end
#
#   56 PHE  QD           56 PHE  HB-         5.50    (#   1232:25  Unique         2.24, 3.08 A)
 &rst
  ixpk= 1232, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 945, 953,
 igr2= 941, 942,
 &end
#
#   56 PHE  HN           56 PHE  HB+         5.50    (#   1233:25  Unique         2.22, 3.12 A)
 &rst
  ixpk= 1233, nxpk= 25, iat= 937,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 941, 942,
 &end
#
#   38 LEU  QD+          57 LYS  HA          3.50    (#   1234:25  Unique         2.27, 4.25 A)
 &rst
  ixpk= 1234, nxpk= 25, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 644, 645, 646, 648, 649, 650,
 &end
#
#    0 AMB  25-3:1235    57 LYS  HA          4.50    (#   1235:25  Single Ambig)
 &rst
  ixpk= 1235, nxpk= 25, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 639, 640, 642,
 &end
#
#    0 AMB  25-3:1236    57 LYS  HA          2.80    (#   1236:25  Single Ambig)
 &rst
  ixpk= 1236, nxpk= 25, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 964, 965, 964, 965, 961, 962,
 &end
#
#   57 LYS  HB+          57 LYS  HA          5.50    (#   1237:25  Unique         2.35, 2.49 A)
 &rst
  ixpk= 1237, nxpk= 25, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 961, 962,
 &end
#
#    7 GLN  HE2+         57 LYS  HA          5.50    (#   1238:25  Unique         2.64, 3.67 A)
 &rst
  ixpk= 1238, nxpk= 25, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 112, 113,
 &end
#
#   57 LYS  HA           57 LYS  HB-         5.50    (#   1242:25  Unique         2.35, 2.49 A)
 &rst
  ixpk= 1242, nxpk= 25, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 961, 962,
 &end
#
#   57 LYS  HA           57 LYS  HB+         3.50    (#   1243:25  Unique         2.35, 2.49 A)
 &rst
  ixpk= 1243, nxpk= 25, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 961, 962,
 &end
#
#   57 LYS  HN           57 LYS  HB+         4.50    (#   1244:25  Unique         2.41, 3.08 A)
 &rst
  ixpk= 1244, nxpk= 25, iat= 957,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 961, 962,
 &end
#
#   57 LYS  HN           57 LYS  HB-         5.50    (#   1245:25  Unique         2.41, 3.08 A)
 &rst
  ixpk= 1245, nxpk= 25, iat= 957,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 961, 962,
 &end
#
#   59 ILE  HN           57 LYS  HB+         7.00    (#   1246:25  Unique         6.93, 7.63 A)
 &rst
  ixpk= 1246, nxpk= 25, iat= 994,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 961, 962,
 &end
#
#    0 AMB  25-3:1248     0 AMB  25-1:1248   3.50    (#   1248:25  Double Ambig)
 &rst
  ixpk= 1248, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 967, 968, 967, 968,
 igr2= 961, 962, 961, 962,
 &end
#
#    0 AMB  25-3:1249    57 LYS  HB-         3.50    (#   1249:25  Single Ambig)
 &rst
  ixpk= 1249, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 967, 968, 967, 968,
 igr2= 961, 962,
 &end
#
#    0 AMB  25-3:1250     0 AMB  25-1:1250   2.80    (#   1250:25  Double Ambig)
 &rst
  ixpk= 1250, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 961, 962, 961, 962,
 igr2= 964, 965, 964, 965,
 &end
#
#    0 AMB  25-3:1251     0 AMB  25-1:1251   2.80    (#   1251:25  Double Ambig)
 &rst
  ixpk= 1251, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 276, 277, 276, 277, 967, 968, 967, 968, 967, 968,
      
 igr2= 273, 274, 273, 274, 964, 965, 964, 965, 964, 965,
      
 &end
#
#    0 AMB  25-3:1252     0 AMB  25-1:1252   3.50    (#   1252:25  Double Ambig)
 &rst
  ixpk= 1252, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
 igr1= 970, 971, 970, 971, 970, 971, 279, 280, 279, 280,
      
 igr2= 964, 965, 964, 965, 964, 965, 273, 274, 273, 274,
      
 &end
#
#    0 AMB  25-3:1253     0 AMB  25-1:1253   3.50    (#   1253:25  Double Ambig)
 &rst
  ixpk= 1253, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 309, 268,1022,
 igr2= 737, 738, 273, 274, 964, 965, 964, 965,
 &end
#
#   57 LYS  HA            0 AMB  25-1:1254   4.50    (#   1254:25  Single Ambig)
 &rst
  ixpk= 1254, nxpk= 25, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 964, 965, 964, 965,
 &end
#
#    0 AMB  25-3:1255     0 AMB  25-1:1255   5.50    (#   1255:25  Double Ambig)
 &rst
  ixpk= 1255, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 983, 984, 983, 984, 986, 987,
 igr2= 964, 965, 964, 965, 964, 965,
 &end
#
#   57 LYS  HN            0 AMB  25-1:1257   5.50    (#   1257:25  Single Ambig)
 &rst
  ixpk= 1257, nxpk= 25, iat= 957,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 964, 965, 964, 965,
 &end
#
#   56 PHE  QD            0 AMB  25-1:1260   5.50    (#   1260:25  Single Ambig)
 &rst
  ixpk= 1260, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 945, 953,
 igr2= 964, 965, 964, 965,
 &end
#
#    0 AMB  25-3:1261     0 AMB  25-1:1261   5.50    (#   1261:25  Double Ambig)
 &rst
  ixpk= 1261, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 986, 987, 986, 987,
 igr2= 964, 965, 964, 965,
 &end
#
#   36 GLN  HG-           0 AMB  25-1:1262   4.50    (#   1262:25  Single Ambig)
 &rst
  ixpk= 1262, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 606, 607,
 igr2= 967, 968, 967, 968,
 &end
#
#   57 LYS  HA            0 AMB  25-1:1263   5.50    (#   1263:25  Single Ambig)
 &rst
  ixpk= 1263, nxpk= 25, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 967, 968, 967, 968,
 &end
#
#    0 AMB  25-3:1268     0 AMB  25-1:1268   3.50    (#   1268:25  Double Ambig)
 &rst
  ixpk= 1268, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 298, 299, 691, 692, 693, 695, 696, 697,
 igr2= 279, 280, 279, 280, 342, 343,
 &end
#
#    0 AMB  25-3:1270     0 AMB  25-1:1270   3.50    (#   1270:25  Double Ambig)
 &rst
  ixpk= 1270, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 606, 607, 358, 359,
 igr2= 970, 971, 970, 971, 413, 414,
 &end
#
#   58 GLU  HA           58 GLU  HB+         4.50    (#   1281:25  Unique         2.50, 2.83 A)
 &rst
  ixpk= 1281, nxpk= 25, iat= 981,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 983, 984,
 &end
#
#   61 SER  HN           58 GLU  HB-         5.50    (#   1282:25  Unique         2.22, 3.24 A)
 &rst
  ixpk= 1282, nxpk= 25, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 983, 984,
 &end
#
#   58 GLU  HN           58 GLU  HB-         4.50    (#   1283:25  Unique         2.77, 3.22 A)
 &rst
  ixpk= 1283, nxpk= 25, iat= 979,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 983, 984,
 &end
#
#   58 GLU  HN           58 GLU  HB+         5.50    (#   1284:25  Unique         2.77, 3.22 A)
 &rst
  ixpk= 1284, nxpk= 25, iat= 979,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 983, 984,
 &end
#
#   58 GLU  HA            0 AMB  25-1:1285   3.50    (#   1285:25  Single Ambig)
 &rst
  ixpk= 1285, nxpk= 25, iat= 981,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 986, 987, 107, 108,
 &end
#
#   58 GLU  HA           58 GLU  HG-         3.50    (#   1286:25  Unique         2.27, 3.03 A)
 &rst
  ixpk= 1286, nxpk= 25, iat= 981,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 986, 987,
 &end
#
#   58 GLU  HN           58 GLU  HG-         5.50    (#   1287:25  Unique         3.42, 4.50 A)
 &rst
  ixpk= 1287, nxpk= 25, iat= 979,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 986, 987,
 &end
#
#    0 AMB  25-3:1289     0 AMB  25-1:1289   4.50    (#   1289:25  Double Ambig)
 &rst
  ixpk= 1289, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 961, 962, 429, 430,
 igr2= 986, 987, 373, 374,
 &end
#
#    0 AMB  25-3:1290    58 GLU  HG-         4.50    (#   1290:25  Single Ambig)
 &rst
  ixpk= 1290, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 964, 965, 964, 965, 961, 962,
 igr2= 986, 987,
 &end
#
#    0 AMB  25-3:1291    59 ILE  HA          3.50    (#   1291:25  Single Ambig)
 &rst
  ixpk= 1291, nxpk= 25, iat=  -1, 996, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1035,1036,1037, 998,
 &end
#
#    0 AMB  25-3:1292    59 ILE  HA          3.50    (#   1292:25  Single Ambig)
 &rst
  ixpk= 1292, nxpk= 25, iat=  -1, 996, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1004,1005,1007,1008,1009, 137, 138, 139,
 &end
#
#    7 GLN  HA           59 ILE  HA          4.50    (#   1293:25  Unique         2.27, 2.59 A)
 &rst
  ixpk= 1293, nxpk= 25, iat= 102, 996, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 PRO  HA           59 ILE  HA          5.50    (#   1294:25  Unique         4.05, 4.48 A)
 &rst
  ixpk= 1294, nxpk= 25, iat=  82, 996, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   59 ILE  HN           59 ILE  HA          5.50    (#   1296:25  Unique         2.81, 2.84 A)
 &rst
  ixpk= 1296, nxpk= 25, iat= 994, 996, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1297    59 ILE  HB          2.80    (#   1297:25  Single Ambig)
 &rst
  ixpk= 1297, nxpk= 25, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1=1004,1005,1007,1008,1009,
 &end
#
#   59 ILE  QG2          59 ILE  HB          3.50    (#   1298:25  Unique         2.36, 2.66 A)
 &rst
  ixpk= 1298, nxpk= 25, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1000,1001,1002,
 &end
#
#    0 AMB  25-3:1300    59 ILE  HB          4.50    (#   1300:25  Single Ambig)
 &rst
  ixpk= 1300, nxpk= 25, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 994,1013,
 &end
#
#    0 AMB  25-3:1303     0 AMB  25-1:1303   4.50    (#   1303:25  Double Ambig)
 &rst
  ixpk= 1303, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 994,1013,
 igr2=1004,1005,1004,1005,
 &end
#
#    0 AMB  25-3:1304    59 ILE  HG1-        5.50    (#   1304:25  Single Ambig)
 &rst
  ixpk= 1304, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 994,1013,
 igr2=1004,1005,
 &end
#
#    6 ASN  HA           59 ILE  HG1-        5.50    (#   1305:25  Unique         5.45, 6.02 A)
 &rst
  ixpk= 1305, nxpk= 25, iat=  88,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1004,1005,
 &end
#
#    6 ASN  HA           59 ILE  HG1+        5.50    (#   1306:25  Unique         5.45, 6.02 A)
 &rst
  ixpk= 1306, nxpk= 25, iat=  88,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1004,1005,
 &end
#
#    0 AMB  25-3:1308    59 ILE  QD1         2.80    (#   1308:25  Single Ambig)
 &rst
  ixpk= 1308, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1=1004,1005, 998,
 igr2=1007,1008,1009,
 &end
#
#    0 AMB  25-3:1310    59 ILE  QD1         4.50    (#   1310:25  Single Ambig)
 &rst
  ixpk= 1310, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=  73,  74, 996,
 igr2=1007,1008,1009,
 &end
#
#    6 ASN  HA           59 ILE  QD1         4.50    (#   1311:25  Unique         4.25, 5.48 A)
 &rst
  ixpk= 1311, nxpk= 25, iat=  88,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1007,1008,1009,
 &end
#
#    0 AMB  25-3:1313    59 ILE  QD1         5.50    (#   1313:25  Single Ambig)
 &rst
  ixpk= 1313, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 994,1013,
 igr2=1007,1008,1009,
 &end
#
#    5 PRO  HB+          59 ILE  QD1         4.50    (#   1314:25  Unique         2.22, 3.63 A)
 &rst
  ixpk= 1314, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  79,  80,
 igr2=1007,1008,1009,
 &end
#
#    5 PRO  HB+          59 ILE  QG2         3.50    (#   1318:25  Unique         4.05, 4.90 A)
 &rst
  ixpk= 1318, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=  79,  80,
 igr2=1000,1001,1002,
 &end
#
#   59 ILE  HB           59 ILE  QG2         2.80    (#   1319:25  Unique         2.36, 2.66 A)
 &rst
  ixpk= 1319, nxpk= 25, iat= 998,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1000,1001,1002,
 &end
#
#    5 PRO  HG-          59 ILE  QG2         5.50    (#   1320:25  Unique         6.15, 7.03 A)
 &rst
  ixpk= 1320, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  76,  77,
 igr2=1000,1001,1002,
 &end
#
#   59 ILE  HA           59 ILE  QG2         4.50    (#   1321:25  Unique         2.39, 3.12 A)
 &rst
  ixpk= 1321, nxpk= 25, iat= 996,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1000,1001,1002,
 &end
#
#   59 ILE  HN           59 ILE  QG2         4.50    (#   1322:25  Unique         2.11, 2.99 A)
 &rst
  ixpk= 1322, nxpk= 25, iat= 994,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1000,1001,1002,
 &end
#
#   60 GLY  HN           60 GLY  HA+         5.50    (#   1326:25  Unique         1.85, 2.58 A)
 &rst
  ixpk= 1326, nxpk= 25, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1015,1016,
 &end
#
#   60 GLY  HN           60 GLY  HA-         5.50    (#   1327:25  Unique         1.85, 2.58 A)
 &rst
  ixpk= 1327, nxpk= 25, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1015,1016,
 &end
#
#   61 SER  HN           60 GLY  HA+         5.50    (#   1328:25  Unique         2.51, 3.22 A)
 &rst
  ixpk= 1328, nxpk= 25, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1015,1016,
 &end
#
#   61 SER  HN           60 GLY  HA-         5.50    (#   1329:25  Unique         2.51, 3.22 A)
 &rst
  ixpk= 1329, nxpk= 25, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1015,1016,
 &end
#
#    0 AMB  25-3:1331    61 SER  HA          7.00    (#   1331:25  Single Ambig)
 &rst
  ixpk= 1331, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1054, 574,
 &end
#
#   61 SER  HB+          61 SER  HA          5.50    (#   1332:25  Unique         2.35, 2.74 A)
 &rst
  ixpk= 1332, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1024,1025,
 &end
#
#    0 AMB  25-3:1333    61 SER  HA          4.50    (#   1333:25  Single Ambig)
 &rst
  ixpk= 1333, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1056,1057,1056,1057,
 &end
#
#   54 VAL  QG+          54 VAL  HA          5.50    (#   1334:25  Unique         2.29, 3.59 A)
 &rst
  ixpk= 1334, nxpk= 25, iat=  -1, 904, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1335    61 SER  HA          5.50    (#   1335:25  Single Ambig)
 &rst
  ixpk= 1335, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 594, 595,1015,1016,1045,1046,
 &end
#
#    0 AMB  25-3:1337    54 VAL  HA          5.50    (#   1337:25  Single Ambig)
 &rst
  ixpk= 1337, nxpk= 25, iat=  -1, 904, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 691, 692, 693, 695, 696, 697, 924, 925, 926, 390,
       391, 392,
 &end
#
#   64 ASN  HN           61 SER  HA          5.50    (#   1338:25  Unique         2.70, 3.37 A)
 &rst
  ixpk= 1338, nxpk= 25, iat=1052,1022, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   64 ASN  HD2+         61 SER  HA          5.50    (#   1339:25  Unique         4.26, 5.30 A)
 &rst
  ixpk= 1339, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1061,1062,
 &end
#
#   55 ILE  HN           54 VAL  HA          4.50    (#   1340:25  Unique         1.84, 2.07 A)
 &rst
  ixpk= 1340, nxpk= 25, iat= 918, 904, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   61 SER  HA           61 SER  HB+         5.50    (#   1341:25  Unique         2.35, 2.74 A)
 &rst
  ixpk= 1341, nxpk= 25, iat=1022,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1024,1025,
 &end
#
#   61 SER  HN           61 SER  HB+         5.50    (#   1345:25  Unique         2.52, 3.10 A)
 &rst
  ixpk= 1345, nxpk= 25, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1024,1025,
 &end
#
#    0 AMB  25-3:1346     0 AMB  25-1:1346   5.50    (#   1346:25  Double Ambig)
 &rst
  ixpk= 1346, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 939, 981,1068,
 igr2=1024,1025,1024,1025,1024,1025,
 &end
#
#   62 ALA  HN           62 ALA  HA          5.50    (#   1347:25  Unique         2.82, 2.84 A)
 &rst
  ixpk= 1347, nxpk= 25, iat=1031,1033, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   56 PHE  QD           62 ALA  HA          5.50    (#   1348:25  Unique         2.43, 3.58 A)
 &rst
  ixpk= 1348, nxpk= 25, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 945, 953,
 &end
#
#    0 AMB  25-3:1350     0 AMB  25-1:1350   4.50    (#   1350:25  Double Ambig)
 &rst
  ixpk= 1350, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 567, 568, 947, 951, 482, 491,
 igr2= 497,1033,
 &end
#
#    0 AMB  25-3:1351    29 ALA  HA          5.50    (#   1351:25  Single Ambig)
 &rst
  ixpk= 1351, nxpk= 25, iat=  -1, 497, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 435, 436, 435, 436,
 &end
#
#    9 ILE  QG2          62 ALA  HA          4.50    (#   1352:25  Unique         3.23, 4.05 A)
 &rst
  ixpk= 1352, nxpk= 25, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 137, 138, 139,
 &end
#
#   65 ALA  QB           62 ALA  HA          5.50    (#   1353:25  Unique         2.55, 3.73 A)
 &rst
  ixpk= 1353, nxpk= 25, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1070,1071,1072,
 &end
#
#    0 AMB  25-3:1354     0 AMB  25-1:1354   3.50    (#   1354:25  Double Ambig)
 &rst
  ixpk= 1354, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 499, 500, 501,1035,1036,1037,
 igr2= 497,1033,
 &end
#
#    9 ILE  QG2          62 ALA  QB          3.50    (#   1355:25  Unique         2.25, 3.89 A)
 &rst
  ixpk= 1355, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 137, 138, 139,
 igr2=1035,1036,1037,
 &end
#
#    5 PRO  HG-          62 ALA  QB          5.50    (#   1356:25  Unique         6.20, 7.90 A)
 &rst
  ixpk= 1356, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  76,  77,
 igr2=1035,1036,1037,
 &end
#
#    0 AMB  25-3:1357     0 AMB  25-1:1357   2.80    (#   1357:25  Double Ambig)
 &rst
  ixpk= 1357, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 497,1033,
 igr2= 499, 500, 501,1035,1036,1037,
 &end
#
#    0 AMB  25-3:1358    62 ALA  QB          4.50    (#   1358:25  Single Ambig)
 &rst
  ixpk= 1358, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 941, 942, 996,
 igr2=1035,1036,1037,
 &end
#
#   61 SER  HB+          62 ALA  QB          5.50    (#   1359:25  Unique         4.24, 5.68 A)
 &rst
  ixpk= 1359, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1024,1025,
 igr2=1035,1036,1037,
 &end
#
#    7 GLN  HA           62 ALA  QB          4.50    (#   1360:25  Unique         2.15, 3.33 A)
 &rst
  ixpk= 1360, nxpk= 25, iat= 102,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1035,1036,1037,
 &end
#
#   56 PHE  QD           62 ALA  QB          4.50    (#   1362:25  Unique         2.49, 4.73 A)
 &rst
  ixpk= 1362, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 945, 953,
 igr2=1035,1036,1037,
 &end
#
#   63 SER  HN           62 ALA  QB          4.50    (#   1363:25  Unique         2.33, 3.28 A)
 &rst
  ixpk= 1363, nxpk= 25, iat=1041,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1035,1036,1037,
 &end
#
#   62 ALA  HN           62 ALA  QB          3.50    (#   1364:25  Unique         2.41, 2.88 A)
 &rst
  ixpk= 1364, nxpk= 25, iat=1031,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1035,1036,1037,
 &end
#
#   59 ILE  QG2          62 ALA  QB          5.50    (#   1365:25  Unique         4.03, 5.98 A)
 &rst
  ixpk= 1365, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1000,1001,1002,
 igr2=1035,1036,1037,
 &end
#
#   30 ILE  HG1-         29 ALA  QB          5.50    (#   1366:25  Unique         2.20, 4.43 A)
 &rst
  ixpk= 1366, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 515, 516,
 igr2= 499, 500, 501,
 &end
#
#    0 AMB  25-3:1367    62 ALA  QB          5.50    (#   1367:25  Single Ambig)
 &rst
  ixpk= 1367, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1080,1081, 141, 142,
 igr2=1035,1036,1037,
 &end
#
#    0 AMB  25-3:1368    63 SER  HA          3.50    (#   1368:25  Single Ambig)
 &rst
  ixpk= 1368, nxpk= 25, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1045,1046,1045,1046,
 &end
#
#    0 AMB  25-3:1370    63 SER  HA          5.50    (#   1370:25  Single Ambig)
 &rst
  ixpk= 1370, nxpk= 25, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1070,1071,1072,1083,
 &end
#
#   66 LEU  MDX          63 SER  HA          5.50    (#   1371:25  Unique         3.08, 4.94 A)
 &rst
  ixpk= 1371, nxpk= 25, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HB+          63 SER  HA          5.50    (#   1372:25  Unique         1.99, 2.92 A)
 &rst
  ixpk= 1372, nxpk= 25, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1080,1081,
 &end
#
#   63 SER  HN            0 AMB  25-1:1376   3.50    (#   1376:25  Single Ambig)
 &rst
  ixpk= 1376, nxpk= 25, iat=1041,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1045,1046,1045,1046,
 &end
#
#   64 ASN  HN            0 AMB  25-1:1377   3.50    (#   1377:25  Single Ambig)
 &rst
  ixpk= 1377, nxpk= 25, iat=1052,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1045,1046,1045,1046,
 &end
#
#   63 SER  HA            0 AMB  25-1:1379   3.50    (#   1379:25  Single Ambig)
 &rst
  ixpk= 1379, nxpk= 25, iat=1043,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1045,1046,1045,1046,
 &end
#
#   64 ASN  HN           64 ASN  HA          3.50    (#   1384:25  Unique         2.83, 2.86 A)
 &rst
  ixpk= 1384, nxpk= 25, iat=1052,1054, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 LEU  HN           64 ASN  HA          5.50    (#   1385:25  Unique         4.50, 4.64 A)
 &rst
  ixpk= 1385, nxpk= 25, iat=1076,1054, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   68 THR  HN           64 ASN  HA          5.50    (#   1386:25  Unique         3.61, 3.87 A)
 &rst
  ixpk= 1386, nxpk= 25, iat=1119,1054, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   61 SER  HA           64 ASN  HA          5.50    (#   1390:25  Unique         4.69, 5.39 A)
 &rst
  ixpk= 1390, nxpk= 25, iat=1022,1054, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1391    64 ASN  HA          2.80    (#   1391:25  Single Ambig)
 &rst
  ixpk= 1391, nxpk= 25, iat=  -1,1054, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1056,1057,1056,1057,
 &end
#
#   67 ARG  HG-          64 ASN  HA          5.50    (#   1392:25  Unique         4.12, 5.37 A)
 &rst
  ixpk= 1392, nxpk= 25, iat=  -1,1054, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1102,1103,
 &end
#
#   67 ARG  HB+          64 ASN  HA          5.50    (#   1393:25  Unique         2.51, 3.59 A)
 &rst
  ixpk= 1393, nxpk= 25, iat=  -1,1054, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1099,1100,
 &end
#
#   67 ARG  HN           64 ASN  HA          5.50    (#   1394:25  Unique         3.41, 3.64 A)
 &rst
  ixpk= 1394, nxpk= 25, iat=1095,1054, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1395     0 AMB  25-1:1395   5.50    (#   1395:25  Double Ambig)
 &rst
  ixpk= 1395, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1= 576, 577, 576, 577,1033,
 igr2=1056,1057,1056,1057,1056,1057,
 &end
#
#   61 SER  HA            0 AMB  25-1:1396   5.50    (#   1396:25  Single Ambig)
 &rst
  ixpk= 1396, nxpk= 25, iat=1022,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1056,1057,1056,1057,
 &end
#
#   64 ASN  HA            0 AMB  25-1:1397   2.80    (#   1397:25  Single Ambig)
 &rst
  ixpk= 1397, nxpk= 25, iat=1054,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1056,1057,1056,1057,
 &end
#
#    0 AMB  25-3:1399     0 AMB  25-1:1399   4.50    (#   1399:25  Double Ambig)
 &rst
  ixpk= 1399, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1= 580, 588, 592,1095, 572,
 igr2=1056,1057,1056,1057,1056,1057,1056,1057,1056,1057,
      
 &end
#
#   64 ASN  HN            0 AMB  25-1:1400   3.50    (#   1400:25  Single Ambig)
 &rst
  ixpk= 1400, nxpk= 25, iat=1052,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1056,1057,1056,1057,
 &end
#
#    0 AMB  25-3:1401     0 AMB  25-1:1401   4.50    (#   1401:25  Double Ambig)
 &rst
  ixpk= 1401, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1061,1062,1061,1062,
 igr2=1056,1057,1056,1057,
 &end
#
#   65 ALA  HN            0 AMB  25-1:1402   3.50    (#   1402:25  Single Ambig)
 &rst
  ixpk= 1402, nxpk= 25, iat=1066,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1056,1057,1056,1057,
 &end
#
#    0 AMB  25-3:1404     0 AMB  25-1:1404   4.50    (#   1404:25  Double Ambig)
 &rst
  ixpk= 1404, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1061,1062,1061,1062,
 igr2=1056,1057,1056,1057,
 &end
#
#    0 AMB  25-3:1405     0 AMB  25-1:1405   4.50    (#   1405:25  Double Ambig)
 &rst
  ixpk= 1405, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1= 580, 588, 592,1095, 572,
 igr2=1056,1057,1056,1057,1056,1057,1056,1057,1056,1057,
      
 &end
#
#   64 ASN  HN            0 AMB  25-1:1406   3.50    (#   1406:25  Single Ambig)
 &rst
  ixpk= 1406, nxpk= 25, iat=1052,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1056,1057,1056,1057,
 &end
#
#   65 ALA  HN            0 AMB  25-1:1407   4.50    (#   1407:25  Single Ambig)
 &rst
  ixpk= 1407, nxpk= 25, iat=1066,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1056,1057,1056,1057,
 &end
#
#   64 ASN  HA            0 AMB  25-1:1408   3.50    (#   1408:25  Single Ambig)
 &rst
  ixpk= 1408, nxpk= 25, iat=1054,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1056,1057,1056,1057,
 &end
#
#   61 SER  HA            0 AMB  25-1:1409   5.50    (#   1409:25  Single Ambig)
 &rst
  ixpk= 1409, nxpk= 25, iat=1022,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1056,1057,1056,1057,
 &end
#
#    0 AMB  25-3:1410    42 ALA  QB          4.50    (#   1410:25  Single Ambig)
 &rst
  ixpk= 1410, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 333, 334, 811, 812, 811, 812,
 igr2= 705, 706, 707,
 &end
#
#    0 AMB  25-3:1411    42 ALA  QB          5.50    (#   1411:25  Single Ambig)
 &rst
  ixpk= 1411, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 687, 309,
 igr2= 705, 706, 707,
 &end
#
#    9 ILE  QD1          65 ALA  QB          3.50    (#   1412:25  Unique         2.66, 4.43 A)
 &rst
  ixpk= 1412, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 144, 145, 146,
 igr2=1070,1071,1072,
 &end
#
#    9 ILE  QG2          65 ALA  QB          3.50    (#   1413:25  Unique         3.17, 5.79 A)
 &rst
  ixpk= 1413, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 137, 138, 139,
 igr2=1070,1071,1072,
 &end
#
#    0 AMB  25-3:1414    65 ALA  QB          3.50    (#   1414:25  Single Ambig)
 &rst
  ixpk= 1414, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1080,1081, 141, 142,
 igr2=1070,1071,1072,
 &end
#
#   62 ALA  QB           65 ALA  QB          5.50    (#   1415:25  Unique         4.48, 6.16 A)
 &rst
  ixpk= 1415, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1035,1036,1037,
 igr2=1070,1071,1072,
 &end
#
#   66 LEU  HB+          65 ALA  QB          5.50    (#   1416:25  Unique         3.94, 5.47 A)
 &rst
  ixpk= 1416, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1080,1081,
 igr2=1070,1071,1072,
 &end
#
#   69 MET  HG-          65 ALA  QB          3.50    (#   1417:25  Unique         2.79, 4.78 A)
 &rst
  ixpk= 1417, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1140,1141,
 igr2=1070,1071,1072,
 &end
#
#    0 AMB  25-3:1418    65 ALA  QB          4.50    (#   1418:25  Single Ambig)
 &rst
  ixpk= 1418, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 576, 577, 528, 529,1056,1057,1056,1057,
 igr2=1070,1071,1072,
 &end
#
#    0 AMB  25-3:1419    65 ALA  QB          3.50    (#   1419:25  Single Ambig)
 &rst
  ixpk= 1419, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1033, 576, 577,
 igr2=1070,1071,1072,
 &end
#
#   31 PHE  QE           65 ALA  QB          4.50    (#   1420:25  Unique         2.30, 6.25 A)
 &rst
  ixpk= 1420, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 534, 538,
 igr2=1070,1071,1072,
 &end
#
#   56 PHE  QE           65 ALA  QB          3.50    (#   1421:25  Unique         2.87, 4.02 A)
 &rst
  ixpk= 1421, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 947, 951,
 igr2=1070,1071,1072,
 &end
#
#   56 PHE  QD           65 ALA  QB          3.50    (#   1422:25  Unique         3.80, 5.02 A)
 &rst
  ixpk= 1422, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 945, 953,
 igr2=1070,1071,1072,
 &end
#
#   64 ASN  HN           65 ALA  QB          5.50    (#   1423:25  Unique         4.46, 5.44 A)
 &rst
  ixpk= 1423, nxpk= 25, iat=1052,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1070,1071,1072,
 &end
#
#   31 PHE  QD           65 ALA  QB          3.50    (#   1424:25  Unique         2.30, 5.40 A)
 &rst
  ixpk= 1424, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 532, 540,
 igr2=1070,1071,1072,
 &end
#
#    0 AMB  25-3:1425    65 ALA  QB          5.50    (#   1425:25  Single Ambig)
 &rst
  ixpk= 1425, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1061,1062,1133,
 igr2=1070,1071,1072,
 &end
#
#    0 AMB  25-3:1426    65 ALA  QB          2.80    (#   1426:25  Single Ambig)
 &rst
  ixpk= 1426, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1076,1066,
 igr2=1070,1071,1072,
 &end
#
#    0 AMB  25-3:1427    65 ALA  QB          5.50    (#   1427:25  Single Ambig)
 &rst
  ixpk= 1427, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 574,1054,
 igr2=1070,1071,1072,
 &end
#
#   81 ILE  QG2          66 LEU  HA          4.50    (#   1428:25  Unique         2.31, 3.79 A)
 &rst
  ixpk= 1428, nxpk= 25, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1337,1338,1339,
 &end
#
#    0 AMB  25-3:1429    66 LEU  HA          4.50    (#   1429:25  Single Ambig)
 &rst
  ixpk= 1429, nxpk= 25, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1344,1345,1346, 137, 138, 139,
 &end
#
#   66 LEU  HG           66 LEU  HA          4.50    (#   1430:25  Unique         2.30, 2.57 A)
 &rst
  ixpk= 1430, nxpk= 25, iat=1083,1078, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   66 LEU  HB-          66 LEU  HA          4.50    (#   1431:25  Unique         2.50, 2.82 A)
 &rst
  ixpk= 1431, nxpk= 25, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1080,1081,
 &end
#
#    0 AMB  25-3:1432    66 LEU  HA          5.50    (#   1432:25  Single Ambig)
 &rst
  ixpk= 1432, nxpk= 25, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1080,1081,1335,
 &end
#
#   66 LEU  HN           66 LEU  HA          5.50    (#   1433:25  Unique         2.59, 2.78 A)
 &rst
  ixpk= 1433, nxpk= 25, iat=1076,1078, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   66 LEU  HN           66 LEU  HB-         4.50    (#   1435:25  Unique         2.03, 2.46 A)
 &rst
  ixpk= 1435, nxpk= 25, iat=1076,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1080,1081,
 &end
#
#   66 LEU  HN           66 LEU  HB+         4.50    (#   1436:25  Unique         2.03, 2.46 A)
 &rst
  ixpk= 1436, nxpk= 25, iat=1076,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1080,1081,
 &end
#
#   66 LEU  HA           66 LEU  HB-         4.50    (#   1437:25  Unique         2.50, 2.82 A)
 &rst
  ixpk= 1437, nxpk= 25, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1080,1081,
 &end
#
#   66 LEU  HA           66 LEU  HB+         5.50    (#   1438:25  Unique         2.50, 2.82 A)
 &rst
  ixpk= 1438, nxpk= 25, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1080,1081,
 &end
#
#   66 LEU  MDY          66 LEU  HB+         5.50    (#   1439:25  Unique         2.25, 3.32 A)
 &rst
  ixpk= 1439, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1080,1081,
 &end
#
#   66 LEU  MDY          66 LEU  HB-         5.50    (#   1440:25  Unique         2.25, 3.32 A)
 &rst
  ixpk= 1440, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1080,1081,
 &end
#
#   66 LEU  MDX          66 LEU  HB-         5.50    (#   1441:25  Unique         2.25, 3.32 A)
 &rst
  ixpk= 1441, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1080,1081,
 &end
#
#   66 LEU  MDX          66 LEU  HB+         5.50    (#   1442:25  Unique         2.25, 3.32 A)
 &rst
  ixpk= 1442, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1080,1081,
 &end
#
#   65 ALA  HA           66 LEU  HB+         5.50    (#   1443:25  Unique         5.54, 5.83 A)
 &rst
  ixpk= 1443, nxpk= 25, iat=1068,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1080,1081,
 &end
#
#   65 ALA  HA           66 LEU  HB-         5.50    (#   1444:25  Unique         5.54, 5.83 A)
 &rst
  ixpk= 1444, nxpk= 25, iat=1068,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1080,1081,
 &end
#
#   66 LEU  HA           66 LEU  HG          4.50    (#   1445:25  Unique         2.30, 2.57 A)
 &rst
  ixpk= 1445, nxpk= 25, iat=1078,1083, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:1446    66 LEU  HG          4.50    (#   1446:25  Single Ambig)
 &rst
  ixpk= 1446, nxpk= 25, iat=  -1,1083, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1080,1081,1335,
 &end
#
#   66 LEU  MDY          66 LEU  HG          3.50    (#   1447:25  Unique         2.11, 2.65 A)
 &rst
  ixpk= 1447, nxpk= 25, iat=  -1,1083, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  MDX          66 LEU  HG          5.50    (#   1448:25  Unique         2.11, 2.65 A)
 &rst
  ixpk= 1448, nxpk= 25, iat=  -1,1083, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#   81 ILE  QG2          66 LEU  HG          4.50    (#   1449:25  Unique         1.93, 2.89 A)
 &rst
  ixpk= 1449, nxpk= 25, iat=  -1,1083, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1337,1338,1339,
 &end
#
#   66 LEU  HN           66 LEU  HG          5.50    (#   1450:25  Unique         4.04, 4.19 A)
 &rst
  ixpk= 1450, nxpk= 25, iat=1076,1083, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1451    66 LEU  HG          5.50    (#   1451:25  Single Ambig)
 &rst
  ixpk= 1451, nxpk= 25, iat=  -1,1083, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1360,1041,
 &end
#
#    9 ILE  QD1          66 LEU  MDY         4.50    (#   1454:25  Unique         3.82, 5.90 A)
 &rst
  ixpk= 1454, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 144, 145, 146,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   81 ILE  QG2          66 LEU  MDY         4.50    (#   1455:25  Unique         2.75, 4.76 A)
 &rst
  ixpk= 1455, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1337,1338,1339,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HG           66 LEU  MDY         3.50    (#   1456:25  Unique         2.11, 2.65 A)
 &rst
  ixpk= 1456, nxpk= 25, iat=1083,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HB-          66 LEU  MDY         4.50    (#   1457:25  Unique         2.25, 3.32 A)
 &rst
  ixpk= 1457, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1080,1081,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1458    66 LEU  MDY         3.50    (#   1458:25  Single Ambig)
 &rst
  ixpk= 1458, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1335,1080,1081,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1459    66 LEU  MDY         5.50    (#   1459:25  Single Ambig)
 &rst
  ixpk= 1459, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 135,1102,1103,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   67 ARG  HG+          66 LEU  MDY         4.50    (#   1460:25  Unique         2.86, 6.36 A)
 &rst
  ixpk= 1460, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1102,1103,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1461    66 LEU  MDY         3.50    (#   1461:25  Single Ambig)
 &rst
  ixpk= 1461, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1097,1045,1046,1045,1046,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1462    66 LEU  MDY         4.50    (#   1462:25  Single Ambig)
 &rst
  ixpk= 1462, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1352,1043,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   83 TYR  QD           66 LEU  MDY         5.50    (#   1464:25  Unique         3.02, 6.71 A)
 &rst
  ixpk= 1464, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1368,1377,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   70 GLN  HE2-         66 LEU  MDY         4.50    (#   1465:25  Unique         1.99, 4.95 A)
 &rst
  ixpk= 1465, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1162,1163,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   67 ARG  HN           66 LEU  MDY         4.50    (#   1466:25  Unique         3.32, 4.81 A)
 &rst
  ixpk= 1466, nxpk= 25, iat=1095,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   70 GLN  HE2+         66 LEU  MDY         4.50    (#   1467:25  Unique         1.99, 4.95 A)
 &rst
  ixpk= 1467, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1162,1163,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HN           66 LEU  MDY         5.50    (#   1468:25  Unique         4.17, 5.18 A)
 &rst
  ixpk= 1468, nxpk= 25, iat=1076,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1472    66 LEU  MDY         4.50    (#   1472:25  Single Ambig)
 &rst
  ixpk= 1472, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 137, 138, 139,1344,1345,1346,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    9 ILE  QD1          66 LEU  MDX         4.50    (#   1473:25  Unique         3.82, 5.90 A)
 &rst
  ixpk= 1473, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 144, 145, 146,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   81 ILE  QG2          66 LEU  MDX         3.50    (#   1475:25  Unique         2.75, 4.76 A)
 &rst
  ixpk= 1475, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1337,1338,1339,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1476    66 LEU  MDX         3.50    (#   1476:25  Single Ambig)
 &rst
  ixpk= 1476, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 137, 138, 139,1344,1345,1346,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HG           66 LEU  MDX         3.50    (#   1477:25  Unique         2.11, 2.65 A)
 &rst
  ixpk= 1477, nxpk= 25, iat=1083,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HB-          66 LEU  MDX         4.50    (#   1478:25  Unique         2.25, 3.32 A)
 &rst
  ixpk= 1478, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1080,1081,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1479    66 LEU  MDX         3.50    (#   1479:25  Single Ambig)
 &rst
  ixpk= 1479, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1335,1080,1081,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HA           66 LEU  MDX         4.50    (#   1480:25  Unique         2.56, 4.10 A)
 &rst
  ixpk= 1480, nxpk= 25, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   82 ALA  HA           66 LEU  MDX         3.50    (#   1481:25  Unique         2.16, 3.90 A)
 &rst
  ixpk= 1481, nxpk= 25, iat=1352,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   81 ILE  HA           66 LEU  MDX         5.50    (#   1483:25  Unique         4.41, 6.04 A)
 &rst
  ixpk= 1483, nxpk= 25, iat=1333,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   83 TYR  QD           66 LEU  MDX         4.50    (#   1484:25  Unique         3.02, 6.71 A)
 &rst
  ixpk= 1484, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1368,1377,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   70 GLN  HE2+         66 LEU  MDX         5.50    (#   1485:25  Unique         1.99, 4.95 A)
 &rst
  ixpk= 1485, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1162,1163,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   83 TYR  HN           66 LEU  MDX         5.50    (#   1486:25  Unique         2.81, 5.03 A)
 &rst
  ixpk= 1486, nxpk= 25, iat=1360,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HN           66 LEU  MDX         4.50    (#   1487:25  Unique         4.17, 5.18 A)
 &rst
  ixpk= 1487, nxpk= 25, iat=1076,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1488    67 ARG  HA          5.50    (#   1488:25  Single Ambig)
 &rst
  ixpk= 1488, nxpk= 25, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1105,1106,1105,1106,
 &end
#
#   67 ARG  HB+          67 ARG  HA          2.80    (#   1489:25  Unique         2.28, 2.78 A)
 &rst
  ixpk= 1489, nxpk= 25, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1099,1100,
 &end
#
#   67 ARG  HG-          67 ARG  HA          4.50    (#   1490:25  Unique         2.26, 2.72 A)
 &rst
  ixpk= 1490, nxpk= 25, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1102,1103,
 &end
#
#    0 AMB  25-3:1491    67 ARG  HA          3.50    (#   1491:25  Single Ambig)
 &rst
  ixpk= 1491, nxpk= 25, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1102,1103,1099,1100,
 &end
#
#   66 LEU  MDY          67 ARG  HA          3.50    (#   1492:25  Unique         2.99, 5.11 A)
 &rst
  ixpk= 1492, nxpk= 25, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#   64 ASN  HA           67 ARG  HA          7.00    (#   1493:25  Unique         5.39, 5.70 A)
 &rst
  ixpk= 1493, nxpk= 25, iat=1054,1097, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   67 ARG  HN           67 ARG  HA          4.50    (#   1494:25  Unique         2.67, 2.83 A)
 &rst
  ixpk= 1494, nxpk= 25, iat=1095,1097, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:1495    67 ARG  HA          5.50    (#   1495:25  Single Ambig)
 &rst
  ixpk= 1495, nxpk= 25, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1162,1163,1119,
 &end
#
#    3 MET  HN           67 ARG  HA          5.50    (#   1496:25  Unique         5.32, 5.59 A)
 &rst
  ixpk= 1496, nxpk= 25, iat=  36,1097, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1498     0 AMB  25-1:1498   3.50    (#   1498:25  Double Ambig)
 &rst
  ixpk= 1498, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.01, r4= 8.51,
 igr1= 834, 835, 834, 835, 834, 835,1105,1106,1105,1106,
      1105,1106,
 igr2= 828, 829, 828, 829, 828, 829,1099,1100,1099,1100,
        25,  26,
 &end
#
#    0 AMB  25-3:1499    67 ARG  HB-         4.50    (#   1499:25  Single Ambig)
 &rst
  ixpk= 1499, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1105,1106,1105,1106,
 igr2=1099,1100,
 &end
#
#    0 AMB  25-3:1500     0 AMB  25-1:1500   4.50    (#   1500:25  Double Ambig)
 &rst
  ixpk= 1500, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1097, 850, 851,1045,1046,
 igr2=1099,1100, 828, 829, 828, 829,1099,1100,
 &end
#
#   67 ARG  HA           67 ARG  HB-         3.50    (#   1501:25  Unique         2.28, 2.78 A)
 &rst
  ixpk= 1501, nxpk= 25, iat=1097,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1099,1100,
 &end
#
#    0 AMB  25-3:1502     0 AMB  25-1:1502   3.50    (#   1502:25  Double Ambig)
 &rst
  ixpk= 1502, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 824,1095,
 igr2= 828, 829, 828, 829,1099,1100,
 &end
#
#   67 ARG  HN           67 ARG  HB-         4.50    (#   1503:25  Unique         2.21, 2.69 A)
 &rst
  ixpk= 1503, nxpk= 25, iat=1095,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1099,1100,
 &end
#
#   68 THR  HN           67 ARG  HB+         5.50    (#   1504:25  Unique         1.98, 3.21 A)
 &rst
  ixpk= 1504, nxpk= 25, iat=1119,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1099,1100,
 &end
#
#   68 THR  HN           67 ARG  HB-         5.50    (#   1505:25  Unique         1.98, 3.21 A)
 &rst
  ixpk= 1505, nxpk= 25, iat=1119,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1099,1100,
 &end
#
#   64 ASN  HA           67 ARG  HB-         5.50    (#   1506:25  Unique         2.51, 3.59 A)
 &rst
  ixpk= 1506, nxpk= 25, iat=1054,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1099,1100,
 &end
#
#    0 AMB  25-3:1507     0 AMB  25-1:1507   3.50    (#   1507:25  Double Ambig)
 &rst
  ixpk= 1507, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=  23, 826,1054,
 igr2=  25,  26, 828, 829, 828, 829,1099,1100,
 &end
#
#   70 GLN  HB-          67 ARG  HG+         5.50    (#   1509:25  Unique         4.35, 6.23 A)
 &rst
  ixpk= 1509, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1154,1155,
 igr2=1102,1103,
 &end
#
#   70 GLN  HB-          67 ARG  HG-         5.50    (#   1510:25  Unique         4.35, 6.23 A)
 &rst
  ixpk= 1510, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1154,1155,
 igr2=1102,1103,
 &end
#
#    0 AMB  25-3:1511     0 AMB  25-1:1511   2.80    (#   1511:25  Double Ambig)
 &rst
  ixpk= 1511, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1=1105,1106,1105,1106, 834, 835, 834, 835,
 igr2=1102,1103,1102,1103, 831, 832, 831, 832,
 &end
#
#    0 AMB  25-3:1512    67 ARG  HG-         3.50    (#   1512:25  Single Ambig)
 &rst
  ixpk= 1512, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1105,1106,1105,1106,
 igr2=1102,1103,
 &end
#
#    0 AMB  25-3:1513    67 ARG  HG-         4.50    (#   1513:25  Single Ambig)
 &rst
  ixpk= 1513, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1097,1045,1046,
 igr2=1102,1103,
 &end
#
#    0 AMB  25-3:1514     0 AMB  25-1:1514   4.50    (#   1514:25  Double Ambig)
 &rst
  ixpk= 1514, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.80, r4= 9.30,
 igr1=1097,1045,1046,1045,1046,1015,1016,
 igr2=1102,1103,  76,  77,  76,  77,  76,  77,
 &end
#
#    0 AMB  25-3:1515     0 AMB  25-1:1515   4.50    (#   1515:25  Double Ambig)
 &rst
  ixpk= 1515, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=  73,  74,1015,1016,
 igr2=  76,  77,  76,  77,
 &end
#
#    0 AMB  25-3:1518     0 AMB  25-1:1518   5.50    (#   1518:25  Double Ambig)
 &rst
  ixpk= 1518, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1043,  55,
 igr2=1102,1103,  76,  77,  76,  77,
 &end
#
#    0 AMB  25-3:1519     0 AMB  25-1:1519   5.50    (#   1519:25  Double Ambig)
 &rst
  ixpk= 1519, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1054,  88,
 igr2=1102,1103,  76,  77,
 &end
#
#   67 ARG  HN           67 ARG  HG+         5.50    (#   1520:25  Unique         2.28, 3.80 A)
 &rst
  ixpk= 1520, nxpk= 25, iat=1095,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1102,1103,
 &end
#
#   67 ARG  HN           67 ARG  HG-         5.50    (#   1521:25  Unique         2.28, 3.80 A)
 &rst
  ixpk= 1521, nxpk= 25, iat=1095,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1102,1103,
 &end
#
#    0 AMB  25-3:1522     0 AMB  25-1:1522   5.50    (#   1522:25  Double Ambig)
 &rst
  ixpk= 1522, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=  43,  44,1157,1158,
 igr2=1102,1103,1102,1103,
 &end
#
#    0 AMB  25-3:1523    67 ARG  HG-         5.50    (#   1523:25  Single Ambig)
 &rst
  ixpk= 1523, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  43,  44,1157,1158,
 igr2=1102,1103,
 &end
#
#    0 AMB  25-3:1524    46 LEU  HG          2.80    (#   1524:25  Single Ambig)
 &rst
  ixpk= 1524, nxpk= 25, iat=  -1, 773, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 779, 780, 781, 775, 776, 777,
 &end
#
#    3 MET  HG-           0 AMB  25-1:1527   5.50    (#   1527:25  Single Ambig)
 &rst
  ixpk= 1527, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  43,  44,
 igr2=1105,1106,1105,1106,
 &end
#
#    0 AMB  25-3:1528     0 AMB  25-1:1528   5.50    (#   1528:25  Double Ambig)
 &rst
  ixpk= 1528, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 775, 776, 777, 779, 780, 781,
 igr2= 834, 835, 834, 835, 834, 835,
 &end
#
#   64 ASN  HA            0 AMB  25-1:1531   5.50    (#   1531:25  Single Ambig)
 &rst
  ixpk= 1531, nxpk= 25, iat=1054,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1105,1106,1105,1106,
 &end
#
#    0 AMB  25-3:1535     0 AMB  25-1:1535   5.50    (#   1535:25  Double Ambig)
 &rst
  ixpk= 1535, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1= 824,1095, 807,
 igr2= 834, 835, 834, 835,1105,1106,1105,1106, 834, 835,
      
 &end
#
#   68 THR  QG2          68 THR  HA          2.80    (#   1536:25  Unique         2.45, 3.11 A)
 &rst
  ixpk= 1536, nxpk= 25, iat=  -1,1121, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1125,1126,1127,
 &end
#
#   68 THR  HB           68 THR  HA          3.50    (#   1538:25  Unique         3.04, 3.05 A)
 &rst
  ixpk= 1538, nxpk= 25, iat=1123,1121, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   68 THR  HN           68 THR  HA          3.50    (#   1541:25  Unique         2.80, 2.87 A)
 &rst
  ixpk= 1541, nxpk= 25, iat=1119,1121, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  25-3:1542    68 THR  HA          7.00    (#   1542:25  Single Ambig)
 &rst
  ixpk= 1542, nxpk= 25, iat=  -1,1121, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1076,1066,
 &end
#
#   67 ARG  HG+          68 THR  HA          7.00    (#   1543:25  Unique         3.53, 5.56 A)
 &rst
  ixpk= 1543, nxpk= 25, iat=  -1,1121, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1102,1103,
 &end
#
#  102 PRO  HA           97 THR  HB          7.00    (#   1545:25  Unique         3.52, 5.61 A)
 &rst
  ixpk= 1545, nxpk= 25, iat=1680,1579, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   97 THR  QG2          97 THR  HB          3.50    (#   1550:25  Unique         2.06, 2.66 A)
 &rst
  ixpk= 1550, nxpk= 25, iat=  -1,1579, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1581,1582,1583,
 &end
#
#   67 ARG  HB-          68 THR  QG2         7.00    (#   1552:25  Unique         5.71, 7.02 A)
 &rst
  ixpk= 1552, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1099,1100,
 igr2=1125,1126,1127,
 &end
#
#   69 MET  HG-          68 THR  QG2         4.50    (#   1554:25  Unique         3.52, 5.32 A)
 &rst
  ixpk= 1554, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1140,1141,
 igr2=1125,1126,1127,
 &end
#
#   69 MET  HG+          68 THR  QG2         4.50    (#   1555:25  Unique         3.52, 5.32 A)
 &rst
  ixpk= 1555, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1140,1141,
 igr2=1125,1126,1127,
 &end
#
#   68 THR  HB           68 THR  QG2         3.50    (#   1556:25  Unique         2.41, 2.67 A)
 &rst
  ixpk= 1556, nxpk= 25, iat=1123,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1125,1126,1127,
 &end
#
#   68 THR  HA           68 THR  QG2         2.80    (#   1557:25  Unique         2.45, 3.11 A)
 &rst
  ixpk= 1557, nxpk= 25, iat=1121,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1125,1126,1127,
 &end
#
#   70 GLN  HN           68 THR  QG2         5.50    (#   1559:25  Unique         5.67, 6.47 A)
 &rst
  ixpk= 1559, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1125,1126,1127,
 &end
#
#   34 PHE  QE           68 THR  QG2         3.50    (#   1560:25  Unique         2.42, 4.81 A)
 &rst
  ixpk= 1560, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 582, 586,
 igr2=1125,1126,1127,
 &end
#
#   68 THR  HN           68 THR  QG2         4.50    (#   1561:25  Unique         4.41, 4.54 A)
 &rst
  ixpk= 1561, nxpk= 25, iat=1119,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1125,1126,1127,
 &end
#
#   81 ILE  QD1          69 MET  HA          4.50    (#   1567:25  Unique         4.19, 5.01 A)
 &rst
  ixpk= 1567, nxpk= 25, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1344,1345,1346,
 &end
#
#    0 AMB  25-3:1568    39 ASP  HA          4.50    (#   1568:25  Single Ambig)
 &rst
  ixpk= 1568, nxpk= 25, iat=  -1, 656, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 644, 645, 646, 648, 649, 650, 679, 680, 681, 691,
       692, 693, 695, 696, 697, 672, 673, 674,
 &end
#
#   37 ILE  QG2          39 ASP  HA          5.50    (#   1569:25  Unique         3.40, 4.10 A)
 &rst
  ixpk= 1569, nxpk= 25, iat=  -1, 656, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 622, 623, 624,
 &end
#
#    0 AMB  25-3:1570     0 AMB  25-1:1570   5.50    (#   1570:25  Double Ambig)
 &rst
  ixpk= 1570, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1125,1126,1127, 642, 639, 640, 928, 929,
 igr2=1135, 656,
 &end
#
#    0 AMB  25-3:1571    39 ASP  HA          5.50    (#   1571:25  Single Ambig)
 &rst
  ixpk= 1571, nxpk= 25, iat=  -1, 656, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 676, 677, 676, 677, 670,
 &end
#
#   69 MET  HB+          69 MET  HA          4.50    (#   1572:25  Unique         2.44, 2.77 A)
 &rst
  ixpk= 1572, nxpk= 25, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1137,1138,
 &end
#
#    0 AMB  25-3:1573    69 MET  HA          5.50    (#   1573:25  Single Ambig)
 &rst
  ixpk= 1573, nxpk= 25, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1157,1158,1195,1196,
 &end
#
#   39 ASP  HB+          39 ASP  HA          4.50    (#   1574:25  Unique         2.49, 2.78 A)
 &rst
  ixpk= 1574, nxpk= 25, iat=  -1, 656, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 658, 659,
 &end
#
#   72 PHE  HB-          69 MET  HA          4.50    (#   1575:25  Unique         2.33, 2.94 A)
 &rst
  ixpk= 1575, nxpk= 25, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1178,1179,
 &end
#
#   66 LEU  HA           69 MET  HA          7.00    (#   1576:25  Unique         6.00, 6.18 A)
 &rst
  ixpk= 1576, nxpk= 25, iat=1078,1135, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  25-3:1577    39 ASP  HA          5.50    (#   1577:25  Single Ambig)
 &rst
  ixpk= 1577, nxpk= 25, iat=  -1, 656, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 904, 687,
 &end
#
#   55 ILE  HA           39 ASP  HA          7.00    (#   1578:25  Unique         6.97, 7.01 A)
 &rst
  ixpk= 1578, nxpk= 25, iat= 920, 656, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   40 ILE  HN           39 ASP  HA          4.50    (#   1579:25  Unique         2.46, 2.50 A)
 &rst
  ixpk= 1579, nxpk= 25, iat= 666, 656, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   81 ILE  QD1          69 MET  HB+         4.50    (#   1580:25  Unique         2.33, 3.21 A)
 &rst
  ixpk= 1580, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1344,1345,1346,
 igr2=1137,1138,
 &end
#
#   81 ILE  QD1          69 MET  HB-         5.50    (#   1581:25  Unique         2.33, 3.21 A)
 &rst
  ixpk= 1581, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1344,1345,1346,
 igr2=1137,1138,
 &end
#
#    9 ILE  QD1          69 MET  HB-         5.50    (#   1582:25  Unique         4.21, 5.76 A)
 &rst
  ixpk= 1582, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 144, 145, 146,
 igr2=1137,1138,
 &end
#
#   70 GLN  HN           69 MET  HB-         5.50    (#   1583:25  Unique         2.90, 3.82 A)
 &rst
  ixpk= 1583, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1137,1138,
 &end
#
#   70 GLN  HN           69 MET  HB+         5.50    (#   1584:25  Unique         2.90, 3.82 A)
 &rst
  ixpk= 1584, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1137,1138,
 &end
#
#   69 MET  HN           69 MET  HB-         5.50    (#   1585:25  Unique         2.25, 3.02 A)
 &rst
  ixpk= 1585, nxpk= 25, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1137,1138,
 &end
#
#   69 MET  HN           69 MET  HB+         5.50    (#   1586:25  Unique         2.25, 3.02 A)
 &rst
  ixpk= 1586, nxpk= 25, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1137,1138,
 &end
#
#    0 AMB  25-3:1588     0 AMB  25-1:1588   2.80    (#   1588:25  Double Ambig)
 &rst
  ixpk= 1588, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 317, 318, 317, 318, 432, 433,1144,1145,1146,
 igr2= 311, 312, 311, 312, 426, 427,1140,1141,
 &end
#
#   69 MET  HB+          69 MET  HG-         2.80    (#   1589:25  Unique         2.35, 2.60 A)
 &rst
  ixpk= 1589, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1137,1138,
 igr2=1140,1141,
 &end
#
#    0 AMB  25-3:1590     0 AMB  25-1:1590   5.50    (#   1590:25  Double Ambig)
 &rst
  ixpk= 1590, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 482, 491,1150,
 igr2= 426, 427,1140,1141,
 &end
#
#    0 AMB  25-3:1591     0 AMB  25-1:1591   4.50    (#   1591:25  Double Ambig)
 &rst
  ixpk= 1591, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 422, 580, 588,
 igr2= 426, 427,1140,1141,
 &end
#
#    0 AMB  25-3:1592     0 AMB  25-1:1592   5.50    (#   1592:25  Double Ambig)
 &rst
  ixpk= 1592, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 307, 444,
 igr2= 311, 312, 426, 427,
 &end
#
#    0 AMB  25-3:1593     0 AMB  25-1:1593   5.50    (#   1593:25  Double Ambig)
 &rst
  ixpk= 1593, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 400, 524, 544,1174,
 igr2= 426, 427,1140,1141, 311, 312,
 &end
#
#   81 ILE  QD1          70 GLN  HA          4.50    (#   1594:25  Unique         2.31, 3.51 A)
 &rst
  ixpk= 1594, nxpk= 25, iat=  -1,1152, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1344,1345,1346,
 &end
#
#   70 GLN  HB-          70 GLN  HA          4.50    (#   1595:25  Unique         2.13, 2.68 A)
 &rst
  ixpk= 1595, nxpk= 25, iat=  -1,1152, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1154,1155,
 &end
#
#   70 GLN  HG-          70 GLN  HA          4.50    (#   1596:25  Unique         2.40, 3.43 A)
 &rst
  ixpk= 1596, nxpk= 25, iat=  -1,1152, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1157,1158,
 &end
#
#   70 GLN  HB+          70 GLN  HA          5.50    (#   1597:25  Unique         2.13, 2.68 A)
 &rst
  ixpk= 1597, nxpk= 25, iat=  -1,1152, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1154,1155,
 &end
#
#   70 GLN  HN           70 GLN  HA          5.50    (#   1598:25  Unique         2.72, 2.81 A)
 &rst
  ixpk= 1598, nxpk= 25, iat=1150,1152, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   71 GLY  HN           70 GLN  HA          3.50    (#   1599:25  Unique         1.97, 2.19 A)
 &rst
  ixpk= 1599, nxpk= 25, iat=1167,1152, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   70 GLN  HG+          70 GLN  HB+         4.50    (#   1601:25  Unique         2.24, 2.65 A)
 &rst
  ixpk= 1601, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1157,1158,
 igr2=1154,1155,
 &end
#
#   70 GLN  HG+          70 GLN  HB-         4.50    (#   1602:25  Unique         2.24, 2.65 A)
 &rst
  ixpk= 1602, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1157,1158,
 igr2=1154,1155,
 &end
#
#   66 LEU  MDY          70 GLN  HB-         5.50    (#   1603:25  Unique         2.32, 6.15 A)
 &rst
  ixpk= 1603, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1154,1155,
 &end
#
#   66 LEU  MDY          70 GLN  HB+         5.50    (#   1604:25  Unique         2.32, 6.15 A)
 &rst
  ixpk= 1604, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1154,1155,
 &end
#
#   70 GLN  HA           70 GLN  HB-         5.50    (#   1605:25  Unique         2.13, 2.68 A)
 &rst
  ixpk= 1605, nxpk= 25, iat=1152,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1154,1155,
 &end
#
#   70 GLN  HA           70 GLN  HB+         5.50    (#   1606:25  Unique         2.13, 2.68 A)
 &rst
  ixpk= 1606, nxpk= 25, iat=1152,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1154,1155,
 &end
#
#   70 GLN  HN           70 GLN  HB+         4.50    (#   1608:25  Unique         2.06, 2.83 A)
 &rst
  ixpk= 1608, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1154,1155,
 &end
#
#   70 GLN  HN           70 GLN  HB-         4.50    (#   1609:25  Unique         2.06, 2.83 A)
 &rst
  ixpk= 1609, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1154,1155,
 &end
#
#   82 ALA  HN           70 GLN  HB-         7.00    (#   1610:25  Unique         5.44, 7.44 A)
 &rst
  ixpk= 1610, nxpk= 25, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1154,1155,
 &end
#
#   82 ALA  HA           70 GLN  HB+         7.00    (#   1611:25  Unique         5.32, 7.19 A)
 &rst
  ixpk= 1611, nxpk= 25, iat=1352,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1154,1155,
 &end
#
#   67 ARG  HG-          70 GLN  HG-         4.50    (#   1612:25  Unique         4.12, 5.85 A)
 &rst
  ixpk= 1612, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1102,1103,
 igr2=1157,1158,
 &end
#
#   67 ARG  HG-          70 GLN  HG+         5.50    (#   1613:25  Unique         4.12, 5.85 A)
 &rst
  ixpk= 1613, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1102,1103,
 igr2=1157,1158,
 &end
#
#   70 GLN  HE2-         70 GLN  HG+         4.50    (#   1614:25  Unique         2.26, 3.34 A)
 &rst
  ixpk= 1614, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1162,1163,
 igr2=1157,1158,
 &end
#
#   70 GLN  HE2-         70 GLN  HG-         5.50    (#   1615:25  Unique         2.26, 3.34 A)
 &rst
  ixpk= 1615, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1162,1163,
 igr2=1157,1158,
 &end
#
#   70 GLN  HE2+         70 GLN  HG+         5.50    (#   1616:25  Unique         2.26, 3.34 A)
 &rst
  ixpk= 1616, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1162,1163,
 igr2=1157,1158,
 &end
#
#   70 GLN  HE2+         70 GLN  HG-         5.50    (#   1617:25  Unique         2.26, 3.34 A)
 &rst
  ixpk= 1617, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1162,1163,
 igr2=1157,1158,
 &end
#
#   70 GLN  HN           70 GLN  HG+         5.50    (#   1618:25  Unique         2.12, 3.33 A)
 &rst
  ixpk= 1618, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1157,1158,
 &end
#
#   70 GLN  HA           70 GLN  HG+         5.50    (#   1619:25  Unique         2.40, 3.43 A)
 &rst
  ixpk= 1619, nxpk= 25, iat=1152,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1157,1158,
 &end
#
#   73 PRO  HD+          72 PHE  HA          3.50    (#   1623:25  Unique         2.12, 2.39 A)
 &rst
  ixpk= 1623, nxpk= 25, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1195,1196,
 &end
#
#   72 PHE  HB-          72 PHE  HA          4.50    (#   1624:25  Unique         2.47, 2.77 A)
 &rst
  ixpk= 1624, nxpk= 25, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1178,1179,
 &end
#
#   73 PRO  HD-          72 PHE  HA          3.50    (#   1625:25  Unique         2.12, 2.39 A)
 &rst
  ixpk= 1625, nxpk= 25, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1195,1196,
 &end
#
#   72 PHE  QD           72 PHE  HA          4.50    (#   1627:25  Unique         2.60, 3.52 A)
 &rst
  ixpk= 1627, nxpk= 25, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1182,1190,
 &end
#
#   72 PHE  HN           72 PHE  HA          5.50    (#   1628:25  Unique         2.85, 2.87 A)
 &rst
  ixpk= 1628, nxpk= 25, iat=1174,1176, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   69 MET  QE           72 PHE  HB+         5.50    (#   1630:25  Unique         2.49, 3.90 A)
 &rst
  ixpk= 1630, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1144,1145,1146,
 igr2=1178,1179,
 &end
#
#   69 MET  QE           72 PHE  HB-         5.50    (#   1631:25  Unique         2.49, 3.90 A)
 &rst
  ixpk= 1631, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1144,1145,1146,
 igr2=1178,1179,
 &end
#
#   72 PHE  HA           72 PHE  HB-         4.50    (#   1634:25  Unique         2.47, 2.77 A)
 &rst
  ixpk= 1634, nxpk= 25, iat=1176,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1178,1179,
 &end
#
#    0 AMB  25-3:1635     0 AMB  25-1:1635   4.50    (#   1635:25  Double Ambig)
 &rst
  ixpk= 1635, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1182,1190, 945, 953,
 igr2=1178,1179, 941, 942,
 &end
#
#   72 PHE  QD           72 PHE  HB+         4.50    (#   1636:25  Unique         2.23, 3.09 A)
 &rst
  ixpk= 1636, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1182,1190,
 igr2=1178,1179,
 &end
#
#   72 PHE  HN           72 PHE  HB-         4.50    (#   1637:25  Unique         2.14, 2.50 A)
 &rst
  ixpk= 1637, nxpk= 25, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1178,1179,
 &end
#
#   72 PHE  HN           72 PHE  HB+         4.50    (#   1638:25  Unique         2.14, 2.50 A)
 &rst
  ixpk= 1638, nxpk= 25, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1178,1179,
 &end
#
#   74 PHE  QD           74 PHE  HB+         5.50    (#   1641:25  Unique         2.21, 3.07 A)
 &rst
  ixpk= 1641, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1216,1224,
 igr2=1212,1213,
 &end
#
#   74 PHE  QD           74 PHE  HB-         5.50    (#   1642:25  Unique         2.21, 3.07 A)
 &rst
  ixpk= 1642, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1216,1224,
 igr2=1212,1213,
 &end
#
#   75 TYR  HB-          75 TYR  HA          4.50    (#   1645:25  Unique         2.30, 2.82 A)
 &rst
  ixpk= 1645, nxpk= 25, iat=  -1,1230, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1232,1233,
 &end
#
#   75 TYR  HB+          75 TYR  HA          4.50    (#   1646:25  Unique         2.30, 2.82 A)
 &rst
  ixpk= 1646, nxpk= 25, iat=  -1,1230, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1232,1233,
 &end
#
#   77 LYS  HA           75 TYR  HA          7.00    (#   1648:25  Unique         6.78, 7.01 A)
 &rst
  ixpk= 1648, nxpk= 25, iat=1263,1230, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   75 TYR  QD           75 TYR  HA          4.50    (#   1649:25  Unique         2.47, 3.45 A)
 &rst
  ixpk= 1649, nxpk= 25, iat=  -1,1230, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1236,1245,
 &end
#
#   76 ASP  HN           75 TYR  HA          4.50    (#   1650:25  Unique         2.18, 2.81 A)
 &rst
  ixpk= 1650, nxpk= 25, iat=1249,1230, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   75 TYR  HN           75 TYR  HA          5.50    (#   1651:25  Unique         2.80, 2.91 A)
 &rst
  ixpk= 1651, nxpk= 25, iat=1228,1230, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   75 TYR  HA           75 TYR  HB+         4.50    (#   1652:25  Unique         2.30, 2.82 A)
 &rst
  ixpk= 1652, nxpk= 25, iat=1230,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1232,1233,
 &end
#
#   75 TYR  QD           75 TYR  HB+         4.50    (#   1653:25  Unique         2.19, 3.08 A)
 &rst
  ixpk= 1653, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1236,1245,
 igr2=1232,1233,
 &end
#
#   75 TYR  QD           75 TYR  HB-         5.50    (#   1654:25  Unique         2.19, 3.08 A)
 &rst
  ixpk= 1654, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1236,1245,
 igr2=1232,1233,
 &end
#
#   75 TYR  QE           75 TYR  HB+         5.50    (#   1655:25  Unique         4.51, 5.09 A)
 &rst
  ixpk= 1655, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1238,1243,
 igr2=1232,1233,
 &end
#
#   75 TYR  HA           75 TYR  HB-         5.50    (#   1656:25  Unique         2.30, 2.82 A)
 &rst
  ixpk= 1656, nxpk= 25, iat=1230,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1232,1233,
 &end
#
#   15 ASN  HD2+         75 TYR  HB+         5.50    (#   1657:25  Unique         2.26, 4.85 A)
 &rst
  ixpk= 1657, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 246, 247,
 igr2=1232,1233,
 &end
#
#   90 ILE  HN           89 ASP  HA          4.50    (#   1660:25  Unique         3.45, 3.60 A)
 &rst
  ixpk= 1660, nxpk= 25, iat=1460,1450, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   78 PRO  HD-          77 LYS  HA          3.50    (#   1667:25  Unique         1.97, 2.40 A)
 &rst
  ixpk= 1667, nxpk= 25, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1284,1285,
 &end
#
#   78 PRO  HD+          77 LYS  HA          3.50    (#   1668:25  Unique         1.97, 2.40 A)
 &rst
  ixpk= 1668, nxpk= 25, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1284,1285,
 &end
#
#    0 AMB  25-3:1669    77 LYS  HA          4.50    (#   1669:25  Single Ambig)
 &rst
  ixpk= 1669, nxpk= 25, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1268,1269,1268,1269,
 &end
#
#    0 AMB  25-3:1670    77 LYS  HA          4.50    (#   1670:25  Single Ambig)
 &rst
  ixpk= 1670, nxpk= 25, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1271,1272,1271,1272,
 &end
#
#   77 LYS  HB+          77 LYS  HA          4.50    (#   1671:25  Unique         2.33, 2.77 A)
 &rst
  ixpk= 1671, nxpk= 25, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1265,1266,
 &end
#
#   15 ASN  HD2-         77 LYS  HA          5.50    (#   1672:25  Unique         4.95, 6.34 A)
 &rst
  ixpk= 1672, nxpk= 25, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 246, 247,
 &end
#
#    0 AMB  25-3:1675    77 LYS  HB-         4.50    (#   1675:25  Single Ambig)
 &rst
  ixpk= 1675, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1268,1269,1268,1269,
 igr2=1265,1266,
 &end
#
#    0 AMB  25-3:1676     0 AMB  25-1:1676   3.50    (#   1676:25  Double Ambig)
 &rst
  ixpk= 1676, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1268,1269,1268,1269,
 igr2=1265,1266,1265,1266,
 &end
#
#    0 AMB  25-3:1677     0 AMB  25-1:1677   5.50    (#   1677:25  Double Ambig)
 &rst
  ixpk= 1677, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 208, 209,1321,1322,1321,1322,
 igr2=1265,1266,1265,1266,1265,1266,
 &end
#
#   77 LYS  HA           77 LYS  HB+         5.50    (#   1680:25  Unique         2.33, 2.77 A)
 &rst
  ixpk= 1680, nxpk= 25, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1265,1266,
 &end
#
#   77 LYS  HA           77 LYS  HB-         5.50    (#   1681:25  Unique         2.33, 2.77 A)
 &rst
  ixpk= 1681, nxpk= 25, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1265,1266,
 &end
#
#   77 LYS  HN           77 LYS  HB-         5.50    (#   1682:25  Unique         2.60, 3.36 A)
 &rst
  ixpk= 1682, nxpk= 25, iat=1261,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1265,1266,
 &end
#
#    0 AMB  25-3:1683    77 LYS  HB-         5.50    (#   1683:25  Single Ambig)
 &rst
  ixpk= 1683, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1271,1272,1271,1272,
 igr2=1265,1266,
 &end
#
#    0 AMB  25-3:1688     0 AMB  25-1:1688   3.50    (#   1688:25  Double Ambig)
 &rst
  ixpk= 1688, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 743, 744, 743, 744, 342, 343, 413, 414, 413, 414,
      1232,1233,
 igr2= 737, 738, 336, 337,1268,1269,
 &end
#
#   71 GLY  HA+          79 MET  HA          5.50    (#   1694:25  Unique         5.17, 6.11 A)
 &rst
  ixpk= 1694, nxpk= 25, iat=  -1,1299, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1169,1170,
 &end
#
#   79 MET  HG+          79 MET  HA          5.50    (#   1695:25  Unique         2.16, 3.24 A)
 &rst
  ixpk= 1695, nxpk= 25, iat=  -1,1299, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1304,1305,
 &end
#
#    0 AMB  25-3:1696     0 AMB  25-1:1696   4.50    (#   1696:25  Double Ambig)
 &rst
  ixpk= 1696, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 154, 155, 154, 155,1304,1305,
 igr2=1383,1299,
 &end
#
#    0 AMB  25-3:1697    79 MET  HA          4.50    (#   1697:25  Single Ambig)
 &rst
  ixpk= 1697, nxpk= 25, iat=  -1,1299, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1301,1302, 208, 209,1321,1322,
 &end
#
#    0 AMB  25-3:1698    79 MET  HA          4.50    (#   1698:25  Single Ambig)
 &rst
  ixpk= 1698, nxpk= 25, iat=  -1,1299, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1301,1302,1265,1266,
 &end
#
#   80 GLN  HN           79 MET  HA          3.50    (#   1699:25  Unique         2.22, 2.27 A)
 &rst
  ixpk= 1699, nxpk= 25, iat=1314,1299, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  25-3:1700    79 MET  HA          4.50    (#   1700:25  Single Ambig)
 &rst
  ixpk= 1700, nxpk= 25, iat=  -1,1299, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1297, 204,
 &end
#
#    0 AMB  25-3:1701    79 MET  HB-         4.50    (#   1701:25  Single Ambig)
 &rst
  ixpk= 1701, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1344,1345,1346, 177, 178, 179,
 igr2=1301,1302,
 &end
#
#    0 AMB  25-3:1702     0 AMB  25-1:1702   4.50    (#   1702:25  Double Ambig)
 &rst
  ixpk= 1702, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1344,1345,1346, 177, 178, 179,
 igr2=1301,1302,1301,1302,
 &end
#
#   80 GLN  HN           79 MET  HB-         5.50    (#   1703:25  Unique         2.47, 3.46 A)
 &rst
  ixpk= 1703, nxpk= 25, iat=1314,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1301,1302,
 &end
#
#   76 ASP  HN           77 LYS  HB+         5.50    (#   1704:25  Unique         4.41, 5.69 A)
 &rst
  ixpk= 1704, nxpk= 25, iat=1249,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1265,1266,
 &end
#
#    0 AMB  25-3:1705     0 AMB  25-1:1705   4.50    (#   1705:25  Double Ambig)
 &rst
  ixpk= 1705, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1297,1167,
 igr2=1301,1302,1301,1302,
 &end
#
#    0 AMB  25-3:1706    79 MET  HB-         5.50    (#   1706:25  Single Ambig)
 &rst
  ixpk= 1706, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1297,1167,
 igr2=1301,1302,
 &end
#
#   79 MET  HG-          79 MET  HB-         5.50    (#   1707:25  Unique         2.25, 2.64 A)
 &rst
  ixpk= 1707, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1304,1305,
 igr2=1301,1302,
 &end
#
#   79 MET  HG-          79 MET  HB+         5.50    (#   1708:25  Unique         2.25, 2.64 A)
 &rst
  ixpk= 1708, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1304,1305,
 igr2=1301,1302,
 &end
#
#   69 MET  QE           79 MET  HG+         5.50    (#   1709:25  Unique         2.62, 5.44 A)
 &rst
  ixpk= 1709, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1144,1145,1146,
 igr2=1304,1305,
 &end
#
#   69 MET  QE           79 MET  HG-         5.50    (#   1710:25  Unique         2.62, 5.44 A)
 &rst
  ixpk= 1710, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1144,1145,1146,
 igr2=1304,1305,
 &end
#
#   79 MET  HB+          79 MET  HG-         5.50    (#   1711:25  Unique         2.25, 2.64 A)
 &rst
  ixpk= 1711, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1301,1302,
 igr2=1304,1305,
 &end
#
#   79 MET  HB+          79 MET  HG+         5.50    (#   1712:25  Unique         2.25, 2.64 A)
 &rst
  ixpk= 1712, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1301,1302,
 igr2=1304,1305,
 &end
#
#    0 AMB  25-3:1713     0 AMB  25-1:1713   5.50    (#   1713:25  Double Ambig)
 &rst
  ixpk= 1713, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1344,1345,1346, 177, 178, 179,
 igr2=1304,1305,1304,1305,
 &end
#
#   11 ILE  QG2          79 MET  HG-         5.50    (#   1714:25  Unique         4.29, 5.53 A)
 &rst
  ixpk= 1714, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 177, 178, 179,
 igr2=1304,1305,
 &end
#
#    0 AMB  25-3:1715    79 MET  HG-         5.50    (#   1715:25  Single Ambig)
 &rst
  ixpk= 1715, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1299,1293,
 igr2=1304,1305,
 &end
#
#    0 AMB  25-3:1716     0 AMB  25-1:1716   5.50    (#   1716:25  Double Ambig)
 &rst
  ixpk= 1716, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1299,1293,
 igr2=1304,1305,1304,1305,
 &end
#
#    0 AMB  25-3:1717     0 AMB  25-1:1717   5.50    (#   1717:25  Double Ambig)
 &rst
  ixpk= 1717, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1301,1302,1137,1138,
 igr2=1304,1305,1304,1305,
 &end
#
#    0 AMB  25-3:1718    79 MET  HG-         5.50    (#   1718:25  Single Ambig)
 &rst
  ixpk= 1718, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1301,1302,1137,1138,
 igr2=1304,1305,
 &end
#
#    0 AMB  25-3:1719    80 GLN  HB-         2.80    (#   1719:25  Single Ambig)
 &rst
  ixpk= 1719, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 208, 209,1321,1322,1321,1322,
 igr2=1318,1319,
 &end
#
#    0 AMB  25-3:1720     0 AMB  25-1:1720   2.80    (#   1720:25  Double Ambig)
 &rst
  ixpk= 1720, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 208, 209,1321,1322,1321,1322, 373, 374, 107, 108,
      
 igr2=1318,1319,1318,1319,1318,1319, 370, 371, 104, 105,
      
 &end
#
#    0 AMB  25-3:1721     0 AMB  25-1:1721   3.50    (#   1721:25  Double Ambig)
 &rst
  ixpk= 1721, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr1= 831, 832, 385, 386, 317, 318, 317, 318, 432, 433,
      
 igr2= 255, 256, 370, 371,
 &end
#
#   81 ILE  HB           80 GLN  HB-         7.00    (#   1722:25  Unique         5.82, 6.40 A)
 &rst
  ixpk= 1722, nxpk= 25, iat=1335,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1318,1319,
 &end
#
#   80 GLN  HA           80 GLN  HB-         4.50    (#   1723:25  Unique         2.45, 2.78 A)
 &rst
  ixpk= 1723, nxpk= 25, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1318,1319,
 &end
#
#    0 AMB  25-3:1724    80 GLN  HB-         4.50    (#   1724:25  Single Ambig)
 &rst
  ixpk= 1724, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1314,1162,1163,
 igr2=1318,1319,
 &end
#
#    0 AMB  25-3:1725    80 GLN  HB-         5.50    (#   1725:25  Single Ambig)
 &rst
  ixpk= 1725, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 177, 178, 179,1344,1345,1346,
 igr2=1318,1319,
 &end
#
#    0 AMB  25-3:1726     0 AMB  25-1:1726   4.50    (#   1726:25  Double Ambig)
 &rst
  ixpk= 1726, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 177, 178, 179, 298, 299, 298, 299,1344,1345,1346,
      
 igr2=1318,1319, 255, 256, 255, 256,1318,1319,
 &end
#
#    0 AMB  25-3:1727    80 GLN  HB-         5.50    (#   1727:25  Single Ambig)
 &rst
  ixpk= 1727, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 204,1167,
 igr2=1318,1319,
 &end
#
#   12 ASN  HB-          80 GLN  HB+         5.50    (#   1728:25  Unique         2.67, 4.72 A)
 &rst
  ixpk= 1728, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 194, 195,
 igr2=1318,1319,
 &end
#
#   12 ASN  HB-          80 GLN  HB-         5.50    (#   1729:25  Unique         2.67, 4.72 A)
 &rst
  ixpk= 1729, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 194, 195,
 igr2=1318,1319,
 &end
#
#    0 AMB  25-3:1730     0 AMB  25-1:1730   5.50    (#   1730:25  Double Ambig)
 &rst
  ixpk= 1730, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.21, r4=12.71,
 igr1=1341,1342,1341,1342,1341,1342,1271,1272,1271,1272,
      1271,1272,
 igr2=1321,1322,1321,1322,1321,1322,1321,1322,1321,1322,
      
 &end
#
#   80 GLN  HB-           0 AMB  25-1:1731   2.80    (#   1731:25  Single Ambig)
 &rst
  ixpk= 1731, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1318,1319,
 igr2=1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1732     0 AMB  25-1:1732   2.80    (#   1732:25  Double Ambig)
 &rst
  ixpk= 1732, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1318,1319,1318,1319,
 igr2=1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1733     0 AMB  25-1:1733   4.50    (#   1733:25  Double Ambig)
 &rst
  ixpk= 1733, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1287,1288,1287,1288,1290,1291,1290,1291,1154,1155,
      
 igr2=1321,1322,1321,1322,1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1734     0 AMB  25-1:1734   4.50    (#   1734:25  Double Ambig)
 &rst
  ixpk= 1734, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 208, 209, 208, 209,
 igr2=1321,1322,1321,1322,
 &end
#
#   80 GLN  HA            0 AMB  25-1:1735   3.50    (#   1735:25  Single Ambig)
 &rst
  ixpk= 1735, nxpk= 25, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1321,1322,1321,1322,
 &end
#
#   80 GLN  HE2-          0 AMB  25-1:1736   4.50    (#   1736:25  Single Ambig)
 &rst
  ixpk= 1736, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1326,1327,
 igr2=1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1737     0 AMB  25-1:1737   3.50    (#   1737:25  Double Ambig)
 &rst
  ixpk= 1737, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1326,1327,1326,1327,
 igr2=1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1738     0 AMB  25-1:1738   4.50    (#   1738:25  Double Ambig)
 &rst
  ixpk= 1738, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1314,1162,1163,1162,1163,
 igr2=1321,1322,1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1739     0 AMB  25-1:1739   5.50    (#   1739:25  Double Ambig)
 &rst
  ixpk= 1739, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 213, 214, 213, 214,
 igr2=1321,1322,1321,1322,
 &end
#
#   81 ILE  HN            0 AMB  25-1:1740   4.50    (#   1740:25  Single Ambig)
 &rst
  ixpk= 1740, nxpk= 25, iat=1331,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1741     0 AMB  25-1:1741   5.50    (#   1741:25  Double Ambig)
 &rst
  ixpk= 1741, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1167,1297, 204,
 igr2=1321,1322,1321,1322,1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1742    81 ILE  HA          3.50    (#   1742:25  Single Ambig)
 &rst
  ixpk= 1742, nxpk= 25, iat=  -1,1333, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 181, 182,1344,1345,1346,
 &end
#
#   82 ALA  HN           81 ILE  HA          3.50    (#   1745:25  Unique         1.95, 2.26 A)
 &rst
  ixpk= 1745, nxpk= 25, iat=1350,1333, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 LEU  HG           81 ILE  HB          4.50    (#   1746:25  Unique         2.74, 3.20 A)
 &rst
  ixpk= 1746, nxpk= 25, iat=1083,1335, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   81 ILE  QD1          81 ILE  HB          3.50    (#   1747:25  Unique         2.22, 3.19 A)
 &rst
  ixpk= 1747, nxpk= 25, iat=  -1,1335, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1344,1345,1346,
 &end
#
#   81 ILE  QG2          81 ILE  HB          3.50    (#   1748:25  Unique         2.35, 2.67 A)
 &rst
  ixpk= 1748, nxpk= 25, iat=  -1,1335, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1337,1338,1339,
 &end
#
#   70 GLN  HE2-         81 ILE  HB          7.00    (#   1749:25  Unique         3.15, 3.97 A)
 &rst
  ixpk= 1749, nxpk= 25, iat=  -1,1335, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1162,1163,
 &end
#
#   81 ILE  HN           81 ILE  HB          4.50    (#   1750:25  Unique         2.78, 2.93 A)
 &rst
  ixpk= 1750, nxpk= 25, iat=1331,1335, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   66 LEU  MDY          81 ILE  HB          5.50    (#   1751:25  Unique         2.20, 4.18 A)
 &rst
  ixpk= 1751, nxpk= 25, iat=  -1,1335, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#   71 GLY  HN           81 ILE  HB          5.50    (#   1753:25  Unique         5.17, 5.50 A)
 &rst
  ixpk= 1753, nxpk= 25, iat=1167,1335, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   67 ARG  HA            0 AMB  25-1:1754   5.50    (#   1754:25  Single Ambig)
 &rst
  ixpk= 1754, nxpk= 25, iat=1097,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1341,1342,1341,1342,
 &end
#
#    0 AMB  25-3:1755     0 AMB  25-1:1755   3.50    (#   1755:25  Double Ambig)
 &rst
  ixpk= 1755, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 557,1152,
 igr2= 559, 560, 559, 560,1341,1342,1341,1342,
 &end
#
#   33 GLN  HN            0 AMB  25-1:1757   5.50    (#   1757:25  Single Ambig)
 &rst
  ixpk= 1757, nxpk= 25, iat= 555,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 559, 560, 559, 560,
 &end
#
#    0 AMB  25-3:1758     0 AMB  25-1:1758   5.50    (#   1758:25  Double Ambig)
 &rst
  ixpk= 1758, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 580, 588, 572,
 igr2= 559, 560, 559, 560, 559, 560,
 &end
#
#   69 MET  HN            0 AMB  25-1:1759   5.50    (#   1759:25  Single Ambig)
 &rst
  ixpk= 1759, nxpk= 25, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1341,1342,1341,1342,
 &end
#
#    0 AMB  25-3:1760     0 AMB  25-1:1760   2.80    (#   1760:25  Double Ambig)
 &rst
  ixpk= 1760, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1=1344,1345,1346, 177, 178, 179, 181, 182,
 igr2=1341,1342,1341,1342,1341,1342,1341,1342,
 &end
#
#    9 ILE  QD1          81 ILE  QD1         5.50    (#   1761:25  Unique         2.67, 4.80 A)
 &rst
  ixpk= 1761, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 144, 145, 146,
 igr2=1344,1345,1346,
 &end
#
#    0 AMB  25-3:1762    81 ILE  QD1         4.50    (#   1762:25  Single Ambig)
 &rst
  ixpk= 1762, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
 igr1=1085,1086,1087,1089,1090,1091, 184, 185, 186,
 igr2=1344,1345,1346,
 &end
#
#    0 AMB  25-3:1763    81 ILE  QD1         4.50    (#   1763:25  Single Ambig)
 &rst
  ixpk= 1763, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1083,1070,1071,1072,
 igr2=1344,1345,1346,
 &end
#
#    0 AMB  25-3:1764    81 ILE  QD1         2.80    (#   1764:25  Single Ambig)
 &rst
  ixpk= 1764, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1341,1342,1341,1342,
 igr2=1344,1345,1346,
 &end
#
#   69 MET  HB+          81 ILE  QD1         3.50    (#   1765:25  Unique         2.33, 3.21 A)
 &rst
  ixpk= 1765, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1137,1138,
 igr2=1344,1345,1346,
 &end
#
#   69 MET  QE           81 ILE  QD1         5.50    (#   1766:25  Unique         4.17, 6.36 A)
 &rst
  ixpk= 1766, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1144,1145,1146,
 igr2=1344,1345,1346,
 &end
#
#    0 AMB  25-3:1767    81 ILE  QD1         4.50    (#   1767:25  Single Ambig)
 &rst
  ixpk= 1767, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1137,1138,1308,1309,1310,
 igr2=1344,1345,1346,
 &end
#
#    0 AMB  25-3:1768    81 ILE  QD1         5.50    (#   1768:25  Single Ambig)
 &rst
  ixpk= 1768, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1301,1302,1154,1155,
 igr2=1344,1345,1346,
 &end
#
#   66 LEU  HA           81 ILE  QD1         4.50    (#   1769:25  Unique         2.72, 3.70 A)
 &rst
  ixpk= 1769, nxpk= 25, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1344,1345,1346,
 &end
#
#   70 GLN  HA           81 ILE  QD1         4.50    (#   1770:25  Unique         2.31, 3.51 A)
 &rst
  ixpk= 1770, nxpk= 25, iat=1152,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1344,1345,1346,
 &end
#
#   81 ILE  HA           81 ILE  QD1         5.50    (#   1771:25  Unique         4.43, 4.84 A)
 &rst
  ixpk= 1771, nxpk= 25, iat=1333,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1344,1345,1346,
 &end
#
#   31 PHE  QE           81 ILE  QD1         5.50    (#   1772:25  Unique         2.22, 4.47 A)
 &rst
  ixpk= 1772, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 534, 538,
 igr2=1344,1345,1346,
 &end
#
#   70 GLN  HN           81 ILE  QD1         4.50    (#   1773:25  Unique         2.80, 3.97 A)
 &rst
  ixpk= 1773, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1344,1345,1346,
 &end
#
#   69 MET  HN           81 ILE  QD1         5.50    (#   1774:25  Unique         3.72, 4.64 A)
 &rst
  ixpk= 1774, nxpk= 25, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1344,1345,1346,
 &end
#
#   81 ILE  HN           81 ILE  QD1         5.50    (#   1775:25  Unique         4.18, 5.10 A)
 &rst
  ixpk= 1775, nxpk= 25, iat=1331,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1344,1345,1346,
 &end
#
#    0 AMB  25-3:1776    81 ILE  QD1         5.50    (#   1776:25  Single Ambig)
 &rst
  ixpk= 1776, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1167,1297,
 igr2=1344,1345,1346,
 &end
#
#   66 LEU  MDX          81 ILE  QG2         3.50    (#   1777:25  Unique         2.75, 4.76 A)
 &rst
  ixpk= 1777, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1337,1338,1339,
 &end
#
#    9 ILE  QD1          81 ILE  QG2         3.50    (#   1778:25  Unique         2.16, 3.80 A)
 &rst
  ixpk= 1778, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 144, 145, 146,
 igr2=1337,1338,1339,
 &end
#
#    0 AMB  25-3:1779    81 ILE  QG2         4.50    (#   1779:25  Single Ambig)
 &rst
  ixpk= 1779, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
 igr1=1085,1086,1087,1089,1090,1091, 184, 185, 186,
 igr2=1337,1338,1339,
 &end
#
#   66 LEU  HG           81 ILE  QG2         3.50    (#   1781:25  Unique         1.93, 2.89 A)
 &rst
  ixpk= 1781, nxpk= 25, iat=1083,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1337,1338,1339,
 &end
#
#    0 AMB  25-3:1782    81 ILE  QG2         3.50    (#   1782:25  Single Ambig)
 &rst
  ixpk= 1782, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 181, 182, 141, 142,
 igr2=1337,1338,1339,
 &end
#
#    0 AMB  25-3:1783    81 ILE  QG2         2.80    (#   1783:25  Single Ambig)
 &rst
  ixpk= 1783, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1=1341,1342,1341,1342, 135,
 igr2=1337,1338,1339,
 &end
#
#   81 ILE  HB           81 ILE  QG2         2.80    (#   1784:25  Unique         2.35, 2.67 A)
 &rst
  ixpk= 1784, nxpk= 25, iat=1335,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1337,1338,1339,
 &end
#
#   66 LEU  HA           81 ILE  QG2         3.50    (#   1785:25  Unique         2.31, 3.79 A)
 &rst
  ixpk= 1785, nxpk= 25, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1337,1338,1339,
 &end
#
#   11 ILE  HA           81 ILE  QG2         4.50    (#   1786:25  Unique         2.22, 3.47 A)
 &rst
  ixpk= 1786, nxpk= 25, iat= 173,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1337,1338,1339,
 &end
#
#   81 ILE  HA           81 ILE  QG2         3.50    (#   1788:25  Unique         2.39, 3.01 A)
 &rst
  ixpk= 1788, nxpk= 25, iat=1333,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1337,1338,1339,
 &end
#
#   82 ALA  HN           81 ILE  QG2         3.50    (#   1789:25  Unique         1.83, 2.94 A)
 &rst
  ixpk= 1789, nxpk= 25, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1337,1338,1339,
 &end
#
#   66 LEU  HN           81 ILE  QG2         5.50    (#   1790:25  Unique         4.44, 6.04 A)
 &rst
  ixpk= 1790, nxpk= 25, iat=1076,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1337,1338,1339,
 &end
#
#   83 TYR  HN           82 ALA  HA          3.50    (#   1791:25  Unique         2.54, 2.65 A)
 &rst
  ixpk= 1791, nxpk= 25, iat=1360,1352, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   82 ALA  HN           82 ALA  HA          4.50    (#   1793:25  Unique         2.74, 2.93 A)
 &rst
  ixpk= 1793, nxpk= 25, iat=1350,1352, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   82 ALA  QB           82 ALA  HA          2.80    (#   1794:25  Unique         2.45, 2.69 A)
 &rst
  ixpk= 1794, nxpk= 25, iat=  -1,1352, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1354,1355,1356,
 &end
#
#   66 LEU  MDX          82 ALA  HA          3.50    (#   1795:25  Unique         2.16, 3.90 A)
 &rst
  ixpk= 1795, nxpk= 25, iat=  -1,1352, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1797     0 AMB  25-1:1797   2.80    (#   1797:25  Double Ambig)
 &rst
  ixpk= 1797, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1=1265,1266,1265,1266, 404, 405, 404, 405,1287,1288,
      
 igr2=1268,1269,1268,1269, 336, 337,1268,1269,
 &end
#
#   33 GLN  HA           34 PHE  HB+         5.50    (#   1801:25  Unique         5.10, 6.12 A)
 &rst
  ixpk= 1801, nxpk= 25, iat= 557,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 576, 577,
 &end
#
#    0 AMB  25-3:1803     0 AMB  25-1:1803   3.50    (#   1803:25  Double Ambig)
 &rst
  ixpk= 1803, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 580, 588, 572, 592,
 igr2= 576, 577, 576, 577, 576, 577,
 &end
#
#    0 AMB  25-3:1804    34 PHE  HB-         3.50    (#   1804:25  Single Ambig)
 &rst
  ixpk= 1804, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 580, 588, 572, 592,
 igr2= 576, 577,
 &end
#
#   56 PHE  QE            0 AMB  25-1:1805   5.50    (#   1805:25  Single Ambig)
 &rst
  ixpk= 1805, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 947, 951,
 igr2= 528, 529, 576, 577,
 &end
#
#    0 AMB  25-3:1806    34 PHE  HB-         5.50    (#   1806:25  Single Ambig)
 &rst
  ixpk= 1806, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 947, 951, 582, 586,
 igr2= 576, 577,
 &end
#
#    0 AMB  25-3:1807     0 AMB  25-1:1807   5.50    (#   1807:25  Double Ambig)
 &rst
  ixpk= 1807, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1268,1269,1268,1269,1354,1355,1356,1335,
 igr2=1299,1383,
 &end
#
#    0 AMB  25-3:1808    84 SER  HA          4.50    (#   1808:25  Single Ambig)
 &rst
  ixpk= 1808, nxpk= 25, iat=  -1,1383, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1392,1381,
 &end
#
#   84 SER  HB-          84 SER  HA          3.50    (#   1811:25  Unique         2.35, 2.71 A)
 &rst
  ixpk= 1811, nxpk= 25, iat=  -1,1383, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1385,1386,
 &end
#
#    0 AMB  25-3:1812    84 SER  HA          5.50    (#   1812:25  Single Ambig)
 &rst
  ixpk= 1812, nxpk= 25, iat=  -1,1383, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 154, 155, 154, 155,
 &end
#
#    8 THR  QG2          84 SER  HB+         4.50    (#   1815:25  Unique         2.37, 4.17 A)
 &rst
  ixpk= 1815, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 123, 124, 125,
 igr2=1385,1386,
 &end
#
#    8 THR  QG2          84 SER  HB-         5.50    (#   1816:25  Unique         2.37, 4.17 A)
 &rst
  ixpk= 1816, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 123, 124, 125,
 igr2=1385,1386,
 &end
#
#   84 SER  HA           84 SER  HB-         4.50    (#   1817:25  Unique         2.35, 2.71 A)
 &rst
  ixpk= 1817, nxpk= 25, iat=1383,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1385,1386,
 &end
#
#   84 SER  HA           84 SER  HB+         4.50    (#   1818:25  Unique         2.35, 2.71 A)
 &rst
  ixpk= 1818, nxpk= 25, iat=1383,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1385,1386,
 &end
#
#    8 THR  HB           84 SER  HB-         4.50    (#   1819:25  Unique         2.12, 3.05 A)
 &rst
  ixpk= 1819, nxpk= 25, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1385,1386,
 &end
#
#    8 THR  HB           84 SER  HB+         4.50    (#   1820:25  Unique         2.12, 3.05 A)
 &rst
  ixpk= 1820, nxpk= 25, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1385,1386,
 &end
#
#    0 AMB  25-3:1824     0 AMB  25-1:1824   4.50    (#   1824:25  Double Ambig)
 &rst
  ixpk= 1824, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1392,1381,
 igr2=1385,1386,1385,1386,
 &end
#
#    0 AMB  25-3:1825     0 AMB  25-1:1825   5.50    (#   1825:25  Double Ambig)
 &rst
  ixpk= 1825, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 158, 167, 160, 165,
 igr2=1385,1386,1385,1386,
 &end
#
#   36 GLN  HB-          36 GLN  HA          3.50    (#   1827:25  Unique         2.22, 2.74 A)
 &rst
  ixpk= 1827, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 603, 604,
 &end
#
#   36 GLN  HG+          36 GLN  HA          4.50    (#   1828:25  Unique         2.31, 3.43 A)
 &rst
  ixpk= 1828, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 606, 607,
 &end
#
#    0 AMB  25-3:1829     0 AMB  25-1:1829   5.50    (#   1829:25  Double Ambig)
 &rst
  ixpk= 1829, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1396,1397,1396,1397, 626, 627,
 igr2=1394, 601,
 &end
#
#    0 AMB  25-3:1830     0 AMB  25-1:1830   5.50    (#   1830:25  Double Ambig)
 &rst
  ixpk= 1830, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 599,1392,
 igr2= 601,1394,
 &end
#
#   88 SER  HB+          88 SER  HA          3.50    (#   1833:25  Unique         2.21, 2.72 A)
 &rst
  ixpk= 1833, nxpk= 25, iat=  -1,1439, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1441,1442,
 &end
#
#   89 ASP  HN           88 SER  HA          5.50    (#   1834:25  Unique         3.51, 3.57 A)
 &rst
  ixpk= 1834, nxpk= 25, iat=1448,1439, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   92 ALA  QB           88 SER  HB+         5.50    (#   1842:25  Unique         4.08, 6.04 A)
 &rst
  ixpk= 1842, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1499,1500,1501,
 igr2=1441,1442,
 &end
#
#   55 ILE  HG1+         84 SER  HB-         5.50    (#   1843:25  Unique         5.85, 7.18 A)
 &rst
  ixpk= 1843, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 928, 929,
 igr2=1385,1386,
 &end
#
#  102 PRO  HA          101 ARG  HA          4.50    (#   1850:25  Unique         4.28, 4.45 A)
 &rst
  ixpk= 1850, nxpk= 25, iat=1680,1648, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   90 ILE  HA           90 ILE  HB          4.50    (#   1857:25  Unique         2.16, 2.40 A)
 &rst
  ixpk= 1857, nxpk= 25, iat=1462,1464, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   90 ILE  HN           90 ILE  HB          4.50    (#   1859:25  Unique         3.57, 3.69 A)
 &rst
  ixpk= 1859, nxpk= 25, iat=1460,1464, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   90 ILE  HN           90 ILE  HG1+        5.50    (#   1866:25  Unique         2.05, 2.78 A)
 &rst
  ixpk= 1866, nxpk= 25, iat=1460,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1470,1471,
 &end
#
#   90 ILE  HN           90 ILE  HG1-        5.50    (#   1867:25  Unique         2.05, 2.78 A)
 &rst
  ixpk= 1867, nxpk= 25, iat=1460,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1470,1471,
 &end
#
#   90 ILE  HG1+         90 ILE  QD1         2.80    (#   1871:25  Unique         2.30, 2.66 A)
 &rst
  ixpk= 1871, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1470,1471,
 igr2=1473,1474,1475,
 &end
#
#   90 ILE  HG1+         90 ILE  QG2         3.50    (#   1879:25  Unique         2.46, 3.56 A)
 &rst
  ixpk= 1879, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1470,1471,
 igr2=1466,1467,1468,
 &end
#
#   91 VAL  HA           90 ILE  QG2         5.50    (#   1883:25  Unique         6.47, 6.66 A)
 &rst
  ixpk= 1883, nxpk= 25, iat=1481,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1466,1467,1468,
 &end
#
#   53 PHE  QE           90 ILE  QG2         5.50    (#   1886:25  Unique         2.71, 4.55 A)
 &rst
  ixpk= 1886, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 892, 896,
 igr2=1466,1467,1468,
 &end
#
#   91 VAL  HN           90 ILE  QG2         4.50    (#   1887:25  Unique         4.30, 4.90 A)
 &rst
  ixpk= 1887, nxpk= 25, iat=1479,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1466,1467,1468,
 &end
#
#   90 ILE  HN           90 ILE  QG2         4.50    (#   1889:25  Unique         2.23, 3.32 A)
 &rst
  ixpk= 1889, nxpk= 25, iat=1460,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1466,1467,1468,
 &end
#
#   93 LYS  HN           90 ILE  QG2         5.50    (#   1890:25  Unique         5.23, 6.22 A)
 &rst
  ixpk= 1890, nxpk= 25, iat=1505,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1466,1467,1468,
 &end
#
#   94 ILE  HB           91 VAL  HA          5.50    (#   1891:25  Unique         2.34, 4.98 A)
 &rst
  ixpk= 1891, nxpk= 25, iat=1531,1481, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   87 ASP  HA           91 VAL  HB          5.50    (#   1897:25  Unique         4.35, 5.29 A)
 &rst
  ixpk= 1897, nxpk= 25, iat=1427,1483, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   91 VAL  HN           91 VAL  HB          4.50    (#   1898:25  Unique         2.34, 2.45 A)
 &rst
  ixpk= 1898, nxpk= 25, iat=1479,1483, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   90 ILE  HG1-         91 VAL  QG+         3.50    (#   1901:25  Unique         2.34, 5.30 A)
 &rst
  ixpk= 1901, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1470,1471,
 igr2=1485,1486,1487,1489,1490,1491,
 &end
#
#   90 ILE  HB           91 VAL  QG+         5.50    (#   1902:25  Unique         4.64, 6.56 A)
 &rst
  ixpk= 1902, nxpk= 25, iat=1464,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1485,1486,1487,1489,1490,1491,
 &end
#
#   94 ILE  HG1-         91 VAL  QG+         5.50    (#   1903:25  Unique         3.81, 5.35 A)
 &rst
  ixpk= 1903, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1537,1538,
 igr2=1485,1486,1487,1489,1490,1491,
 &end
#
#   91 VAL  HB           91 VAL  QG+         3.50    (#   1904:25  Unique         2.28, 2.68 A)
 &rst
  ixpk= 1904, nxpk= 25, iat=1483,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1485,1486,1487,1489,1490,1491,
 &end
#
#   91 VAL  HA           91 VAL  QG+         3.50    (#   1905:25  Unique         2.15, 3.15 A)
 &rst
  ixpk= 1905, nxpk= 25, iat=1481,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1485,1486,1487,1489,1490,1491,
 &end
#
#   89 ASP  HA           91 VAL  QG+         5.50    (#   1907:25  Unique         6.21, 7.42 A)
 &rst
  ixpk= 1907, nxpk= 25, iat=1450,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1485,1486,1487,1489,1490,1491,
 &end
#
#   91 VAL  HN           91 VAL  QG+         4.50    (#   1908:25  Unique         2.07, 3.86 A)
 &rst
  ixpk= 1908, nxpk= 25, iat=1479,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1485,1486,1487,1489,1490,1491,
 &end
#
#    0 AMB  25-3:1910    41 VAL  QG-         5.50    (#   1910:25  Single Ambig)
 &rst
  ixpk= 1910, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 886, 887, 886, 887,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   98 PHE  HA           92 ALA  HA          5.50    (#   1919:25  Unique         4.05, 4.81 A)
 &rst
  ixpk= 1919, nxpk= 25, iat=1591,1497, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   91 VAL  QG-          92 ALA  QB          5.50    (#   1922:25  Unique         4.33, 6.90 A)
 &rst
  ixpk= 1922, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1485,1486,1487,1489,1490,1491,
 igr2=1499,1500,1501,
 &end
#
#   94 ILE  HG1+         92 ALA  QB          7.00    (#   1923:25  Unique         6.22, 7.44 A)
 &rst
  ixpk= 1923, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1537,1538,
 igr2=1499,1500,1501,
 &end
#
#   98 PHE  HB-          92 ALA  QB          5.50    (#   1928:25  Unique         2.44, 5.08 A)
 &rst
  ixpk= 1928, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1593,1594,
 igr2=1499,1500,1501,
 &end
#
#   89 ASP  HA           92 ALA  QB          4.50    (#   1930:25  Unique         2.35, 3.70 A)
 &rst
  ixpk= 1930, nxpk= 25, iat=1450,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1499,1500,1501,
 &end
#
#   98 PHE  QD           92 ALA  QB          5.50    (#   1932:25  Unique         2.56, 6.30 A)
 &rst
  ixpk= 1932, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1597,1605,
 igr2=1499,1500,1501,
 &end
#
#   17 LYS  HN           17 LYS  HG+         4.50    (#   1944:25  Unique         2.29, 3.30 A)
 &rst
  ixpk= 1944, nxpk= 25, iat= 266,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 273, 274,
 &end
#
#    0 AMB  25-3:1951     0 AMB  25-1:1951   5.50    (#   1951:25  Double Ambig)
 &rst
  ixpk= 1951, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.00, r4=11.50,
 igr1= 859, 860, 859, 860, 859, 860, 862, 863,
 igr2= 798, 799, 798, 799, 798, 799, 798, 799,
 &end
#
#   94 ILE  QD1          94 ILE  HA          4.50    (#   1952:25  Unique         4.20, 5.05 A)
 &rst
  ixpk= 1952, nxpk= 25, iat=  -1,1529, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1540,1541,1542,
 &end
#
#   64 ASN  HN            0 AMB  25-1:1957   4.50    (#   1957:25  Single Ambig)
 &rst
  ixpk= 1957, nxpk= 25, iat=1052,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1045,1046,1045,1046,
 &end
#
#   91 VAL  HA           94 ILE  HB          5.50    (#   1960:25  Unique         2.34, 4.98 A)
 &rst
  ixpk= 1960, nxpk= 25, iat=1481,1531, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 ILE  HA           94 ILE  HB          5.50    (#   1961:25  Unique         2.25, 2.41 A)
 &rst
  ixpk= 1961, nxpk= 25, iat=1529,1531, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 ILE  HG1+         94 ILE  HB          5.50    (#   1964:25  Unique         2.01, 2.72 A)
 &rst
  ixpk= 1964, nxpk= 25, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1537,1538,
 &end
#
#   94 ILE  HA           94 ILE  HG1+        4.50    (#   1969:25  Unique         2.46, 3.74 A)
 &rst
  ixpk= 1969, nxpk= 25, iat=1529,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1537,1538,
 &end
#
#    0 AMB  25-3:1971     0 AMB  25-1:1971   5.50    (#   1971:25  Double Ambig)
 &rst
  ixpk= 1971, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 622, 623, 624, 464, 465, 466,
 igr2= 676, 677, 676, 677,
 &end
#
#   94 ILE  HG1+         94 ILE  QD1         2.80    (#   1973:25  Unique         2.20, 2.64 A)
 &rst
  ixpk= 1973, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1537,1538,
 igr2=1540,1541,1542,
 &end
#
#   90 ILE  HG1-         94 ILE  QD1         4.50    (#   1974:25  Unique         2.48, 6.05 A)
 &rst
  ixpk= 1974, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1470,1471,
 igr2=1540,1541,1542,
 &end
#
#   90 ILE  HG1+         90 ILE  QD1         3.50    (#   1975:25  Unique         2.30, 2.66 A)
 &rst
  ixpk= 1975, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1470,1471,
 igr2=1473,1474,1475,
 &end
#
#   91 VAL  HA           94 ILE  QD1         5.50    (#   1980:25  Unique         2.59, 3.56 A)
 &rst
  ixpk= 1980, nxpk= 25, iat=1481,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1540,1541,1542,
 &end
#
#   94 ILE  HA           94 ILE  QD1         5.50    (#   1981:25  Unique         4.20, 5.05 A)
 &rst
  ixpk= 1981, nxpk= 25, iat=1529,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1540,1541,1542,
 &end
#
#   90 ILE  HG1-         94 ILE  QG2         4.50    (#   1983:25  Unique         4.95, 6.58 A)
 &rst
  ixpk= 1983, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1470,1471,
 igr2=1533,1534,1535,
 &end
#
#   94 ILE  HG1+         94 ILE  QG2         2.80    (#   1984:25  Unique         2.34, 3.53 A)
 &rst
  ixpk= 1984, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1537,1538,
 igr2=1533,1534,1535,
 &end
#
#   94 ILE  HA           94 ILE  QG2         3.50    (#   1990:25  Unique         2.11, 3.09 A)
 &rst
  ixpk= 1990, nxpk= 25, iat=1529,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1533,1534,1535,
 &end
#
#   15 ASN  HB+          77 LYS  HE-         4.50    (#   2010:25  Unique         2.54, 5.08 A)
 &rst
  ixpk= 2010, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 241, 242,
 igr2=1274,1275,
 &end
#
#   61 SER  HN            5 PRO  HA          7.00    (#   2022:25  Unique         6.20, 6.99 A)
 &rst
  ixpk= 2022, nxpk= 25, iat=1020,  82, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   97 THR  QG2          97 THR  HA          3.50    (#   2023:25  Unique         2.06, 2.93 A)
 &rst
  ixpk= 2023, nxpk= 25, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1581,1582,1583,
 &end
#
#    0 AMB  25-3:2024    68 THR  QG2         5.50    (#   2024:25  Single Ambig)
 &rst
  ixpk= 2024, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1061,1062,1133,
 igr2=1125,1126,1127,
 &end
#
#   89 ASP  HA           98 PHE  HA          5.50    (#   2027:25  Unique         4.40, 5.25 A)
 &rst
  ixpk= 2027, nxpk= 25, iat=1450,1591, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 PHE  HB+          98 PHE  HA          4.50    (#   2028:25  Unique         2.04, 2.56 A)
 &rst
  ixpk= 2028, nxpk= 25, iat=  -1,1591, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1593,1594,
 &end
#
#   98 PHE  QD           98 PHE  HA          4.50    (#   2031:25  Unique         2.17, 3.92 A)
 &rst
  ixpk= 2031, nxpk= 25, iat=  -1,1591, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1597,1605,
 &end
#
#   98 PHE  HA           98 PHE  HB+         4.50    (#   2034:25  Unique         2.04, 2.56 A)
 &rst
  ixpk= 2034, nxpk= 25, iat=1591,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1593,1594,
 &end
#
#   98 PHE  HA           98 PHE  HB-         3.50    (#   2035:25  Unique         2.04, 2.56 A)
 &rst
  ixpk= 2035, nxpk= 25, iat=1591,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1593,1594,
 &end
#
#   98 PHE  QD           98 PHE  HB+         3.50    (#   2040:25  Unique         2.30, 3.09 A)
 &rst
  ixpk= 2040, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1597,1605,
 igr2=1593,1594,
 &end
#
#   98 PHE  QD           98 PHE  HB-         3.50    (#   2041:25  Unique         2.30, 3.09 A)
 &rst
  ixpk= 2041, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1597,1605,
 igr2=1593,1594,
 &end
#
#  100 GLU  HN           99 LYS  HA          4.50    (#   2048:25  Unique         2.20, 3.24 A)
 &rst
  ixpk= 2048, nxpk= 25, iat=1631,1611, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  100 GLU  HB-         100 GLU  HA          4.50    (#   2061:25  Unique         2.14, 2.66 A)
 &rst
  ixpk= 2061, nxpk= 25, iat=  -1,1633, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1635,1636,
 &end
#
#  100 GLU  HB+         100 GLU  HA          3.50    (#   2062:25  Unique         2.14, 2.66 A)
 &rst
  ixpk= 2062, nxpk= 25, iat=  -1,1633, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1635,1636,
 &end
#
#    0 AMB  25-3:2068     0 AMB  25-1:2068   2.80    (#   2068:25  Double Ambig)
 &rst
  ixpk= 2068, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=  28,  29,  28,  29,
 igr2=  25,  26,  25,  26,
 &end
#
#    2 GLU  HA            2 GLU  HB+         5.50    (#   2070:25  Unique         2.21, 2.72 A)
 &rst
  ixpk= 2070, nxpk= 25, iat=  23,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  25,  26,
 &end
#
#    0 AMB  25-3:2075     0 AMB  25-1:2075   5.50    (#   2075:25  Double Ambig)
 &rst
  ixpk= 2075, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1105,1106,1105,1106,
 igr2=  25,  26,  25,  26,
 &end
#
#    0 AMB  25-3:2076     0 AMB  25-1:2076   2.80    (#   2076:25  Double Ambig)
 &rst
  ixpk= 2076, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1= 734, 735, 734, 735, 426, 427, 333, 334,
 igr2= 740, 741, 740, 741, 432, 433, 740, 741,
 &end
#
#    0 AMB  25-3:2078     0 AMB  25-1:2078   2.80    (#   2078:25  Double Ambig)
 &rst
  ixpk= 2078, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 737, 738, 429, 430,
 igr2= 740, 741, 740, 741, 432, 433,
 &end
#
#  101 ARG  HA          101 ARG  HB+         4.50    (#   2081:25  Unique         2.28, 2.68 A)
 &rst
  ixpk= 2081, nxpk= 25, iat=1648,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1650,1651,
 &end
#
#    0 AMB  25-3:2087    46 LEU  HG          2.80    (#   2087:25  Single Ambig)
 &rst
  ixpk= 2087, nxpk= 25, iat=  -1, 773, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 779, 780, 781, 775, 776, 777,
 &end
#
#    0 AMB  25-3:2090     0 AMB  25-1:2090   5.50    (#   2090:25  Double Ambig)
 &rst
  ixpk= 2090, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 253, 768, 268, 787, 850, 851,
 igr2= 831, 832, 773,
 &end
#
#   49 ARG  HA           49 ARG  HG-         4.50    (#   2091:25  Unique         2.26, 2.69 A)
 &rst
  ixpk= 2091, nxpk= 25, iat= 826,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 831, 832,
 &end
#
#   34 PHE  HA           34 PHE  HB+         4.50    (#   2097:25  Unique         2.42, 2.74 A)
 &rst
  ixpk= 2097, nxpk= 25, iat= 574,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 576, 577,
 &end
#
#    0 AMB  25-3:2106    44 LYS  HB-         2.80    (#   2106:25  Single Ambig)
 &rst
  ixpk= 2106, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 737, 738, 737, 738,
 igr2= 734, 735,
 &end
#
#   20 LYS  HN            0 AMB  25-1:2114   4.50    (#   2114:25  Single Ambig)
 &rst
  ixpk= 2114, nxpk= 25, iat= 329,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 743, 744, 743, 744,
 &end
#
#   76 ASP  HN            0 AMB  25-1:2115   5.50    (#   2115:25  Single Ambig)
 &rst
  ixpk= 2115, nxpk= 25, iat=1249,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 279, 280, 279, 280,
 &end
#
#  102 PRO  HD+         102 PRO  HA          4.50    (#   2119:25  Unique         3.48, 3.80 A)
 &rst
  ixpk= 2119, nxpk= 25, iat=  -1,1680, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1671,1672,
 &end
#
#  102 PRO  HA          102 PRO  HB+         4.50    (#   2121:25  Unique         2.27, 2.56 A)
 &rst
  ixpk= 2121, nxpk= 25, iat=1680,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1677,1678,
 &end
#
#  101 ARG  HA          102 PRO  HD-         3.50    (#   2134:25  Unique         2.00, 2.45 A)
 &rst
  ixpk= 2134, nxpk= 25, iat=1648,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1671,1672,
 &end
#
#  102 PRO  HA          102 PRO  HD-         5.50    (#   2143:25  Unique         3.48, 3.80 A)
 &rst
  ixpk= 2143, nxpk= 25, iat=1680,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1671,1672,
 &end
#
#   78 PRO  HA           73 PRO  HA          3.50    (#   2145:25  Unique         2.19, 2.35 A)
 &rst
  ixpk= 2145, nxpk= 25, iat=1293,1204, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   73 PRO  HB+          73 PRO  HA          3.50    (#   2147:25  Unique         2.28, 2.53 A)
 &rst
  ixpk= 2147, nxpk= 25, iat=  -1,1204, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1201,1202,
 &end
#
#   74 PHE  HN           73 PRO  HA          4.50    (#   2148:25  Unique         2.29, 2.39 A)
 &rst
  ixpk= 2148, nxpk= 25, iat=1208,1204, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   74 PHE  HB-          73 PRO  HB-         5.50    (#   2149:25  Unique         5.17, 6.48 A)
 &rst
  ixpk= 2149, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1212,1213,
 igr2=1201,1202,
 &end
#
#   79 MET  HG-          73 PRO  HB+         5.50    (#   2150:25  Unique         6.20, 7.11 A)
 &rst
  ixpk= 2150, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1304,1305,
 igr2=1201,1202,
 &end
#
#   73 PRO  HA           73 PRO  HB+         5.50    (#   2151:25  Unique         2.28, 2.53 A)
 &rst
  ixpk= 2151, nxpk= 25, iat=1204,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1201,1202,
 &end
#
#   73 PRO  HA           73 PRO  HB-         5.50    (#   2152:25  Unique         2.28, 2.53 A)
 &rst
  ixpk= 2152, nxpk= 25, iat=1204,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1201,1202,
 &end
#
#   77 LYS  HN           73 PRO  HB+         5.50    (#   2153:25  Unique         4.33, 4.99 A)
 &rst
  ixpk= 2153, nxpk= 25, iat=1261,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1201,1202,
 &end
#
#   72 PHE  HA           73 PRO  HD+         3.50    (#   2155:25  Unique         2.12, 2.39 A)
 &rst
  ixpk= 2155, nxpk= 25, iat=1176,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1195,1196,
 &end
#
#   72 PHE  HA           73 PRO  HD-         4.50    (#   2156:25  Unique         2.12, 2.39 A)
 &rst
  ixpk= 2156, nxpk= 25, iat=1176,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1195,1196,
 &end
#
#   73 PRO  HB+          73 PRO  HD-         4.50    (#   2157:25  Unique         2.84, 3.71 A)
 &rst
  ixpk= 2157, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1201,1202,
 igr2=1195,1196,
 &end
#
#   73 PRO  HB-          73 PRO  HD-         5.50    (#   2158:25  Unique         2.84, 3.71 A)
 &rst
  ixpk= 2158, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1201,1202,
 igr2=1195,1196,
 &end
#
#   73 PRO  HB-          73 PRO  HD+         4.50    (#   2160:25  Unique         2.84, 3.71 A)
 &rst
  ixpk= 2160, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1201,1202,
 igr2=1195,1196,
 &end
#
#   72 PHE  QD           73 PRO  HD+         5.50    (#   2161:25  Unique         3.01, 4.17 A)
 &rst
  ixpk= 2161, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1182,1190,
 igr2=1195,1196,
 &end
#
#   72 PHE  QD           73 PRO  HD-         5.50    (#   2162:25  Unique         3.01, 4.17 A)
 &rst
  ixpk= 2162, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1182,1190,
 igr2=1195,1196,
 &end
#
#    0 AMB  25-3:2164    78 PRO  HA          5.50    (#   2164:25  Single Ambig)
 &rst
  ixpk= 2164, nxpk= 25, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1287,1288,1265,1266,
 &end
#
#    0 AMB  25-3:2165    78 PRO  HA          5.50    (#   2165:25  Single Ambig)
 &rst
  ixpk= 2165, nxpk= 25, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1290,1291,1287,1288,
 &end
#
#    7 GLN  HN            5 PRO  HA          7.00    (#   2167:25  Unique         3.84, 5.90 A)
 &rst
  ixpk= 2167, nxpk= 25, iat= 100,  82, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   79 MET  HN           78 PRO  HA          5.50    (#   2169:25  Unique         2.19, 2.25 A)
 &rst
  ixpk= 2169, nxpk= 25, iat=1297,1293, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   75 TYR  HN           78 PRO  HA          5.50    (#   2170:25  Unique         4.69, 4.99 A)
 &rst
  ixpk= 2170, nxpk= 25, iat=1228,1293, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:2171    78 PRO  HA          5.50    (#   2171:25  Single Ambig)
 &rst
  ixpk= 2171, nxpk= 25, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1287,1288,1265,1266,
 &end
#
#    0 AMB  25-3:2172     0 AMB  25-1:2172   4.50    (#   2172:25  Double Ambig)
 &rst
  ixpk= 2172, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1169,1170,1284,1285,
 igr2=1290,1291,1290,1291,
 &end
#
#    0 AMB  25-3:2173    78 PRO  HB-         4.50    (#   2173:25  Single Ambig)
 &rst
  ixpk= 2173, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1169,1170,1284,1285,
 igr2=1290,1291,
 &end
#
#    0 AMB  25-3:2174     0 AMB  25-1:2174   3.50    (#   2174:25  Double Ambig)
 &rst
  ixpk= 2174, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1293,1169,1170,
 igr2=1290,1291,1290,1291,
 &end
#
#    0 AMB  25-3:2175    78 PRO  HB-         3.50    (#   2175:25  Single Ambig)
 &rst
  ixpk= 2175, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1293,1169,1170,
 igr2=1290,1291,
 &end
#
#   73 PRO  HA           78 PRO  HB+         5.50    (#   2176:25  Unique         3.28, 4.50 A)
 &rst
  ixpk= 2176, nxpk= 25, iat=1204,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1290,1291,
 &end
#
#   80 GLN  HE2-         78 PRO  HB+         5.50    (#   2177:25  Unique         3.51, 5.73 A)
 &rst
  ixpk= 2177, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1326,1327,
 igr2=1290,1291,
 &end
#
#   78 PRO  HD+          78 PRO  HG+         4.50    (#   2179:25  Unique         2.17, 2.60 A)
 &rst
  ixpk= 2179, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1284,1285,
 igr2=1287,1288,
 &end
#
#   78 PRO  HD-          78 PRO  HG+         4.50    (#   2180:25  Unique         2.17, 2.60 A)
 &rst
  ixpk= 2180, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1284,1285,
 igr2=1287,1288,
 &end
#
#   78 PRO  HD-          78 PRO  HG-         3.50    (#   2181:25  Unique         2.17, 2.60 A)
 &rst
  ixpk= 2181, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1284,1285,
 igr2=1287,1288,
 &end
#
#   78 PRO  HD+          78 PRO  HG-         4.50    (#   2182:25  Unique         2.17, 2.60 A)
 &rst
  ixpk= 2182, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1284,1285,
 igr2=1287,1288,
 &end
#
#    0 AMB  25-3:2183     0 AMB  25-1:2183   5.50    (#   2183:25  Double Ambig)
 &rst
  ixpk= 2183, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1293,1169,1170,
 igr2=1287,1288,1287,1288,
 &end
#
#   77 LYS  HA           78 PRO  HG+         5.50    (#   2184:25  Unique         4.23, 4.55 A)
 &rst
  ixpk= 2184, nxpk= 25, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1287,1288,
 &end
#
#   13 ASN  HD2-         78 PRO  HG+         5.50    (#   2185:25  Unique         2.80, 4.13 A)
 &rst
  ixpk= 2185, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 213, 214,
 igr2=1287,1288,
 &end
#
#   78 PRO  HA           78 PRO  HD+         4.50    (#   2188:25  Unique         3.37, 3.84 A)
 &rst
  ixpk= 2188, nxpk= 25, iat=1293,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1284,1285,
 &end
#
#   77 LYS  HA           78 PRO  HD-         3.50    (#   2189:25  Unique         1.97, 2.40 A)
 &rst
  ixpk= 2189, nxpk= 25, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1284,1285,
 &end
#
#   77 LYS  HA           78 PRO  HD+         3.50    (#   2190:25  Unique         1.97, 2.40 A)
 &rst
  ixpk= 2190, nxpk= 25, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1284,1285,
 &end
#
#   13 ASN  HD2-         78 PRO  HD+         4.50    (#   2191:25  Unique         2.51, 4.02 A)
 &rst
  ixpk= 2191, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 213, 214,
 igr2=1284,1285,
 &end
#
#   13 ASN  HD2-         78 PRO  HD-         5.50    (#   2192:25  Unique         2.51, 4.02 A)
 &rst
  ixpk= 2192, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 213, 214,
 igr2=1284,1285,
 &end
#
#   13 ASN  HD2+         78 PRO  HD+         5.50    (#   2193:25  Unique         2.51, 4.02 A)
 &rst
  ixpk= 2193, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 213, 214,
 igr2=1284,1285,
 &end
#
#    0 AMB  25-3:2194     0 AMB  25-1:2194   5.50    (#   2194:25  Double Ambig)
 &rst
  ixpk= 2194, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1204,1251,
 igr2=1284,1285,1284,1285,
 &end
#
#    0 AMB  25-3:2195    78 PRO  HD-         5.50    (#   2195:25  Single Ambig)
 &rst
  ixpk= 2195, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1271,1272,1271,1272,
 igr2=1284,1285,
 &end
#
#    5 PRO  HG-           5 PRO  HB+         4.50    (#   2196:25  Unique         2.15, 2.62 A)
 &rst
  ixpk= 2196, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  76,  77,
 igr2=  79,  80,
 &end
#
#    5 PRO  HG-           5 PRO  HB-         2.80    (#   2197:25  Unique         2.15, 2.62 A)
 &rst
  ixpk= 2197, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=  76,  77,
 igr2=  79,  80,
 &end
#
#    0 AMB  25-3:2198     0 AMB  25-1:2198   5.50    (#   2198:25  Double Ambig)
 &rst
  ixpk= 2198, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=  73,  74,1015,1016,
 igr2=  79,  80,  79,  80,
 &end
#
#    0 AMB  25-3:2199     5 PRO  HB-         5.50    (#   2199:25  Single Ambig)
 &rst
  ixpk= 2199, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  73,  74,1015,1016,
 igr2=  79,  80,
 &end
#
#    5 PRO  HB+           5 PRO  HG-         4.50    (#   2200:25  Unique         2.15, 2.62 A)
 &rst
  ixpk= 2200, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  79,  80,
 igr2=  76,  77,
 &end
#
#    5 PRO  HB+           5 PRO  HG+         3.50    (#   2201:25  Unique         2.15, 2.62 A)
 &rst
  ixpk= 2201, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  79,  80,
 igr2=  76,  77,
 &end
#
#    0 AMB  25-3:2202     0 AMB  25-1:2202   5.50    (#   2202:25  Double Ambig)
 &rst
  ixpk= 2202, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=  25,  26,  40,  41,  40,  41,
 igr2=1102,1103,1102,1103,1102,1103,
 &end
#
#    5 PRO  HD+           5 PRO  HG-         3.50    (#   2205:25  Unique         1.90, 2.61 A)
 &rst
  ixpk= 2205, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  73,  74,
 igr2=  76,  77,
 &end
#
#    5 PRO  HD+           5 PRO  HG+         5.50    (#   2206:25  Unique         1.90, 2.61 A)
 &rst
  ixpk= 2206, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  73,  74,
 igr2=  76,  77,
 &end
#
#    5 PRO  HD-           5 PRO  HG-         3.50    (#   2207:25  Unique         1.90, 2.61 A)
 &rst
  ixpk= 2207, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  73,  74,
 igr2=  76,  77,
 &end
#
#    4 LEU  HA            5 PRO  HG-         5.50    (#   2208:25  Unique         4.04, 4.48 A)
 &rst
  ixpk= 2208, nxpk= 25, iat=  55,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  76,  77,
 &end
#
#    0 AMB  25-3:2210     0 AMB  25-1:2210   5.50    (#   2210:25  Double Ambig)
 &rst
  ixpk= 2210, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1119,1162,1163,
 igr2=1102,1103,1102,1103,
 &end
#
#    0 AMB  25-3:2212     5 PRO  HD-         4.50    (#   2212:25  Single Ambig)
 &rst
  ixpk= 2212, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=  62,  63,  64,  66,  67,  68,  62,  63,  64,  66,
        67,  68,
 igr2=  73,  74,
 &end
#
#    0 AMB  25-3:2213     0 AMB  25-1:2213   4.50    (#   2213:25  Double Ambig)
 &rst
  ixpk= 2213, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=  62,  63,  64,  66,  67,  68,  62,  63,  64,  66,
        67,  68,
 igr2=  73,  74,  73,  74,
 &end
#
#    0 AMB  25-3:2214     0 AMB  25-1:2214   4.50    (#   2214:25  Double Ambig)
 &rst
  ixpk= 2214, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=  57,  58,  79,  80,
 igr2=  73,  74,  73,  74,
 &end
#
#    0 AMB  25-3:2215     0 AMB  25-1:2215   4.50    (#   2215:25  Double Ambig)
 &rst
  ixpk= 2215, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=  76,  77,  79,  80,
 igr2=  73,  74,  73,  74,
 &end
#
#    5 PRO  HG-           5 PRO  HD+         4.50    (#   2216:25  Unique         1.90, 2.61 A)
 &rst
  ixpk= 2216, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  76,  77,
 igr2=  73,  74,
 &end
#
#    4 LEU  HA            5 PRO  HD+         3.50    (#   2221:25  Unique         2.02, 2.43 A)
 &rst
  ixpk= 2221, nxpk= 25, iat=  55,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=  73,  74,
 &end
#
#   73 PRO  HA           78 PRO  HD-         4.50    (#   2224:25  Unique         4.58, 5.18 A)
 &rst
  ixpk= 2224, nxpk= 25, iat=1204,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1284,1285,
 &end
#
#    0 AMB  25-3:2225    45 THR  QG2         4.50    (#   2225:25  Single Ambig)
 &rst
  ixpk= 2225, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,
 igr2= 758, 759, 760,
 &end
#
#    0 AMB  25-3:2227    45 THR  QG2         4.50    (#   2227:25  Single Ambig)
 &rst
  ixpk= 2227, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 715, 716, 770, 771,
 igr2= 758, 759, 760,
 &end
#
#    0 AMB  25-3:2228    45 THR  QG2         4.50    (#   2228:25  Single Ambig)
 &rst
  ixpk= 2228, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 789, 790, 811, 812, 811, 812,
 igr2= 758, 759, 760,
 &end
#
#   48 MET  HG-          45 THR  QG2         5.50    (#   2231:25  Unique         3.07, 5.14 A)
 &rst
  ixpk= 2231, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 814, 815,
 igr2= 758, 759, 760,
 &end
#
#   45 THR  HB           45 THR  QG2         3.50    (#   2233:25  Unique         2.36, 2.67 A)
 &rst
  ixpk= 2233, nxpk= 25, iat= 756,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 758, 759, 760,
 &end
#
#    0 AMB  25-3:2235    45 THR  QG2         4.50    (#   2235:25  Single Ambig)
 &rst
  ixpk= 2235, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 752, 807,
 igr2= 758, 759, 760,
 &end
#
#    0 AMB  25-3:2237     6 ASN  HA          3.50    (#   2237:25  Single Ambig)
 &rst
  ixpk= 2237, nxpk= 25, iat=  -1,  88, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  90,  91,  90,  91,
 &end
#
#   59 ILE  QG2           6 ASN  HA          4.50    (#   2238:25  Unique         2.14, 3.86 A)
 &rst
  ixpk= 2238, nxpk= 25, iat=  -1,  88, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1000,1001,1002,
 &end
#
#    7 GLN  HN            6 ASN  HA          4.50    (#   2239:25  Unique         2.12, 2.49 A)
 &rst
  ixpk= 2239, nxpk= 25, iat= 100,  88, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:2240     6 ASN  HA          4.50    (#   2240:25  Single Ambig)
 &rst
  ixpk= 2240, nxpk= 25, iat=  -1,  88, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1007,1008,1009,1004,1005, 137, 138, 139,
 &end
#
#    0 AMB  25-3:2241    78 PRO  HD-         4.50    (#   2241:25  Single Ambig)
 &rst
  ixpk= 2241, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1287,1288,1290,1291,
 igr2=1284,1285,
 &end
#
#    0 AMB  25-3:2242     0 AMB  25-1:2242   4.50    (#   2242:25  Double Ambig)
 &rst
  ixpk= 2242, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1287,1288,1290,1291,
 igr2=1284,1285,1284,1285,
 &end
#
#   30 ILE  QG2          69 MET  QE          4.50    (#   2243:25  Unique         2.40, 5.69 A)
 &rst
  ixpk= 2243, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 511, 512, 513,
 igr2=1144,1145,1146,
 &end
#
#   30 ILE  HB           69 MET  QE          4.50    (#   2244:25  Unique         2.78, 4.14 A)
 &rst
  ixpk= 2244, nxpk= 25, iat= 509,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1144,1145,1146,
 &end
#
#   30 ILE  QD1          69 MET  QE          3.50    (#   2245:25  Unique         2.36, 4.36 A)
 &rst
  ixpk= 2245, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 518, 519, 520,
 igr2=1144,1145,1146,
 &end
#
#   81 ILE  QD1          69 MET  QE          4.50    (#   2246:25  Unique         4.17, 6.36 A)
 &rst
  ixpk= 2246, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1344,1345,1346,
 igr2=1144,1145,1146,
 &end
#
#    0 AMB  25-3:2248    69 MET  QE          3.50    (#   2248:25  Single Ambig)
 &rst
  ixpk= 2248, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1137,1138,1140,1141,
 igr2=1144,1145,1146,
 &end
#
#   79 MET  HB+          69 MET  QE          4.50    (#   2249:25  Unique         4.31, 6.44 A)
 &rst
  ixpk= 2249, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1301,1302,
 igr2=1144,1145,1146,
 &end
#
#   79 MET  HG-          69 MET  QE          5.50    (#   2250:25  Unique         2.62, 5.44 A)
 &rst
  ixpk= 2250, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1304,1305,
 igr2=1144,1145,1146,
 &end
#
#    0 AMB  25-3:2251    69 MET  QE          3.50    (#   2251:25  Single Ambig)
 &rst
  ixpk= 2251, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1178,1179,1212,1213,
 igr2=1144,1145,1146,
 &end
#
#    0 AMB  25-3:2252    69 MET  QE          3.50    (#   2252:25  Single Ambig)
 &rst
  ixpk= 2252, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1178,1179,1212,1213,
 igr2=1144,1145,1146,
 &end
#
#   31 PHE  QE           69 MET  QE          4.50    (#   2253:25  Unique         2.64, 4.67 A)
 &rst
  ixpk= 2253, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 534, 538,
 igr2=1144,1145,1146,
 &end
#
#   70 GLN  HN           69 MET  QE          5.50    (#   2254:25  Unique         5.16, 6.78 A)
 &rst
  ixpk= 2254, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1144,1145,1146,
 &end
#
#   72 PHE  QD           69 MET  QE          3.50    (#   2255:25  Unique         2.35, 4.25 A)
 &rst
  ixpk= 2255, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1182,1190,
 igr2=1144,1145,1146,
 &end
#
#   74 PHE  QE           69 MET  QE          4.50    (#   2256:25  Unique         3.57, 6.72 A)
 &rst
  ixpk= 2256, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1218,1222,
 igr2=1144,1145,1146,
 &end
#
#    0 AMB  25-3:2257    69 MET  QE          4.50    (#   2257:25  Single Ambig)
 &rst
  ixpk= 2257, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1216,1224,1184,1188,
 igr2=1144,1145,1146,
 &end
#
#    0 AMB  25-3:2258    69 MET  QE          4.50    (#   2258:25  Single Ambig)
 &rst
  ixpk= 2258, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 524,1174, 544,
 igr2=1144,1145,1146,
 &end
#
#    0 AMB  25-3:2260    79 MET  QE          5.50    (#   2260:25  Single Ambig)
 &rst
  ixpk= 2260, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1= 181, 182,1344,1345,1346,
 igr2=1308,1309,1310,
 &end
#
#   11 ILE  QG2          79 MET  QE          5.50    (#   2261:25  Unique         2.25, 3.54 A)
 &rst
  ixpk= 2261, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 177, 178, 179,
 igr2=1308,1309,1310,
 &end
#
#   52 ALA  QB           48 MET  QE          5.50    (#   2262:25  Unique         4.09, 5.29 A)
 &rst
  ixpk= 2262, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 876, 877, 878,
 igr2= 818, 819, 820,
 &end
#
#   42 ALA  QB           48 MET  QE          4.50    (#   2264:25  Unique         4.02, 5.96 A)
 &rst
  ixpk= 2264, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 705, 706, 707,
 igr2= 818, 819, 820,
 &end
#
#   11 ILE  HB           79 MET  QE          4.50    (#   2265:25  Unique         4.44, 5.46 A)
 &rst
  ixpk= 2265, nxpk= 25, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1308,1309,1310,
 &end
#
#   47 LYS  HG+          48 MET  QE          5.50    (#   2266:25  Unique         4.01, 6.94 A)
 &rst
  ixpk= 2266, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 792, 793,
 igr2= 818, 819, 820,
 &end
#
#    0 AMB  25-3:2268    79 MET  QE          4.50    (#   2268:25  Single Ambig)
 &rst
  ixpk= 2268, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1341,1342,1341,1342,
 igr2=1308,1309,1310,
 &end
#
#    0 AMB  25-3:2269    79 MET  QE          3.50    (#   2269:25  Single Ambig)
 &rst
  ixpk= 2269, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1301,1302,1265,1266,
 igr2=1308,1309,1310,
 &end
#
#   48 MET  HG+          48 MET  QE          3.50    (#   2270:25  Unique         2.27, 3.63 A)
 &rst
  ixpk= 2270, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 814, 815,
 igr2= 818, 819, 820,
 &end
#
#   69 MET  QE           79 MET  QE          3.50    (#   2271:25  Unique         4.02, 7.37 A)
 &rst
  ixpk= 2271, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1144,1145,1146,
 igr2=1308,1309,1310,
 &end
#
#    0 AMB  25-3:2274    48 MET  QE          3.50    (#   2274:25  Single Ambig)
 &rst
  ixpk= 2274, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 859, 860, 859, 860, 862, 863,
 igr2= 818, 819, 820,
 &end
#
#   79 MET  HG-          79 MET  QE          4.50    (#   2275:25  Unique         2.23, 3.61 A)
 &rst
  ixpk= 2275, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1304,1305,
 igr2=1308,1309,1310,
 &end
#
#    0 AMB  25-3:2276    48 MET  QE          4.50    (#   2276:25  Single Ambig)
 &rst
  ixpk= 2276, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 814, 815, 886, 887, 886, 887,
 igr2= 818, 819, 820,
 &end
#
#   48 MET  HA           48 MET  QE          4.50    (#   2277:25  Unique         2.05, 3.14 A)
 &rst
  ixpk= 2277, nxpk= 25, iat= 809,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 818, 819, 820,
 &end
#
#   52 ALA  HA           48 MET  QE          4.50    (#   2279:25  Unique         2.10, 2.82 A)
 &rst
  ixpk= 2279, nxpk= 25, iat= 874,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 818, 819, 820,
 &end
#
#   53 PHE  QD           48 MET  QE          4.50    (#   2280:25  Unique         2.28, 4.47 A)
 &rst
  ixpk= 2280, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 890, 898,
 igr2= 818, 819, 820,
 &end
#
#   53 PHE  QE           48 MET  QE          4.50    (#   2281:25  Unique         2.59, 4.66 A)
 &rst
  ixpk= 2281, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 892, 896,
 igr2= 818, 819, 820,
 &end
#
#   74 PHE  QD           79 MET  QE          5.50    (#   2282:25  Unique         2.72, 4.65 A)
 &rst
  ixpk= 2282, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1216,1224,
 igr2=1308,1309,1310,
 &end
#
#   53 PHE  HN           48 MET  QE          4.50    (#   2284:25  Unique         2.39, 3.55 A)
 &rst
  ixpk= 2284, nxpk= 25, iat= 882,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 818, 819, 820,
 &end
#
#    0 AMB  25-3:2286    40 ILE  QG2         2.80    (#   2286:25  Single Ambig)
 &rst
  ixpk= 2286, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1= 670, 407, 408, 676, 677,
 igr2= 672, 673, 674,
 &end
#
#    0 AMB  25-3:2287    40 ILE  QG2         3.50    (#   2287:25  Single Ambig)
 &rst
  ixpk= 2287, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 407, 408, 705, 706, 707,
 igr2= 672, 673, 674,
 &end
#
#   52 ALA  QB           40 ILE  QG2         4.50    (#   2288:25  Unique         3.64, 5.39 A)
 &rst
  ixpk= 2288, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 876, 877, 878,
 igr2= 672, 673, 674,
 &end
#
#   54 VAL  QG-          40 ILE  QG2         4.50    (#   2289:25  Unique         3.10, 5.87 A)
 &rst
  ixpk= 2289, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 672, 673, 674,
 &end
#
#    0 AMB  25-3:2290    40 ILE  QG2         4.50    (#   2290:25  Single Ambig)
 &rst
  ixpk= 2290, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 687, 904,
 igr2= 672, 673, 674,
 &end
#
#   40 ILE  HA           40 ILE  QG2         3.50    (#   2291:25  Unique         2.45, 3.20 A)
 &rst
  ixpk= 2291, nxpk= 25, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 672, 673, 674,
 &end
#
#   41 VAL  HN           40 ILE  QG2         3.50    (#   2292:25  Unique         2.62, 3.34 A)
 &rst
  ixpk= 2292, nxpk= 25, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 672, 673, 674,
 &end
#
#    0 AMB  25-3:2293    40 ILE  QG2         5.50    (#   2293:25  Single Ambig)
 &rst
  ixpk= 2293, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 666, 474,
 igr2= 672, 673, 674,
 &end
#
#   23 LEU  QD2          40 ILE  QG2         4.50    (#   2294:25  Unique         3.79, 5.33 A)
 &rst
  ixpk= 2294, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 394, 395, 396,
 igr2= 672, 673, 674,
 &end
#
#   27 LEU  QD1          40 ILE  QG2         2.80    (#   2295:25  Unique         2.03, 3.34 A)
 &rst
  ixpk= 2295, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 464, 465, 466,
 igr2= 672, 673, 674,
 &end
#
#   24 LYS  HA           40 ILE  QG2         4.50    (#   2296:25  Unique         2.26, 3.54 A)
 &rst
  ixpk= 2296, nxpk= 25, iat= 402,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 672, 673, 674,
 &end
#
#    0 AMB  25-3:2297     0 AMB  25-1:2297   3.50    (#   2297:25  Double Ambig)
 &rst
  ixpk= 2297, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,
 igr2= 715, 716, 715, 716,
 &end
#
#    0 AMB  25-3:2298    43 LEU  HB-         3.50    (#   2298:25  Single Ambig)
 &rst
  ixpk= 2298, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,
 igr2= 715, 716,
 &end
#
#    0 AMB  25-3:2301     0 AMB  25-1:2301   3.50    (#   2301:25  Double Ambig)
 &rst
  ixpk= 2301, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 779, 780, 781, 775, 776, 777,
 igr2= 770, 771, 770, 771,
 &end
#
#    0 AMB  25-3:2302    46 LEU  HB-         3.50    (#   2302:25  Single Ambig)
 &rst
  ixpk= 2302, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 779, 780, 781, 775, 776, 777,
 igr2= 770, 771,
 &end
#
#   46 LEU  HA           46 LEU  HB+         4.50    (#   2303:25  Unique         1.94, 2.69 A)
 &rst
  ixpk= 2303, nxpk= 25, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 770, 771,
 &end
#
#   46 LEU  HA           46 LEU  HB-         4.50    (#   2304:25  Unique         1.94, 2.69 A)
 &rst
  ixpk= 2304, nxpk= 25, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 770, 771,
 &end
#
#   44 LYS  HA           46 LEU  HB-         7.00    (#   2307:25  Unique         6.13, 7.57 A)
 &rst
  ixpk= 2307, nxpk= 25, iat= 732,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 770, 771,
 &end
#
#   45 THR  QG2          45 THR  HB          2.80    (#   2309:25  Unique         2.36, 2.67 A)
 &rst
  ixpk= 2309, nxpk= 25, iat=  -1, 756, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 758, 759, 760,
 &end
#
#   30 ILE  QG2          30 ILE  HB          3.50    (#   2312:25  Unique         2.34, 2.67 A)
 &rst
  ixpk= 2312, nxpk= 25, iat=  -1, 509, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 511, 512, 513,
 &end
#
#   30 ILE  QD1          30 ILE  HB          4.50    (#   2313:25  Unique         2.35, 3.13 A)
 &rst
  ixpk= 2313, nxpk= 25, iat=  -1, 509, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 518, 519, 520,
 &end
#
#   30 ILE  HG1-         30 ILE  HB          4.50    (#   2314:25  Unique         2.45, 2.80 A)
 &rst
  ixpk= 2314, nxpk= 25, iat=  -1, 509, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 515, 516,
 &end
#
#   30 ILE  HG1+         30 ILE  HB          4.50    (#   2315:25  Unique         2.45, 2.80 A)
 &rst
  ixpk= 2315, nxpk= 25, iat=  -1, 509, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 515, 516,
 &end
#
#   30 ILE  HA           30 ILE  HB          5.50    (#   2316:25  Unique         2.41, 2.64 A)
 &rst
  ixpk= 2316, nxpk= 25, iat= 507, 509, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:2317    30 ILE  HB          5.50    (#   2317:25  Single Ambig)
 &rst
  ixpk= 2317, nxpk= 25, iat=  -1, 509, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 567, 568,1216,1224,1184,1188,
 &end
#
#    0 AMB  25-3:2318    30 ILE  HB          4.50    (#   2318:25  Single Ambig)
 &rst
  ixpk= 2318, nxpk= 25, iat=  -1, 509, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 580, 588, 572,
 &end
#
#   31 PHE  HN           30 ILE  HB          5.50    (#   2319:25  Unique         2.35, 3.42 A)
 &rst
  ixpk= 2319, nxpk= 25, iat= 524, 509, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   68 THR  QG2          68 THR  HB          3.50    (#   2320:25  Unique         2.41, 2.67 A)
 &rst
  ixpk= 2320, nxpk= 25, iat=  -1,1123, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1125,1126,1127,
 &end
#
#    8 THR  QG2           8 THR  HB          4.50    (#   2321:25  Unique         2.32, 2.67 A)
 &rst
  ixpk= 2321, nxpk= 25, iat=  -1, 121, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 123, 124, 125,
 &end
#
#   68 THR  HN           68 THR  HB          4.50    (#   2324:25  Unique         2.53, 2.58 A)
 &rst
  ixpk= 2324, nxpk= 25, iat=1119,1123, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:2325     0 AMB  25-1:2325   4.50    (#   2325:25  Double Ambig)
 &rst
  ixpk= 2325, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 102, 368,
 igr2= 107, 108, 373, 374,
 &end
#
#    0 AMB  25-3:2326     0 AMB  25-1:2326   4.50    (#   2326:25  Double Ambig)
 &rst
  ixpk= 2326, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 102, 368,
 igr2= 107, 108, 373, 374,
 &end
#
#   18 ILE  QG2          22 GLU  HG+         5.50    (#   2327:25  Unique         4.04, 5.45 A)
 &rst
  ixpk= 2327, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 294, 295, 296,
 igr2= 373, 374,
 &end
#
#   18 ILE  QG2          22 GLU  HG-         4.50    (#   2328:25  Unique         4.04, 5.45 A)
 &rst
  ixpk= 2328, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 294, 295, 296,
 igr2= 373, 374,
 &end
#
#   22 GLU  HN           22 GLU  HG-         5.50    (#   2331:25  Unique         1.89, 2.96 A)
 &rst
  ixpk= 2331, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 373, 374,
 &end
#
#   22 GLU  HN           22 GLU  HG+         5.50    (#   2332:25  Unique         1.89, 2.96 A)
 &rst
  ixpk= 2332, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 373, 374,
 &end
#
#    0 AMB  25-3:2333     0 AMB  25-1:2333   4.50    (#   2333:25  Double Ambig)
 &rst
  ixpk= 2333, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 100, 381,
 igr2= 107, 108, 373, 374,
 &end
#
#    0 AMB  25-3:2334     3 MET  HG-         3.50    (#   2334:25  Single Ambig)
 &rst
  ixpk= 2334, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=  40,  41,  40,  41,
 igr2=  43,  44,
 &end
#
#    0 AMB  25-3:2335     3 MET  HG-         5.50    (#   2335:25  Single Ambig)
 &rst
  ixpk= 2335, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  38,1043,
 igr2=  43,  44,
 &end
#
#   61 SER  HA           61 SER  HB-         5.50    (#   2340:25  Unique         2.35, 2.74 A)
 &rst
  ixpk= 2340, nxpk= 25, iat=1022,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1024,1025,
 &end
#
#   90 ILE  HG1-         90 ILE  HA          5.50    (#   2343:25  Unique         3.52, 3.82 A)
 &rst
  ixpk= 2343, nxpk= 25, iat=  -1,1462, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1470,1471,
 &end
#
#   90 ILE  HN           90 ILE  HA          5.50    (#   2346:25  Unique         2.84, 2.89 A)
 &rst
  ixpk= 2346, nxpk= 25, iat=1460,1462, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:2348    25 LYS  HA          5.50    (#   2348:25  Single Ambig)
 &rst
  ixpk= 2348, nxpk= 25, iat=  -1, 424, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 432, 433, 432, 433,
 &end
#
#   24 LYS  HB-          25 LYS  HA          5.50    (#   2349:25  Unique         3.49, 4.73 A)
 &rst
  ixpk= 2349, nxpk= 25, iat=  -1, 424, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 404, 405,
 &end
#
#    0 AMB  25-3:2350    25 LYS  HA          3.50    (#   2350:25  Single Ambig)
 &rst
  ixpk= 2350, nxpk= 25, iat=  -1, 424, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 426, 427, 426, 427,
 &end
#
#   28 TYR  HB+          25 LYS  HA          4.50    (#   2351:25  Unique         2.68, 3.58 A)
 &rst
  ixpk= 2351, nxpk= 25, iat=  -1, 424, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 478, 479,
 &end
#
#   28 TYR  QD           25 LYS  HA          5.50    (#   2352:25  Unique         2.16, 5.12 A)
 &rst
  ixpk= 2352, nxpk= 25, iat=  -1, 424, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 482, 491,
 &end
#
#   66 LEU  MDX          82 ALA  QB          5.50    (#   2357:25  Unique         4.28, 6.23 A)
 &rst
  ixpk= 2357, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1354,1355,1356,
 &end
#
#    0 AMB  25-3:2360    82 ALA  QB          4.50    (#   2360:25  Single Ambig)
 &rst
  ixpk= 2360, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 154, 155, 154, 155,
 igr2=1354,1355,1356,
 &end
#
#   82 ALA  HA           82 ALA  QB          2.80    (#   2361:25  Unique         2.45, 2.69 A)
 &rst
  ixpk= 2361, nxpk= 25, iat=1352,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1354,1355,1356,
 &end
#
#    0 AMB  25-3:2362    82 ALA  QB          5.50    (#   2362:25  Single Ambig)
 &rst
  ixpk= 2362, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1333, 152,
 igr2=1354,1355,1356,
 &end
#
#    0 AMB  25-3:2363    82 ALA  QB          4.50    (#   2363:25  Single Ambig)
 &rst
  ixpk= 2363, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 158, 167, 160, 165,
 igr2=1354,1355,1356,
 &end
#
#   83 TYR  QD           82 ALA  QB          5.50    (#   2364:25  Unique         3.33, 5.81 A)
 &rst
  ixpk= 2364, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1368,1377,
 igr2=1354,1355,1356,
 &end
#
#   83 TYR  HN           82 ALA  QB          2.80    (#   2365:25  Unique         1.88, 3.12 A)
 &rst
  ixpk= 2365, nxpk= 25, iat=1360,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1354,1355,1356,
 &end
#
#   82 ALA  HN           82 ALA  QB          3.50    (#   2366:25  Unique         2.74, 3.43 A)
 &rst
  ixpk= 2366, nxpk= 25, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1354,1355,1356,
 &end
#
#    0 AMB  25-3:2370    43 LEU  QD-         3.50    (#   2370:25  Single Ambig)
 &rst
  ixpk= 2370, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 758, 759, 760, 705, 706, 707,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#    0 AMB  25-3:2372    43 LEU  QD-         2.80    (#   2372:25  Single Ambig)
 &rst
  ixpk= 2372, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 718, 715, 716,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#    4 LEU  HB-           4 LEU  MDY         2.80    (#   2373:25  Unique         2.33, 3.43 A)
 &rst
  ixpk= 2373, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=  57,  58,
 igr2=  62,  63,  64,  66,  67,  68,
 &end
#
#    0 AMB  25-3:2374     0 AMB  25-1:2374   2.80    (#   2374:25  Double Ambig)
 &rst
  ixpk= 2374, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 718, 715, 716,  60,
 igr2= 720, 721, 722, 724, 725, 726,  62,  63,  64,  66,
        67,  68,
 &end
#
#    0 AMB  25-3:2375    43 LEU  QD-         5.50    (#   2375:25  Single Ambig)
 &rst
  ixpk= 2375, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 811, 812, 811, 812,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#    5 PRO  HG-           4 LEU  MDY         5.50    (#   2376:25  Unique         4.50, 7.36 A)
 &rst
  ixpk= 2376, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  76,  77,
 igr2=  62,  63,  64,  66,  67,  68,
 &end
#
#    0 AMB  25-3:2377     0 AMB  25-1:2377   4.50    (#   2377:25  Double Ambig)
 &rst
  ixpk= 2377, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 339, 340,  79,  80,
 igr2= 720, 721, 722, 724, 725, 726,  62,  63,  64,  66,
        67,  68,
 &end
#
#    5 PRO  HD+           4 LEU  MDY         4.50    (#   2378:25  Unique         2.51, 5.26 A)
 &rst
  ixpk= 2378, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=  73,  74,
 igr2=  62,  63,  64,  66,  67,  68,
 &end
#
#    5 PRO  HD-           4 LEU  MDY         4.50    (#   2379:25  Unique         2.51, 5.26 A)
 &rst
  ixpk= 2379, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=  73,  74,
 igr2=  62,  63,  64,  66,  67,  68,
 &end
#
#   43 LEU  HA           43 LEU  QD-         3.50    (#   2380:25  Unique         2.21, 4.05 A)
 &rst
  ixpk= 2380, nxpk= 25, iat= 713,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#    0 AMB  25-3:2381     0 AMB  25-1:2381   3.50    (#   2381:25  Double Ambig)
 &rst
  ixpk= 2381, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=  55, 713,
 igr2=  62,  63,  64,  66,  67,  68, 720, 721, 722, 724,
       725, 726,
 &end
#
#   45 THR  HB           43 LEU  QD-         5.50    (#   2390:25  Unique         3.04, 5.94 A)
 &rst
  ixpk= 2390, nxpk= 25, iat= 756,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#   53 PHE  QD            8 THR  QG2         4.50    (#   2391:25  Unique         2.34, 5.06 A)
 &rst
  ixpk= 2391, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 890, 898,
 igr2= 123, 124, 125,
 &end
#
#    8 THR  HN            8 THR  QG2         5.50    (#   2393:25  Unique         4.44, 4.69 A)
 &rst
  ixpk= 2393, nxpk= 25, iat= 117,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 123, 124, 125,
 &end
#
#    0 AMB  25-3:2394     0 AMB  25-1:2394   2.80    (#   2394:25  Double Ambig)
 &rst
  ixpk= 2394, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 131, 882,
 igr2= 123, 124, 125, 876, 877, 878,
 &end
#
#    8 THR  HA            8 THR  QG2         4.50    (#   2395:25  Unique         2.36, 3.06 A)
 &rst
  ixpk= 2395, nxpk= 25, iat= 119,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 123, 124, 125,
 &end
#
#   53 PHE  HA            0 AMB  25-1:2396   5.50    (#   2396:25  Single Ambig)
 &rst
  ixpk= 2396, nxpk= 25, iat= 884,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 123, 124, 125, 876, 877, 878,
 &end
#
#    0 AMB  25-3:2397     8 THR  QG2         4.50    (#   2397:25  Single Ambig)
 &rst
  ixpk= 2397, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1385,1386,1385,1386,
 igr2= 123, 124, 125,
 &end
#
#    8 THR  HB            8 THR  QG2         4.50    (#   2398:25  Unique         2.32, 2.67 A)
 &rst
  ixpk= 2398, nxpk= 25, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 123, 124, 125,
 &end
#
#    0 AMB  25-3:2399     8 THR  QG2         4.50    (#   2399:25  Single Ambig)
 &rst
  ixpk= 2399, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 886, 887, 886, 887,
 igr2= 123, 124, 125,
 &end
#
#    0 AMB  25-3:2401    38 LEU  QD-         3.50    (#   2401:25  Single Ambig)
 &rst
  ixpk= 2401, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 642, 639, 640,
 igr2= 644, 645, 646, 648, 649, 650,
 &end
#
#    0 AMB  25-3:2402    38 LEU  QD-         4.50    (#   2402:25  Single Ambig)
 &rst
  ixpk= 2402, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 964, 965, 964, 965, 961, 962,
 igr2= 644, 645, 646, 648, 649, 650,
 &end
#
#    0 AMB  25-3:2403    38 LEU  QD-         5.50    (#   2403:25  Single Ambig)
 &rst
  ixpk= 2403, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1= 967, 968, 967, 968, 922,
 igr2= 644, 645, 646, 648, 649, 650,
 &end
#
#   38 LEU  HA           38 LEU  QD-         4.50    (#   2405:25  Unique         2.24, 3.86 A)
 &rst
  ixpk= 2405, nxpk= 25, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 644, 645, 646, 648, 649, 650,
 &end
#
#    0 AMB  25-3:2408    61 SER  HA          4.50    (#   2408:25  Single Ambig)
 &rst
  ixpk= 2408, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1020,1061,1062,
 &end
#
#    0 AMB  25-3:2413    10 TYR  HA          5.50    (#   2413:25  Single Ambig)
 &rst
  ixpk= 2413, nxpk= 25, iat=  -1, 152, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 154, 155, 154, 155,
 &end
#
#   10 TYR  HA            0 AMB  25-1:2414   5.50    (#   2414:25  Single Ambig)
 &rst
  ixpk= 2414, nxpk= 25, iat= 152,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 154, 155, 154, 155,
 &end
#
#   10 TYR  QD            0 AMB  25-1:2415   5.50    (#   2415:25  Single Ambig)
 &rst
  ixpk= 2415, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 158, 167,
 igr2= 154, 155, 154, 155,
 &end
#
#   82 ALA  QB            0 AMB  25-1:2418   5.50    (#   2418:25  Single Ambig)
 &rst
  ixpk= 2418, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1354,1355,1356,
 igr2= 154, 155, 154, 155,
 &end
#
#   11 ILE  HA           11 ILE  HG1-        5.50    (#   2419:25  Unique         2.37, 2.72 A)
 &rst
  ixpk= 2419, nxpk= 25, iat= 173,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 181, 182,
 &end
#
#   11 ILE  HA           11 ILE  HG1+        5.50    (#   2420:25  Unique         2.37, 2.72 A)
 &rst
  ixpk= 2420, nxpk= 25, iat= 173,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 181, 182,
 &end
#
#   14 LEU  HB-          14 LEU  HA          5.50    (#   2421:25  Unique         2.50, 2.87 A)
 &rst
  ixpk= 2421, nxpk= 25, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 222, 223,
 &end
#
#   27 LEU  HN           27 LEU  HG          5.50    (#   2422:25  Unique         2.47, 2.66 A)
 &rst
  ixpk= 2422, nxpk= 25, iat= 455, 462, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   30 ILE  QG2          30 ILE  HA          5.50    (#   2423:25  Unique         2.04, 2.91 A)
 &rst
  ixpk= 2423, nxpk= 25, iat=  -1, 507, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 511, 512, 513,
 &end
#
#   30 ILE  HB           30 ILE  HA          5.50    (#   2424:25  Unique         2.41, 2.64 A)
 &rst
  ixpk= 2424, nxpk= 25, iat= 509, 507, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:2425     0 AMB  25-1:2425   5.50    (#   2425:25  Double Ambig)
 &rst
  ixpk= 2425, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 544, 599,
 igr2= 548, 549, 548, 549,
 &end
#
#   34 PHE  HA           32 SER  HB+         7.00    (#   2427:25  Unique         7.37, 7.72 A)
 &rst
  ixpk= 2427, nxpk= 25, iat= 574,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 548, 549,
 &end
#
#   32 SER  HA           32 SER  HB+         5.50    (#   2428:25  Unique         2.34, 2.74 A)
 &rst
  ixpk= 2428, nxpk= 25, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 548, 549,
 &end
#
#   31 PHE  HB-          32 SER  HB+         5.50    (#   2430:25  Unique         4.67, 5.98 A)
 &rst
  ixpk= 2430, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 528, 529,
 igr2= 548, 549,
 &end
#
#    0 AMB  25-3:2431    44 LYS  HA          5.50    (#   2431:25  Single Ambig)
 &rst
  ixpk= 2431, nxpk= 25, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 734, 735, 740, 741, 740, 741, 831, 832, 831, 832,
      
 &end
#
#    0 AMB  25-3:2432    44 LYS  HA          5.50    (#   2432:25  Single Ambig)
 &rst
  ixpk= 2432, nxpk= 25, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 828, 829, 828, 829, 811, 812, 811, 812,
 &end
#
#    0 AMB  25-3:2434    44 LYS  HA          5.50    (#   2434:25  Single Ambig)
 &rst
  ixpk= 2434, nxpk= 25, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 824, 807,
 &end
#
#   45 THR  QG2          45 THR  HA          4.50    (#   2437:25  Unique         2.23, 2.98 A)
 &rst
  ixpk= 2437, nxpk= 25, iat=  -1, 754, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 758, 759, 760,
 &end
#
#   55 ILE  HG1+         55 ILE  HA          5.50    (#   2438:25  Unique         2.15, 3.32 A)
 &rst
  ixpk= 2438, nxpk= 25, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 928, 929,
 &end
#
#    0 AMB  25-3:2439    55 ILE  HA          5.50    (#   2439:25  Single Ambig)
 &rst
  ixpk= 2439, nxpk= 25, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 107, 108, 658, 659,
 &end
#
#    0 AMB  25-3:2442    48 MET  HA          3.50    (#   2442:25  Single Ambig)
 &rst
  ixpk= 2442, nxpk= 25, iat=  -1, 809, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 824, 807,
 &end
#
#    0 AMB  25-3:2443    48 MET  HA          4.50    (#   2443:25  Single Ambig)
 &rst
  ixpk= 2443, nxpk= 25, iat=  -1, 809, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 859, 860, 859, 860, 862, 863,
 &end
#
#    0 AMB  25-3:2444    48 MET  HA          4.50    (#   2444:25  Single Ambig)
 &rst
  ixpk= 2444, nxpk= 25, iat=  -1, 809, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 811, 812, 811, 812,
 &end
#
#   51 GLN  HN           50 GLY  HA+         7.00    (#   2445:25  Unique         2.59, 3.31 A)
 &rst
  ixpk= 2445, nxpk= 25, iat= 855,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 850, 851,
 &end
#
#   51 GLN  HN           50 GLY  HA-         5.50    (#   2446:25  Unique         2.59, 3.31 A)
 &rst
  ixpk= 2446, nxpk= 25, iat= 855,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 850, 851,
 &end
#
#   52 ALA  QB           52 ALA  HA          3.50    (#   2447:25  Unique         2.35, 2.66 A)
 &rst
  ixpk= 2447, nxpk= 25, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 876, 877, 878,
 &end
#
#   54 VAL  QG+          54 VAL  HA          5.50    (#   2448:25  Unique         2.29, 3.59 A)
 &rst
  ixpk= 2448, nxpk= 25, iat=  -1, 904, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 908, 909, 910, 912, 913, 914,
 &end
#
#   54 VAL  QG-          54 VAL  HA          4.50    (#   2449:25  Unique         2.29, 3.59 A)
 &rst
  ixpk= 2449, nxpk= 25, iat=  -1, 904, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 908, 909, 910, 912, 913, 914,
 &end
#
#   40 ILE  HA           54 VAL  HA          5.50    (#   2450:25  Unique         2.17, 2.25 A)
 &rst
  ixpk= 2450, nxpk= 25, iat= 668, 904, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   55 ILE  HN           54 VAL  HA          4.50    (#   2451:25  Unique         1.84, 2.07 A)
 &rst
  ixpk= 2451, nxpk= 25, iat= 918, 904, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   61 SER  HN           61 SER  HB-         5.50    (#   2452:25  Unique         2.52, 3.10 A)
 &rst
  ixpk= 2452, nxpk= 25, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1024,1025,
 &end
#
#   68 THR  HA           68 THR  HB          4.50    (#   2453:25  Unique         3.04, 3.05 A)
 &rst
  ixpk= 2453, nxpk= 25, iat=1121,1123, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:2455    68 THR  HB          5.50    (#   2455:25  Single Ambig)
 &rst
  ixpk= 2455, nxpk= 25, iat=  -1,1123, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1099,1100,1137,1138,
 &end
#
#   77 LYS  HN           77 LYS  HA          5.50    (#   2456:25  Unique         2.85, 2.93 A)
 &rst
  ixpk= 2456, nxpk= 25, iat=1261,1263, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   79 MET  HA           79 MET  HB+         5.50    (#   2457:25  Unique         2.44, 2.80 A)
 &rst
  ixpk= 2457, nxpk= 25, iat=1299,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1301,1302,
 &end
#
#   79 MET  HA           79 MET  HB-         5.50    (#   2458:25  Unique         2.44, 2.80 A)
 &rst
  ixpk= 2458, nxpk= 25, iat=1299,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1301,1302,
 &end
#
#   79 MET  HG+          79 MET  HB+         5.50    (#   2459:25  Unique         2.25, 2.64 A)
 &rst
  ixpk= 2459, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1304,1305,
 igr2=1301,1302,
 &end
#
#   94 ILE  QG2          90 ILE  HG1+        5.50    (#   2473:25  Unique         4.95, 6.58 A)
 &rst
  ixpk= 2473, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1533,1534,1535,
 igr2=1470,1471,
 &end
#
#   94 ILE  QG2          90 ILE  HG1-        5.50    (#   2474:25  Unique         4.95, 6.58 A)
 &rst
  ixpk= 2474, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1533,1534,1535,
 igr2=1470,1471,
 &end
#
#   91 VAL  HB           90 ILE  QG2         7.00    (#   2477:25  Unique         6.63, 7.29 A)
 &rst
  ixpk= 2477, nxpk= 25, iat=1483,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=1466,1467,1468,
 &end
#
#   91 VAL  HN           91 VAL  HA          5.50    (#   2480:25  Unique         2.76, 2.80 A)
 &rst
  ixpk= 2480, nxpk= 25, iat=1479,1481, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   57 LYS  HA           38 LEU  QD-         5.50    (#   2481:25  Unique         2.27, 4.25 A)
 &rst
  ixpk= 2481, nxpk= 25, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 644, 645, 646, 648, 649, 650,
 &end
#
#   41 VAL  HA           41 VAL  QG-         4.50    (#   2482:25  Unique         2.17, 3.19 A)
 &rst
  ixpk= 2482, nxpk= 25, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   46 LEU  QD2          47 LYS  HA          4.50    (#   2490:25  Unique         2.89, 4.77 A)
 &rst
  ixpk= 2490, nxpk= 25, iat=  -1, 787, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 779, 780, 781,
 &end
#
#    0 AMB  25-3:2494     7 GLN  HA          5.50    (#   2494:25  Single Ambig)
 &rst
  ixpk= 2494, nxpk= 25, iat=  -1, 102, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 117,1041,
 &end
#
#    0 AMB  25-3:2502    59 ILE  QD1         5.50    (#   2502:25  Single Ambig)
 &rst
  ixpk= 2502, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  90,  91,  90,  91,
 igr2=1007,1008,1009,
 &end
#
#    0 AMB  25-3:2503    59 ILE  QD1         5.50    (#   2503:25  Single Ambig)
 &rst
  ixpk= 2503, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 983, 984, 104, 105,
 igr2=1007,1008,1009,
 &end
#
#   17 LYS  HN           17 LYS  HG-         4.50    (#   2508:25  Unique         2.29, 3.30 A)
 &rst
  ixpk= 2508, nxpk= 25, iat= 266,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 273, 274,
 &end
#
#   77 LYS  HE+          77 LYS  HD-         4.50    (#   2513:25  Unique         2.15, 2.72 A)
 &rst
  ixpk= 2513, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1274,1275,
 igr2=1271,1272,
 &end
#
#    9 ILE  HN            8 THR  HA          4.50    (#   2514:25  Unique         2.12, 2.26 A)
 &rst
  ixpk= 2514, nxpk= 25, iat= 131, 119, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    3 MET  HN            2 GLU  HA          3.50    (#   2515:25  Unique         2.18, 2.54 A)
 &rst
  ixpk= 2515, nxpk= 25, iat=  36,  23, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  25-3:2520     0 AMB  25-1:2520   3.50    (#   2520:25  Double Ambig)
 &rst
  ixpk= 2520, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
 igr1= 642, 639, 640, 222, 223,
 igr2= 644, 645, 646, 648, 649, 650, 644, 645, 646, 648,
       649, 650, 298, 299,
 &end
#
#    0 AMB  25-3:2521     0 AMB  25-1:2521   3.50    (#   2521:25  Double Ambig)
 &rst
  ixpk= 2521, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1= 639, 640, 273, 274,
 igr2= 644, 645, 646, 648, 649, 650, 298, 299,
 &end
#
#   57 LYS  HA           38 LEU  QD+         4.50    (#   2522:25  Unique         2.27, 4.25 A)
 &rst
  ixpk= 2522, nxpk= 25, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 644, 645, 646, 648, 649, 650,
 &end
#
#    0 AMB  25-3:2523     0 AMB  25-1:2523   5.50    (#   2523:25  Double Ambig)
 &rst
  ixpk= 2523, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 637, 220,
 igr2= 644, 645, 646, 648, 649, 650, 298, 299,
 &end
#
#   15 ASN  HD2+         18 ILE  HG1-        5.50    (#   2524:25  Unique         2.48, 5.63 A)
 &rst
  ixpk= 2524, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 246, 247,
 igr2= 298, 299,
 &end
#
#    7 GLN  HE2+         38 LEU  QD+         5.50    (#   2525:25  Unique         2.55, 4.83 A)
 &rst
  ixpk= 2525, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 112, 113,
 igr2= 644, 645, 646, 648, 649, 650,
 &end
#
#   37 ILE  QG2          37 ILE  HA          5.50    (#   2527:25  Unique         2.26, 3.25 A)
 &rst
  ixpk= 2527, nxpk= 25, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 622, 623, 624,
 &end
#
#   37 ILE  HA           37 ILE  HB          5.50    (#   2528:25  Unique         2.85, 3.03 A)
 &rst
  ixpk= 2528, nxpk= 25, iat= 618, 620, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:2532    40 ILE  QD1         4.50    (#   2532:25  Single Ambig)
 &rst
  ixpk= 2532, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 402, 476,
 igr2= 679, 680, 681,
 &end
#
#   41 VAL  HN           41 VAL  HA          5.50    (#   2533:25  Unique         2.77, 2.95 A)
 &rst
  ixpk= 2533, nxpk= 25, iat= 685, 687, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:2534    41 VAL  HA          5.50    (#   2534:25  Single Ambig)
 &rst
  ixpk= 2534, nxpk= 25, iat=  -1, 687, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 689, 718, 670, 715, 716,
 &end
#
#    0 AMB  25-3:2535    41 VAL  HA          4.50    (#   2535:25  Single Ambig)
 &rst
  ixpk= 2535, nxpk= 25, iat=  -1, 687, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 691, 692, 693, 695, 696, 697, 672, 673, 674,
 &end
#
#   41 VAL  HN           41 VAL  QG-         5.50    (#   2537:25  Unique         2.26, 4.27 A)
 &rst
  ixpk= 2537, nxpk= 25, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   19 LYS  HG-          19 LYS  HA          4.50    (#   2538:25  Unique         2.37, 2.84 A)
 &rst
  ixpk= 2538, nxpk= 25, iat=  -1, 309, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 314, 315,
 &end
#
#    0 AMB  25-3:2539    19 LYS  HA          3.50    (#   2539:25  Single Ambig)
 &rst
  ixpk= 2539, nxpk= 25, iat=  -1, 309, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 317, 318, 317, 318, 311, 312,
 &end
#
#   19 LYS  HB+          19 LYS  HA          4.50    (#   2540:25  Unique         2.51, 2.80 A)
 &rst
  ixpk= 2540, nxpk= 25, iat=  -1, 309, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 311, 312,
 &end
#
#   19 LYS  HN           19 LYS  HA          4.50    (#   2541:25  Unique         2.86, 2.89 A)
 &rst
  ixpk= 2541, nxpk= 25, iat= 307, 309, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 PRO  HD+           4 LEU  HB-         5.50    (#   2545:25  Unique         2.25, 4.01 A)
 &rst
  ixpk= 2545, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  73,  74,
 igr2=  57,  58,
 &end
#
#    5 PRO  HD-           4 LEU  HB+         5.50    (#   2546:25  Unique         2.25, 4.01 A)
 &rst
  ixpk= 2546, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  73,  74,
 igr2=  57,  58,
 &end
#
#    4 LEU  HN            4 LEU  HB-         4.50    (#   2547:25  Unique         2.19, 3.05 A)
 &rst
  ixpk= 2547, nxpk= 25, iat=  53,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  57,  58,
 &end
#
#   49 ARG  HA           49 ARG  HG-         5.50    (#   2549:25  Unique         2.26, 2.69 A)
 &rst
  ixpk= 2549, nxpk= 25, iat= 826,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 831, 832,
 &end
#
#   54 VAL  QG-          54 VAL  HB          5.50    (#   2550:25  Unique         2.18, 2.64 A)
 &rst
  ixpk= 2550, nxpk= 25, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:2551    54 VAL  HB          5.50    (#   2551:25  Single Ambig)
 &rst
  ixpk= 2551, nxpk= 25, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 902, 131,
 &end
#
#   52 ALA  QB           54 VAL  QG-         5.50    (#   2552:25  Unique         3.17, 6.58 A)
 &rst
  ixpk= 2552, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 876, 877, 878,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:2553     0 AMB  25-1:2553   5.50    (#   2553:25  Double Ambig)
 &rst
  ixpk= 2553, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 918, 117,
 igr2= 928, 929, 928, 929,
 &end
#
#   59 ILE  HA           59 ILE  HB          5.50    (#   2554:25  Unique         2.37, 2.42 A)
 &rst
  ixpk= 2554, nxpk= 25, iat= 996, 998, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   61 SER  HN           62 ALA  QB          5.50    (#   2555:25  Unique         4.41, 5.27 A)
 &rst
  ixpk= 2555, nxpk= 25, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1035,1036,1037,
 &end
#
#    0 AMB  25-3:2556     0 AMB  25-1:2556   5.50    (#   2556:25  Double Ambig)
 &rst
  ixpk= 2556, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1041, 117,
 igr2=1043, 920,
 &end
#
#    0 AMB  25-3:2558    84 SER  HB-         4.50    (#   2558:25  Single Ambig)
 &rst
  ixpk= 2558, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1392,1381,
 igr2=1385,1386,
 &end
#
#    0 AMB  25-3:2560    40 ILE  QD1         3.50    (#   2560:25  Single Ambig)
 &rst
  ixpk= 2560, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 622, 623, 624, 464, 465, 466,
 igr2= 679, 680, 681,
 &end
#
#   61 SER  HB+          61 SER  HA          5.50    (#   2561:25  Unique         2.35, 2.74 A)
 &rst
  ixpk= 2561, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1024,1025,
 &end
#
#   61 SER  HB-          61 SER  HA          5.50    (#   2562:25  Unique         2.35, 2.74 A)
 &rst
  ixpk= 2562, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1024,1025,
 &end
#
#    0 AMB  25-3:2563    61 SER  HA          5.50    (#   2563:25  Single Ambig)
 &rst
  ixpk= 2563, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1020,1061,1062,
 &end
#
#    0 AMB  25-3:2568     0 AMB  25-1:2568   3.50    (#   2568:25  Double Ambig)
 &rst
  ixpk= 2568, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 758, 759, 760, 705, 706, 707,
 igr2= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,
 &end
#
#    0 AMB  25-3:2569     0 AMB  25-1:2569   2.80    (#   2569:25  Double Ambig)
 &rst
  ixpk= 2569, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 718, 715, 716,
 igr2= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,
 &end
#
#   48 MET  QE           43 LEU  QD+         4.50    (#   2571:25  Unique         3.72, 7.60 A)
 &rst
  ixpk= 2571, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 818, 819, 820,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#   48 MET  HG-          43 LEU  QD+         5.50    (#   2572:25  Unique         2.22, 5.48 A)
 &rst
  ixpk= 2572, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 814, 815,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#   43 LEU  HA           43 LEU  QD+         5.50    (#   2573:25  Unique         2.21, 4.05 A)
 &rst
  ixpk= 2573, nxpk= 25, iat= 713,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#   66 LEU  MDY           3 MET  QE          3.50    (#   2576:25  Unique         2.14, 5.10 A)
 &rst
  ixpk= 2576, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=  47,  48,  49,
 &end
#
#   66 LEU  HB+           3 MET  QE          4.50    (#   2578:25  Unique         2.46, 6.15 A)
 &rst
  ixpk= 2578, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1080,1081,
 igr2=  47,  48,  49,
 &end
#
#   67 ARG  HG+           3 MET  QE          3.50    (#   2579:25  Unique         2.23, 4.07 A)
 &rst
  ixpk= 2579, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1102,1103,
 igr2=  47,  48,  49,
 &end
#
#    0 AMB  25-3:2580     3 MET  QE          2.80    (#   2580:25  Single Ambig)
 &rst
  ixpk= 2580, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=  25,  26,1157,1158,
 igr2=  47,  48,  49,
 &end
#
#   70 GLN  HE2-          3 MET  QE          4.50    (#   2587:25  Unique         2.11, 4.02 A)
 &rst
  ixpk= 2587, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1162,1163,
 igr2=  47,  48,  49,
 &end
#
#    0 AMB  25-3:2589    46 LEU  QD2         2.80    (#   2589:25  Single Ambig)
 &rst
  ixpk= 2589, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 773, 770, 771,
 igr2= 779, 780, 781,
 &end
#
#   12 ASN  HB-          12 ASN  HA          5.50    (#   2591:25  Unique         2.39, 2.66 A)
 &rst
  ixpk= 2591, nxpk= 25, iat=  -1, 192, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 194, 195,
 &end
#
#   70 GLN  HE2+         81 ILE  HN          4.50    (#      0:10  Unique         2.13, 3.52 A)
 &rst
  ixpk= 0, nxpk= 10, iat=  -1,1331, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr1=1162,1163,
 &end
#
#   80 GLN  HA           81 ILE  HN          2.80    (#      1:10  Unique         2.17, 2.26 A)
 &rst
  ixpk= 1, nxpk= 10, iat=1316,1331, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:2       81 ILE  HN          5.50    (#      2:10  Single Ambig)
 &rst
  ixpk= 2, nxpk= 10, iat=  -1,1331, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1321,1322,1321,1322,
 &end
#
#   81 ILE  HB           81 ILE  HN          3.50    (#      3:10  Unique         2.78, 2.93 A)
 &rst
  ixpk= 3, nxpk= 10, iat=1335,1331, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   39 ASP  HN           38 LEU  HN          3.50    (#      4:10  Unique         1.90, 2.00 A)
 &rst
  ixpk= 4, nxpk= 10, iat= 654, 635, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   38 LEU  HA           38 LEU  HN          4.50    (#      5:10  Unique         2.79, 2.95 A)
 &rst
  ixpk= 5, nxpk= 10, iat= 637, 635, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   37 ILE  HA           38 LEU  HN          3.50    (#      6:10  Unique         2.04, 2.23 A)
 &rst
  ixpk= 6, nxpk= 10, iat= 618, 635, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   38 LEU  HB+          38 LEU  HN          3.50    (#      7:10  Unique         2.10, 2.77 A)
 &rst
  ixpk= 7, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 639, 640,
 &end
#
#   38 LEU  HB-          38 LEU  HN          3.50    (#      8:10  Unique         2.10, 2.77 A)
 &rst
  ixpk= 8, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 639, 640,
 &end
#
#    0 AMB  10-2:9       38 LEU  HN          3.50    (#      9:10  Single Ambig)
 &rst
  ixpk= 9, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 924, 925, 926, 644, 645, 646, 648, 649, 650,
 &end
#
#   37 ILE  QG2          38 LEU  HN          3.50    (#     10:10  Unique         2.42, 3.19 A)
 &rst
  ixpk= 10, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 622, 623, 624,
 &end
#
#    0 AMB  10-2:11      81 ILE  HN          4.50    (#     11:10  Single Ambig)
 &rst
  ixpk= 11, nxpk= 10, iat=  -1,1331, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1344,1345,1346, 181, 182,
 &end
#
#   82 ALA  HN           10 TYR  HN          4.50    (#     12:10  Unique         2.66, 2.87 A)
 &rst
  ixpk= 12, nxpk= 10, iat=1350, 150, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:14      10 TYR  HN          2.80    (#     14:10  Single Ambig)
 &rst
  ixpk= 14, nxpk= 10, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 154, 155, 154, 155,
 &end
#
#    9 ILE  HB           10 TYR  HN          3.50    (#     15:10  Unique         2.17, 2.50 A)
 &rst
  ixpk= 15, nxpk= 10, iat= 135, 150, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:16      10 TYR  HN          3.50    (#     16:10  Single Ambig)
 &rst
  ixpk= 16, nxpk= 10, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 137, 138, 139, 181, 182,
 &end
#
#    9 ILE  HA           10 TYR  HN          2.80    (#     17:10  Unique         2.04, 2.31 A)
 &rst
  ixpk= 17, nxpk= 10, iat= 133, 150, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:18      10 TYR  HN          5.50    (#     18:10  Single Ambig)
 &rst
  ixpk= 18, nxpk= 10, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 158, 167, 160, 165,
 &end
#
#   22 GLU  HN           21 GLU  HN          5.50    (#     19:10  Unique         2.73, 2.82 A)
 &rst
  ixpk= 19, nxpk= 10, iat= 366, 351, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   21 GLU  HA           21 GLU  HN          3.50    (#     21:10  Unique         2.79, 2.83 A)
 &rst
  ixpk= 21, nxpk= 10, iat= 353, 351, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:22      21 GLU  HN          2.80    (#     22:10  Single Ambig)
 &rst
  ixpk= 22, nxpk= 10, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 355, 356, 355, 356, 311, 312,
 &end
#
#    0 AMB  10-2:23      21 GLU  HN          4.50    (#     23:10  Single Ambig)
 &rst
  ixpk= 23, nxpk= 10, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 333, 334, 311, 312,
 &end
#
#   21 GLU  HG+          21 GLU  HN          5.50    (#     24:10  Unique         4.22, 4.41 A)
 &rst
  ixpk= 24, nxpk= 10, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 358, 359,
 &end
#
#   14 LEU  HG           15 ASN  HN          5.50    (#     25:10  Unique         3.27, 3.78 A)
 &rst
  ixpk= 25, nxpk= 10, iat= 225, 237, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   14 LEU  HB-          15 ASN  HN          5.50    (#     26:10  Unique         2.59, 3.72 A)
 &rst
  ixpk= 26, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 222, 223,
 &end
#
#   15 ASN  HB+          15 ASN  HN          3.50    (#     27:10  Unique         2.25, 2.65 A)
 &rst
  ixpk= 27, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 241, 242,
 &end
#
#   15 ASN  HB-          15 ASN  HN          3.50    (#     28:10  Unique         2.25, 2.65 A)
 &rst
  ixpk= 28, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 241, 242,
 &end
#
#   15 ASN  HA           15 ASN  HN          3.50    (#     29:10  Unique         2.85, 2.93 A)
 &rst
  ixpk= 29, nxpk= 10, iat= 239, 237, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   14 LEU  HA           15 ASN  HN          2.80    (#     30:10  Unique         2.05, 2.37 A)
 &rst
  ixpk= 30, nxpk= 10, iat= 220, 237, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:31      15 ASN  HN          5.50    (#     31:10  Single Ambig)
 &rst
  ixpk= 31, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 279, 280, 279, 280,
 &end
#
#   16 GLU  HB+          16 GLU  HN          3.50    (#     32:10  Unique         2.28, 2.98 A)
 &rst
  ixpk= 32, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 255, 256,
 &end
#
#    0 AMB  10-2:33      16 GLU  HN          3.50    (#     33:10  Single Ambig)
 &rst
  ixpk= 33, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 258, 259, 255, 256,
 &end
#
#   16 GLU  HG+          16 GLU  HN          4.50    (#     34:10  Unique         2.08, 3.20 A)
 &rst
  ixpk= 34, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 258, 259,
 &end
#
#    0 AMB  10-2:35      16 GLU  HN          4.50    (#     35:10  Single Ambig)
 &rst
  ixpk= 35, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 253, 850, 851,
 &end
#
#   15 ASN  HA           16 GLU  HN          2.80    (#     36:10  Unique         1.85, 2.10 A)
 &rst
  ixpk= 36, nxpk= 10, iat= 239, 251, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:37      16 GLU  HN          5.50    (#     37:10  Single Ambig)
 &rst
  ixpk= 37, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 220, 826,
 &end
#
#   17 LYS  HN           16 GLU  HN          4.50    (#     38:10  Unique         3.03, 3.29 A)
 &rst
  ixpk= 38, nxpk= 10, iat= 266, 251, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   75 TYR  HA           75 TYR  HN          4.50    (#     39:10  Unique         2.80, 2.91 A)
 &rst
  ixpk= 39, nxpk= 10, iat=1230,1228, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:40      75 TYR  HN          3.50    (#     40:10  Single Ambig)
 &rst
  ixpk= 40, nxpk= 10, iat=  -1,1228, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1210,1293,
 &end
#
#    0 AMB  10-2:41      75 TYR  HN          5.50    (#     41:10  Single Ambig)
 &rst
  ixpk= 41, nxpk= 10, iat=  -1,1228, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1308,1309,1310,1290,1291,
 &end
#
#   77 LYS  HB-          75 TYR  HN          5.50    (#     42:10  Unique         2.89, 4.87 A)
 &rst
  ixpk= 42, nxpk= 10, iat=  -1,1228, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1265,1266,
 &end
#
#   79 MET  HB+          75 TYR  HN          7.00    (#     43:10  Unique         6.27, 7.11 A)
 &rst
  ixpk= 43, nxpk= 10, iat=  -1,1228, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1301,1302,
 &end
#
#   49 ARG  HA           50 GLY  HN          4.50    (#     44:10  Unique         3.47, 3.57 A)
 &rst
  ixpk= 44, nxpk= 10, iat= 826, 848, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   50 GLY  HA+          50 GLY  HN          4.50    (#     46:10  Unique         2.07, 2.68 A)
 &rst
  ixpk= 46, nxpk= 10, iat=  -1, 848, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 850, 851,
 &end
#
#    0 AMB  10-2:47      82 ALA  HN          3.50    (#     47:10  Single Ambig)
 &rst
  ixpk= 47, nxpk= 10, iat=  -1,1350, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1352, 173,
 &end
#
#   81 ILE  HA           82 ALA  HN          2.80    (#     48:10  Unique         1.95, 2.26 A)
 &rst
  ixpk= 48, nxpk= 10, iat=1333,1350, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   82 ALA  QB           82 ALA  HN          3.50    (#     49:10  Unique         2.74, 3.43 A)
 &rst
  ixpk= 49, nxpk= 10, iat=  -1,1350, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1354,1355,1356,
 &end
#
#   81 ILE  QG2          82 ALA  HN          3.50    (#     50:10  Unique         1.83, 2.94 A)
 &rst
  ixpk= 50, nxpk= 10, iat=  -1,1350, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1337,1338,1339,
 &end
#
#    0 AMB  10-2:51      82 ALA  HN          4.50    (#     51:10  Single Ambig)
 &rst
  ixpk= 51, nxpk= 10, iat=  -1,1350, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1344,1345,1346, 137, 138, 139,
 &end
#
#   10 TYR  HN           82 ALA  HN          4.50    (#     52:10  Unique         2.66, 2.87 A)
 &rst
  ixpk= 52, nxpk= 10, iat= 150,1350, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:53      27 LEU  HN          3.50    (#     53:10  Single Ambig)
 &rst
  ixpk= 53, nxpk= 10, iat=  -1, 455, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 464, 465, 466, 468, 469, 470,
 &end
#
#   27 LEU  HB-          27 LEU  HN          5.50    (#     54:10  Unique         2.22, 2.94 A)
 &rst
  ixpk= 54, nxpk= 10, iat=  -1, 455, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 459, 460,
 &end
#
#   27 LEU  HG           27 LEU  HN          3.50    (#     55:10  Unique         2.47, 2.66 A)
 &rst
  ixpk= 55, nxpk= 10, iat= 462, 455, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   27 LEU  HB+          27 LEU  HN          3.50    (#     56:10  Unique         2.22, 2.94 A)
 &rst
  ixpk= 56, nxpk= 10, iat=  -1, 455, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 459, 460,
 &end
#
#    0 AMB  10-2:57      27 LEU  HN          5.50    (#     57:10  Single Ambig)
 &rst
  ixpk= 57, nxpk= 10, iat=  -1, 455, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 402, 476,
 &end
#
#    0 AMB  10-2:58      27 LEU  HN          4.50    (#     58:10  Single Ambig)
 &rst
  ixpk= 58, nxpk= 10, iat=  -1, 455, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 457, 424,
 &end
#
#   26 SER  HA           27 LEU  HN          3.50    (#     59:10  Unique         3.56, 3.58 A)
 &rst
  ixpk= 59, nxpk= 10, iat= 446, 455, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   26 SER  HN           27 LEU  HN          3.50    (#     60:10  Unique         2.53, 2.77 A)
 &rst
  ixpk= 60, nxpk= 10, iat= 444, 455, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   19 LYS  HA           20 LYS  HN          3.50    (#     62:10  Unique         2.00, 2.36 A)
 &rst
  ixpk= 62, nxpk= 10, iat= 309, 329, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:63      20 LYS  HN          4.50    (#     63:10  Single Ambig)
 &rst
  ixpk= 63, nxpk= 10, iat=  -1, 329, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 311, 312, 333, 334,
 &end
#
#   19 LYS  HG-          20 LYS  HN          4.50    (#     64:10  Unique         2.20, 3.00 A)
 &rst
  ixpk= 64, nxpk= 10, iat=  -1, 329, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 314, 315,
 &end
#
#   20 LYS  HB+          20 LYS  HN          5.50    (#     65:10  Unique         2.25, 2.55 A)
 &rst
  ixpk= 65, nxpk= 10, iat=  -1, 329, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 333, 334,
 &end
#
#   37 ILE  QD1          37 ILE  HN          5.50    (#     66:10  Unique         2.88, 4.17 A)
 &rst
  ixpk= 66, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 629, 630, 631,
 &end
#
#   37 ILE  HB           37 ILE  HN          3.50    (#     67:10  Unique         2.17, 2.35 A)
 &rst
  ixpk= 67, nxpk= 10, iat= 620, 616, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   36 GLN  HB+          37 ILE  HN          5.50    (#     68:10  Unique         4.15, 4.34 A)
 &rst
  ixpk= 68, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 603, 604,
 &end
#
#   36 GLN  HG-          37 ILE  HN          4.50    (#     69:10  Unique         3.46, 4.28 A)
 &rst
  ixpk= 69, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 606, 607,
 &end
#
#   37 ILE  HA           37 ILE  HN          4.50    (#     71:10  Unique         2.56, 2.83 A)
 &rst
  ixpk= 71, nxpk= 10, iat= 618, 616, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   36 GLN  HN           37 ILE  HN          4.50    (#     72:10  Unique         3.58, 4.14 A)
 &rst
  ixpk= 72, nxpk= 10, iat= 599, 616, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   36 GLN  HA           37 ILE  HN          2.80    (#     73:10  Unique         2.01, 2.08 A)
 &rst
  ixpk= 73, nxpk= 10, iat= 601, 616, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   36 GLN  HB-          37 ILE  HN          5.50    (#     74:10  Unique         4.15, 4.34 A)
 &rst
  ixpk= 74, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 603, 604,
 &end
#
#    0 AMB  10-2:76       0 AMB  10-1:76     5.50    (#     76:10  Double Ambig)
 &rst
  ixpk= 76, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 872, 131, 902,
 igr2= 171, 937,
 &end
#
#   56 PHE  QD           56 PHE  HN          3.50    (#     77:10  Unique         2.30, 3.90 A)
 &rst
  ixpk= 77, nxpk= 10, iat=  -1, 937, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 945, 953,
 &end
#
#   10 TYR  HA           11 ILE  HN          2.80    (#     78:10  Unique         2.00, 2.18 A)
 &rst
  ixpk= 78, nxpk= 10, iat= 152, 171, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   56 PHE  HA           56 PHE  HN          4.50    (#     79:10  Unique         2.80, 2.99 A)
 &rst
  ixpk= 79, nxpk= 10, iat= 939, 937, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   55 ILE  HA           56 PHE  HN          2.80    (#     80:10  Unique         2.16, 2.28 A)
 &rst
  ixpk= 80, nxpk= 10, iat= 920, 937, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   56 PHE  HB-          56 PHE  HN          3.50    (#     81:10  Unique         2.22, 3.12 A)
 &rst
  ixpk= 81, nxpk= 10, iat=  -1, 937, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 941, 942,
 &end
#
#   56 PHE  HB+          56 PHE  HN          3.50    (#     82:10  Unique         2.22, 3.12 A)
 &rst
  ixpk= 82, nxpk= 10, iat=  -1, 937, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 941, 942,
 &end
#
#   11 ILE  HB           11 ILE  HN          3.50    (#     83:10  Unique         2.23, 2.37 A)
 &rst
  ixpk= 83, nxpk= 10, iat= 175, 171, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:84      11 ILE  HN          3.50    (#     84:10  Single Ambig)
 &rst
  ixpk= 84, nxpk= 10, iat=  -1, 171, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 181, 182, 141, 142,
 &end
#
#    0 AMB  10-2:85       0 AMB  10-1:85     3.50    (#     85:10  Double Ambig)
 &rst
  ixpk= 85, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 181, 182, 924, 925, 926,
 igr2= 171, 937,
 &end
#
#   60 GLY  HA+          60 GLY  HN          4.50    (#     86:10  Unique         1.85, 2.58 A)
 &rst
  ixpk= 86, nxpk= 10, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1015,1016,
 &end
#
#   60 GLY  HA-          60 GLY  HN          3.50    (#     87:10  Unique         1.85, 2.58 A)
 &rst
  ixpk= 87, nxpk= 10, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1015,1016,
 &end
#
#    0 AMB  10-2:89      60 GLY  HN          4.50    (#     89:10  Single Ambig)
 &rst
  ixpk= 89, nxpk= 10, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 998,1035,1036,1037,
 &end
#
#   61 SER  HN           60 GLY  HN          4.50    (#     90:10  Unique         2.23, 2.58 A)
 &rst
  ixpk= 90, nxpk= 10, iat=1020,1013, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   58 GLU  HB+          60 GLY  HN          5.50    (#     91:10  Unique         2.35, 3.58 A)
 &rst
  ixpk= 91, nxpk= 10, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 983, 984,
 &end
#
#   27 LEU  HN           26 SER  HN          3.50    (#     92:10  Unique         2.53, 2.77 A)
 &rst
  ixpk= 92, nxpk= 10, iat= 455, 444, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:93      26 SER  HN          3.50    (#     93:10  Single Ambig)
 &rst
  ixpk= 93, nxpk= 10, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 426, 427, 426, 427,
 &end
#
#   26 SER  HA           26 SER  HN          3.50    (#     94:10  Unique         2.81, 2.84 A)
 &rst
  ixpk= 94, nxpk= 10, iat= 446, 444, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   23 LEU  QD1          26 SER  HN          5.50    (#     95:10  Unique         5.32, 6.40 A)
 &rst
  ixpk= 95, nxpk= 10, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 390, 391, 392,
 &end
#
#   25 LYS  HN           26 SER  HN          4.50    (#     96:10  Unique         2.78, 2.85 A)
 &rst
  ixpk= 96, nxpk= 10, iat= 422, 444, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:97      26 SER  HN          5.50    (#     97:10  Single Ambig)
 &rst
  ixpk= 97, nxpk= 10, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 424, 368, 457,
 &end
#
#   11 ILE  HA           12 ASN  HN          3.50    (#     98:10  Unique         2.16, 2.23 A)
 &rst
  ixpk= 98, nxpk= 10, iat= 173, 190, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   11 ILE  QG2          12 ASN  HN          5.50    (#     99:10  Unique         2.25, 3.54 A)
 &rst
  ixpk= 99, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 177, 178, 179,
 &end
#
#   11 ILE  HN           53 PHE  HN          5.50    (#    100:10  Unique         4.77, 5.02 A)
 &rst
  ixpk= 100, nxpk= 10, iat= 171, 882, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   53 PHE  QD           53 PHE  HN          3.50    (#    101:10  Unique         3.24, 4.10 A)
 &rst
  ixpk= 101, nxpk= 10, iat=  -1, 882, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 890, 898,
 &end
#
#   52 ALA  HA           53 PHE  HN          2.80    (#    102:10  Unique         2.01, 2.31 A)
 &rst
  ixpk= 102, nxpk= 10, iat= 874, 882, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:104     53 PHE  HN          3.50    (#    104:10  Single Ambig)
 &rst
  ixpk= 104, nxpk= 10, iat=  -1, 882, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 886, 887, 886, 887,
 &end
#
#   41 VAL  HB           53 PHE  HN          3.50    (#    105:10  Unique         2.85, 3.15 A)
 &rst
  ixpk= 105, nxpk= 10, iat= 689, 882, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   52 ALA  QB           53 PHE  HN          2.80    (#    106:10  Unique         2.56, 3.52 A)
 &rst
  ixpk= 106, nxpk= 10, iat=  -1, 882, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 876, 877, 878,
 &end
#
#   53 PHE  HA           53 PHE  HN          5.50    (#    107:10  Unique         2.91, 2.98 A)
 &rst
  ixpk= 107, nxpk= 10, iat= 884, 882, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   58 GLU  HA           59 ILE  HN          2.80    (#    109:10  Unique         2.22, 2.36 A)
 &rst
  ixpk= 109, nxpk= 10, iat= 981, 994, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   59 ILE  HA           59 ILE  HN          3.50    (#    110:10  Unique         2.81, 2.84 A)
 &rst
  ixpk= 110, nxpk= 10, iat= 996, 994, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:111     59 ILE  HN          3.50    (#    111:10  Single Ambig)
 &rst
  ixpk= 111, nxpk= 10, iat=  -1, 994, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 986, 987, 983, 984,
 &end
#
#    0 AMB  10-2:112     59 ILE  HN          5.50    (#    112:10  Single Ambig)
 &rst
  ixpk= 112, nxpk= 10, iat=  -1, 994, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 983, 984, 104, 105,
 &end
#
#   59 ILE  HG1+         59 ILE  HN          2.80    (#    113:10  Unique         1.67, 2.82 A)
 &rst
  ixpk= 113, nxpk= 10, iat=  -1, 994, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1004,1005,
 &end
#
#   59 ILE  HG1-         59 ILE  HN          3.50    (#    114:10  Unique         1.67, 2.82 A)
 &rst
  ixpk= 114, nxpk= 10, iat=  -1, 994, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1004,1005,
 &end
#
#    0 AMB  10-2:115     26 SER  HN          5.50    (#    115:10  Single Ambig)
 &rst
  ixpk= 115, nxpk= 10, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 448, 449, 448, 449,
 &end
#
#   19 LYS  HA           19 LYS  HN          3.50    (#    117:10  Unique         2.86, 2.89 A)
 &rst
  ixpk= 117, nxpk= 10, iat= 309, 307, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   18 ILE  HA           19 LYS  HN          2.80    (#    118:10  Unique         1.94, 2.17 A)
 &rst
  ixpk= 118, nxpk= 10, iat= 290, 307, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   19 LYS  HB+          19 LYS  HN          3.50    (#    119:10  Unique         2.36, 2.59 A)
 &rst
  ixpk= 119, nxpk= 10, iat=  -1, 307, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 311, 312,
 &end
#
#   19 LYS  HB-          19 LYS  HN          3.50    (#    120:10  Unique         2.36, 2.59 A)
 &rst
  ixpk= 120, nxpk= 10, iat=  -1, 307, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 311, 312,
 &end
#
#   19 LYS  HG+          19 LYS  HN          4.50    (#    121:10  Unique         2.35, 4.22 A)
 &rst
  ixpk= 121, nxpk= 10, iat=  -1, 307, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 314, 315,
 &end
#
#   18 ILE  HB           19 LYS  HN          7.00    (#    122:10  Unique         4.02, 4.31 A)
 &rst
  ixpk= 122, nxpk= 10, iat= 292, 307, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   18 ILE  QG2          19 LYS  HN          4.50    (#    123:10  Unique         3.00, 3.72 A)
 &rst
  ixpk= 123, nxpk= 10, iat=  -1, 307, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 294, 295, 296,
 &end
#
#   18 ILE  QD1          19 LYS  HN          5.50    (#    124:10  Unique         3.66, 4.86 A)
 &rst
  ixpk= 124, nxpk= 10, iat=  -1, 307, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 301, 302, 303,
 &end
#
#   40 ILE  HA           41 VAL  HN          3.50    (#    125:10  Unique         2.01, 2.28 A)
 &rst
  ixpk= 125, nxpk= 10, iat= 668, 685, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:126     41 VAL  HN          5.50    (#    126:10  Single Ambig)
 &rst
  ixpk= 126, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 687, 904,
 &end
#
#    0 AMB  10-2:127     41 VAL  HN          3.50    (#    127:10  Single Ambig)
 &rst
  ixpk= 127, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 689, 670, 676, 677, 676, 677,
 &end
#
#    0 AMB  10-2:128     41 VAL  HN          2.80    (#    128:10  Single Ambig)
 &rst
  ixpk= 128, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 691, 692, 693, 695, 696, 697, 672, 673, 674,
 &end
#
#    9 ILE  QD1           9 ILE  HN          4.50    (#    129:10  Unique         4.34, 4.88 A)
 &rst
  ixpk= 129, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 144, 145, 146,
 &end
#
#    9 ILE  QG2           9 ILE  HN          3.50    (#    130:10  Unique         2.50, 3.62 A)
 &rst
  ixpk= 130, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 137, 138, 139,
 &end
#
#    8 THR  QG2           9 ILE  HN          3.50    (#    131:10  Unique         2.43, 3.34 A)
 &rst
  ixpk= 131, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 123, 124, 125,
 &end
#
#    9 ILE  HG1-          9 ILE  HN          3.50    (#    132:10  Unique         2.32, 3.06 A)
 &rst
  ixpk= 132, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 141, 142,
 &end
#
#    9 ILE  HG1+          9 ILE  HN          3.50    (#    133:10  Unique         2.32, 3.06 A)
 &rst
  ixpk= 133, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 141, 142,
 &end
#
#    8 THR  HA            9 ILE  HN          2.80    (#    134:10  Unique         2.12, 2.26 A)
 &rst
  ixpk= 134, nxpk= 10, iat= 119, 131, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   56 PHE  QD            9 ILE  HN          5.50    (#    135:10  Unique         3.37, 5.92 A)
 &rst
  ixpk= 135, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 945, 953,
 &end
#
#   55 ILE  HA            9 ILE  HN          4.50    (#    136:10  Unique         3.55, 3.77 A)
 &rst
  ixpk= 136, nxpk= 10, iat= 920, 131, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:138      9 ILE  HN          5.50    (#    138:10  Single Ambig)
 &rst
  ixpk= 138, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 937, 171,
 &end
#
#   54 VAL  HB           54 VAL  HN          4.50    (#    139:10  Unique         3.32, 3.56 A)
 &rst
  ixpk= 139, nxpk= 10, iat= 906, 902, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:140     54 VAL  HN          3.50    (#    140:10  Single Ambig)
 &rst
  ixpk= 140, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 886, 887, 886, 887,
 &end
#
#   53 PHE  HA           54 VAL  HN          2.80    (#    141:10  Unique         2.09, 2.24 A)
 &rst
  ixpk= 141, nxpk= 10, iat= 884, 902, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   53 PHE  QD           54 VAL  HN          5.50    (#    142:10  Unique         3.54, 5.08 A)
 &rst
  ixpk= 142, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 890, 898,
 &end
#
#   54 VAL  QG-          54 VAL  HN          3.50    (#    143:10  Unique         2.45, 4.03 A)
 &rst
  ixpk= 143, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 908, 909, 910, 912, 913, 914,
 &end
#
#   54 VAL  HA           54 VAL  HN          5.50    (#    144:10  Unique         2.90, 2.94 A)
 &rst
  ixpk= 144, nxpk= 10, iat= 904, 902, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 ILE  HN           52 ALA  HN          3.50    (#    145:10  Unique         2.78, 3.08 A)
 &rst
  ixpk= 145, nxpk= 10, iat= 171, 872, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   51 GLN  HA           52 ALA  HN          2.80    (#    147:10  Unique         2.31, 2.48 A)
 &rst
  ixpk= 147, nxpk= 10, iat= 857, 872, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   52 ALA  HA           52 ALA  HN          4.50    (#    148:10  Unique         2.72, 2.91 A)
 &rst
  ixpk= 148, nxpk= 10, iat= 874, 872, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   12 ASN  HA           52 ALA  HN          4.50    (#    149:10  Unique         3.78, 4.01 A)
 &rst
  ixpk= 149, nxpk= 10, iat= 192, 872, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:150     52 ALA  HN          4.50    (#    150:10  Single Ambig)
 &rst
  ixpk= 150, nxpk= 10, iat=  -1, 872, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 862, 863, 859, 860, 859, 860,
 &end
#
#   48 MET  QE           52 ALA  HN          3.50    (#    151:10  Unique         3.36, 4.31 A)
 &rst
  ixpk= 151, nxpk= 10, iat=  -1, 872, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 818, 819, 820,
 &end
#
#   11 ILE  HB           52 ALA  HN          4.50    (#    153:10  Unique         2.56, 2.77 A)
 &rst
  ixpk= 153, nxpk= 10, iat= 175, 872, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   52 ALA  QB           52 ALA  HN          3.50    (#    154:10  Unique         2.41, 3.48 A)
 &rst
  ixpk= 154, nxpk= 10, iat=  -1, 872, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 876, 877, 878,
 &end
#
#    0 AMB  10-2:155     52 ALA  HN          3.50    (#    155:10  Single Ambig)
 &rst
  ixpk= 155, nxpk= 10, iat=  -1, 872, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   53 PHE  HN           42 ALA  HN          5.50    (#    156:10  Unique         4.99, 5.05 A)
 &rst
  ixpk= 156, nxpk= 10, iat= 882, 701, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   41 VAL  HA           42 ALA  HN          2.80    (#    158:10  Unique         2.00, 2.13 A)
 &rst
  ixpk= 158, nxpk= 10, iat= 687, 701, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   42 ALA  QB           42 ALA  HN          3.50    (#    159:10  Unique         2.65, 3.39 A)
 &rst
  ixpk= 159, nxpk= 10, iat=  -1, 701, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 705, 706, 707,
 &end
#
#    0 AMB  10-2:160     42 ALA  HN          3.50    (#    160:10  Single Ambig)
 &rst
  ixpk= 160, nxpk= 10, iat=  -1, 701, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 691, 692, 693, 695, 696, 697, 390, 391, 392,
 &end
#
#    0 AMB  10-2:161     42 ALA  HN          4.50    (#    161:10  Single Ambig)
 &rst
  ixpk= 161, nxpk= 10, iat=  -1, 701, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 691, 692, 693, 695, 696, 697, 672, 673, 674,
 &end
#
#    0 AMB  10-2:162     42 ALA  HN          5.50    (#    162:10  Single Ambig)
 &rst
  ixpk= 162, nxpk= 10, iat=  -1, 701, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 339, 340, 715, 716,
 &end
#
#    0 AMB  10-2:163     79 MET  HN          3.50    (#    163:10  Single Ambig)
 &rst
  ixpk= 163, nxpk= 10, iat=  -1,1297, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1293,1169,1170,
 &end
#
#   79 MET  HB+          79 MET  HN          5.50    (#    164:10  Unique         1.97, 2.96 A)
 &rst
  ixpk= 164, nxpk= 10, iat=  -1,1297, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1301,1302,
 &end
#
#   79 MET  HB-          79 MET  HN          5.50    (#    165:10  Unique         1.97, 2.96 A)
 &rst
  ixpk= 165, nxpk= 10, iat=  -1,1297, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1301,1302,
 &end
#
#   71 GLY  HA-          71 GLY  HN          3.50    (#    167:10  Unique         2.26, 2.59 A)
 &rst
  ixpk= 167, nxpk= 10, iat=  -1,1167, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1169,1170,
 &end
#
#   70 GLN  HA           71 GLY  HN          3.50    (#    168:10  Unique         1.97, 2.19 A)
 &rst
  ixpk= 168, nxpk= 10, iat=1152,1167, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   71 GLY  HA+          71 GLY  HN          3.50    (#    169:10  Unique         2.26, 2.59 A)
 &rst
  ixpk= 169, nxpk= 10, iat=  -1,1167, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1169,1170,
 &end
#
#    0 AMB  10-2:170     71 GLY  HN          4.50    (#    170:10  Single Ambig)
 &rst
  ixpk= 170, nxpk= 10, iat=  -1,1167, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1154,1155,1290,1291,
 &end
#
#   14 LEU  HN           13 ASN  HN          3.50    (#    171:10  Unique         2.25, 2.69 A)
 &rst
  ixpk= 171, nxpk= 10, iat= 218, 204, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   12 ASN  HA           13 ASN  HN          3.50    (#    172:10  Unique         2.45, 2.96 A)
 &rst
  ixpk= 172, nxpk= 10, iat= 192, 204, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   51 GLN  HA           13 ASN  HN          5.50    (#    174:10  Unique         3.84, 4.17 A)
 &rst
  ixpk= 174, nxpk= 10, iat= 857, 204, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   13 ASN  HA           13 ASN  HN          2.80    (#    175:10  Unique         2.21, 2.68 A)
 &rst
  ixpk= 175, nxpk= 10, iat= 206, 204, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   12 ASN  HB+          13 ASN  HN          4.50    (#    176:10  Unique         2.19, 3.98 A)
 &rst
  ixpk= 176, nxpk= 10, iat=  -1, 204, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 194, 195,
 &end
#
#    0 AMB  10-2:177     13 ASN  HN          4.50    (#    177:10  Single Ambig)
 &rst
  ixpk= 177, nxpk= 10, iat=  -1, 204, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 862, 863, 859, 860, 859, 860,1321,1322,
 &end
#
#   57 LYS  HN           58 GLU  HN          3.50    (#    178:10  Unique         2.64, 2.90 A)
 &rst
  ixpk= 178, nxpk= 10, iat= 957, 979, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   58 GLU  HA           58 GLU  HN          3.50    (#    180:10  Unique         2.76, 2.93 A)
 &rst
  ixpk= 180, nxpk= 10, iat= 981, 979, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   57 LYS  HA           58 GLU  HN          4.50    (#    181:10  Unique         3.38, 3.54 A)
 &rst
  ixpk= 181, nxpk= 10, iat= 959, 979, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   56 PHE  HB-          58 GLU  HN          3.50    (#    182:10  Unique         2.79, 3.11 A)
 &rst
  ixpk= 182, nxpk= 10, iat=  -1, 979, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 941, 942,
 &end
#
#   56 PHE  HB+          58 GLU  HN          4.50    (#    183:10  Unique         2.79, 3.11 A)
 &rst
  ixpk= 183, nxpk= 10, iat=  -1, 979, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 941, 942,
 &end
#
#    0 AMB  10-2:184     58 GLU  HN          2.80    (#    184:10  Single Ambig)
 &rst
  ixpk= 184, nxpk= 10, iat=  -1, 979, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 983, 984, 986, 987,
 &end
#
#    0 AMB  10-2:185     58 GLU  HN          2.80    (#    185:10  Single Ambig)
 &rst
  ixpk= 185, nxpk= 10, iat=  -1, 979, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 983, 984, 104, 105,
 &end
#
#   57 LYS  HB-          58 GLU  HN          4.50    (#    186:10  Unique         3.09, 4.09 A)
 &rst
  ixpk= 186, nxpk= 10, iat=  -1, 979, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 961, 962,
 &end
#
#    0 AMB  10-2:188     28 TYR  HN          5.50    (#    188:10  Single Ambig)
 &rst
  ixpk= 188, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 457, 424,
 &end
#
#   28 TYR  HB-          28 TYR  HN          4.50    (#    189:10  Unique         1.94, 2.73 A)
 &rst
  ixpk= 189, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 478, 479,
 &end
#
#   27 LEU  HB+          28 TYR  HN          5.50    (#    190:10  Unique         2.51, 2.97 A)
 &rst
  ixpk= 190, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 459, 460,
 &end
#
#    0 AMB  10-2:191     40 ILE  HN          2.80    (#    191:10  Single Ambig)
 &rst
  ixpk= 191, nxpk= 10, iat=  -1, 666, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 656, 668,
 &end
#
#   39 ASP  HB+          40 ILE  HN          5.50    (#    192:10  Unique         3.08, 3.71 A)
 &rst
  ixpk= 192, nxpk= 10, iat=  -1, 666, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 658, 659,
 &end
#
#   39 ASP  HB-          40 ILE  HN          4.50    (#    193:10  Unique         3.08, 3.71 A)
 &rst
  ixpk= 193, nxpk= 10, iat=  -1, 666, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 658, 659,
 &end
#
#    0 AMB  10-2:194     40 ILE  HN          3.50    (#    194:10  Single Ambig)
 &rst
  ixpk= 194, nxpk= 10, iat=  -1, 666, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 670, 676, 677, 676, 677,
 &end
#
#    0 AMB  10-2:195     40 ILE  HN          3.50    (#    195:10  Single Ambig)
 &rst
  ixpk= 195, nxpk= 10, iat=  -1, 666, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 691, 692, 693, 695, 696, 697, 672, 673, 674, 679,
       680, 681,
 &end
#
#    3 MET  HA            3 MET  HN          3.50    (#    197:10  Unique         2.07, 2.81 A)
 &rst
  ixpk= 197, nxpk= 10, iat=  38,  36, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   82 ALA  HA            3 MET  HN          7.00    (#    198:10  Unique         5.58, 6.69 A)
 &rst
  ixpk= 198, nxpk= 10, iat=1352,  36, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    2 GLU  HA            3 MET  HN          3.50    (#    199:10  Unique         2.18, 2.54 A)
 &rst
  ixpk= 199, nxpk= 10, iat=  23,  36, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:200      3 MET  HN          3.50    (#    200:10  Single Ambig)
 &rst
  ixpk= 200, nxpk= 10, iat=  -1,  36, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  40,  41,  40,  41,
 &end
#
#    7 GLN  HG-           7 GLN  HN          5.50    (#    201:10  Unique         2.67, 4.41 A)
 &rst
  ixpk= 201, nxpk= 10, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 107, 108,
 &end
#
#    0 AMB  10-2:202      7 GLN  HN          3.50    (#    202:10  Single Ambig)
 &rst
  ixpk= 202, nxpk= 10, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  90,  91,  90,  91,
 &end
#
#    7 GLN  HG+           7 GLN  HN          5.50    (#    203:10  Unique         2.67, 4.41 A)
 &rst
  ixpk= 203, nxpk= 10, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 107, 108,
 &end
#
#    7 GLN  HA            7 GLN  HN          4.50    (#    204:10  Unique         2.20, 2.80 A)
 &rst
  ixpk= 204, nxpk= 10, iat= 102, 100, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   22 GLU  HN           23 LEU  HN          3.50    (#    206:10  Unique         2.54, 2.62 A)
 &rst
  ixpk= 206, nxpk= 10, iat= 366, 381, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   22 GLU  HA           23 LEU  HN          5.50    (#    207:10  Unique         3.56, 3.58 A)
 &rst
  ixpk= 207, nxpk= 10, iat= 368, 381, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 LEU  HA           23 LEU  HN          3.50    (#    208:10  Unique         2.83, 2.85 A)
 &rst
  ixpk= 208, nxpk= 10, iat= 383, 381, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:209     23 LEU  HN          3.50    (#    209:10  Single Ambig)
 &rst
  ixpk= 209, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 331, 290,
 &end
#
#    0 AMB  10-2:210     23 LEU  HN          3.50    (#    210:10  Single Ambig)
 &rst
  ixpk= 210, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 370, 371, 311, 312,
 &end
#
#   23 LEU  HB+          23 LEU  HN          3.50    (#    211:10  Unique         1.86, 2.40 A)
 &rst
  ixpk= 211, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 385, 386,
 &end
#
#   23 LEU  HB-          23 LEU  HN          2.80    (#    212:10  Unique         1.86, 2.40 A)
 &rst
  ixpk= 212, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 385, 386,
 &end
#
#   18 ILE  QG2          23 LEU  HN          3.50    (#    213:10  Unique         2.58, 3.42 A)
 &rst
  ixpk= 213, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 294, 295, 296,
 &end
#
#    0 AMB  10-2:214     84 SER  HN          5.50    (#    214:10  Single Ambig)
 &rst
  ixpk= 214, nxpk= 10, iat=  -1,1381, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1368,1377, 892, 896,
 &end
#
#    9 ILE  HA           84 SER  HN          4.50    (#    215:10  Unique         2.18, 2.56 A)
 &rst
  ixpk= 215, nxpk= 10, iat= 133,1381, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   84 SER  HA           84 SER  HN          3.50    (#    217:10  Unique         2.80, 2.87 A)
 &rst
  ixpk= 217, nxpk= 10, iat=1383,1381, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   84 SER  HB+          84 SER  HN          3.50    (#    218:10  Unique         2.04, 3.06 A)
 &rst
  ixpk= 218, nxpk= 10, iat=  -1,1381, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1385,1386,
 &end
#
#   83 TYR  HB+          84 SER  HN          5.50    (#    219:10  Unique         2.62, 3.50 A)
 &rst
  ixpk= 219, nxpk= 10, iat=  -1,1381, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1364,1365,
 &end
#
#    0 AMB  10-2:220     84 SER  HN          4.50    (#    220:10  Single Ambig)
 &rst
  ixpk= 220, nxpk= 10, iat=  -1,1381, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1364,1365, 154, 155, 154, 155,
 &end
#
#    9 ILE  QG2          84 SER  HN          5.50    (#    221:10  Unique         3.61, 5.17 A)
 &rst
  ixpk= 221, nxpk= 10, iat=  -1,1381, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 137, 138, 139,
 &end
#
#  101 ARG  HA          103 LYS  HN          5.50    (#    228:10  Unique         3.36, 4.35 A)
 &rst
  ixpk= 228, nxpk= 10, iat=1648,1684, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  102 PRO  HA          103 LYS  HN          3.50    (#    229:10  Unique         2.17, 3.27 A)
 &rst
  ixpk= 229, nxpk= 10, iat=1680,1684, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  101 ARG  HB-         103 LYS  HN          4.50    (#    230:10  Unique         2.29, 4.03 A)
 &rst
  ixpk= 230, nxpk= 10, iat=  -1,1684, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1650,1651,
 &end
#
#    0 AMB  10-2:231     31 PHE  HN          5.50    (#    231:10  Single Ambig)
 &rst
  ixpk= 231, nxpk= 10, iat=  -1, 524, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 580, 588, 572, 592,
 &end
#
#   31 PHE  HB-          31 PHE  HN          3.50    (#    232:10  Unique         2.02, 2.95 A)
 &rst
  ixpk= 232, nxpk= 10, iat=  -1, 524, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 528, 529,
 &end
#
#   31 PHE  HB+          31 PHE  HN          3.50    (#    233:10  Unique         2.02, 2.95 A)
 &rst
  ixpk= 233, nxpk= 10, iat=  -1, 524, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 528, 529,
 &end
#
#   30 ILE  HB           31 PHE  HN          3.50    (#    234:10  Unique         2.35, 3.42 A)
 &rst
  ixpk= 234, nxpk= 10, iat= 509, 524, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   37 ILE  QD1          31 PHE  HN          4.50    (#    235:10  Unique         3.94, 5.01 A)
 &rst
  ixpk= 235, nxpk= 10, iat=  -1, 524, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 629, 630, 631,
 &end
#
#   31 PHE  QD           31 PHE  HN          5.50    (#    236:10  Unique         2.02, 3.92 A)
 &rst
  ixpk= 236, nxpk= 10, iat=  -1, 524, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 532, 540,
 &end
#
#   31 PHE  HA           31 PHE  HN          5.50    (#    237:10  Unique         2.80, 2.88 A)
 &rst
  ixpk= 237, nxpk= 10, iat= 526, 524, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   30 ILE  HG1-         31 PHE  HN          5.50    (#    238:10  Unique         2.14, 3.51 A)
 &rst
  ixpk= 238, nxpk= 10, iat=  -1, 524, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 515, 516,
 &end
#
#   30 ILE  HG1+         31 PHE  HN          5.50    (#    239:10  Unique         2.14, 3.51 A)
 &rst
  ixpk= 239, nxpk= 10, iat=  -1, 524, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 515, 516,
 &end
#
#    0 AMB  10-2:240     72 PHE  HN          3.50    (#    240:10  Single Ambig)
 &rst
  ixpk= 240, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1167,1297,
 &end
#
#   72 PHE  QD           72 PHE  HN          4.50    (#    241:10  Unique         3.43, 4.70 A)
 &rst
  ixpk= 241, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1182,1190,
 &end
#
#   72 PHE  HA           72 PHE  HN          3.50    (#    242:10  Unique         2.85, 2.87 A)
 &rst
  ixpk= 242, nxpk= 10, iat=1176,1174, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:243     72 PHE  HN          3.50    (#    243:10  Single Ambig)
 &rst
  ixpk= 243, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1169,1170,1293,
 &end
#
#    0 AMB  10-2:244     72 PHE  HN          3.50    (#    244:10  Single Ambig)
 &rst
  ixpk= 244, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1152,1204,
 &end
#
#    0 AMB  10-2:245     72 PHE  HN          3.50    (#    245:10  Single Ambig)
 &rst
  ixpk= 245, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1169,1170,1195,1196,
 &end
#
#   72 PHE  HB-          72 PHE  HN          2.80    (#    246:10  Unique         2.14, 2.50 A)
 &rst
  ixpk= 246, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1178,1179,
 &end
#
#   72 PHE  HB+          72 PHE  HN          2.80    (#    247:10  Unique         2.14, 2.50 A)
 &rst
  ixpk= 247, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1178,1179,
 &end
#
#   79 MET  HB+          72 PHE  HN          4.50    (#    248:10  Unique         2.15, 3.44 A)
 &rst
  ixpk= 248, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1301,1302,
 &end
#
#    0 AMB  10-2:249     72 PHE  HN          5.50    (#    249:10  Single Ambig)
 &rst
  ixpk= 249, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=1290,1291,1154,1155,1308,1309,1310,
 &end
#
#    0 AMB  10-2:250     17 LYS  HN          3.50    (#    250:10  Single Ambig)
 &rst
  ixpk= 250, nxpk= 10, iat=  -1, 266, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 251, 237,
 &end
#
#   83 TYR  QD           83 TYR  HN          3.50    (#    251:10  Unique         1.92, 3.28 A)
 &rst
  ixpk= 251, nxpk= 10, iat=  -1,1360, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1368,1377,
 &end
#
#   18 ILE  HN           17 LYS  HN          2.80    (#    252:10  Unique         1.79, 2.30 A)
 &rst
  ixpk= 252, nxpk= 10, iat= 288, 266, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   17 LYS  HA           17 LYS  HN          2.80    (#    253:10  Unique         2.79, 2.90 A)
 &rst
  ixpk= 253, nxpk= 10, iat= 268, 266, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   17 LYS  HB-          17 LYS  HN          3.50    (#    255:10  Unique         2.05, 3.35 A)
 &rst
  ixpk= 255, nxpk= 10, iat=  -1, 266, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 270, 271,
 &end
#
#    0 AMB  10-2:256      0 AMB  10-1:256    2.80    (#    256:10  Double Ambig)
 &rst
  ixpk= 256, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1=1354,1355,1356, 273, 274,
 igr2=1360, 266,
 &end
#
#   17 LYS  HG-          17 LYS  HN          3.50    (#    257:10  Unique         2.29, 3.30 A)
 &rst
  ixpk= 257, nxpk= 10, iat=  -1, 266, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 273, 274,
 &end
#
#    0 AMB  10-2:258     17 LYS  HN          4.50    (#    258:10  Single Ambig)
 &rst
  ixpk= 258, nxpk= 10, iat=  -1, 266, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 255, 256, 258, 259,
 &end
#
#    0 AMB  10-2:268      0 AMB  10-1:268    3.50    (#    268:10  Double Ambig)
 &rst
  ixpk= 268, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 154, 155, 154, 155, 241, 242,  43,  44,
 igr2=1360, 266,
 &end
#
#   83 TYR  HB+          83 TYR  HN          3.50    (#    269:10  Unique         2.64, 3.28 A)
 &rst
  ixpk= 269, nxpk= 10, iat=  -1,1360, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1364,1365,
 &end
#
#   66 LEU  MDX          83 TYR  HN          4.50    (#    270:10  Unique         2.81, 5.03 A)
 &rst
  ixpk= 270, nxpk= 10, iat=  -1,1360, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#   83 TYR  HA           83 TYR  HN          4.50    (#    271:10  Unique         2.87, 2.95 A)
 &rst
  ixpk= 271, nxpk= 10, iat=1362,1360, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   82 ALA  HA           83 TYR  HN          2.80    (#    272:10  Unique         2.54, 2.65 A)
 &rst
  ixpk= 272, nxpk= 10, iat=1352,1360, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   83 TYR  QD           83 TYR  HN          3.50    (#    273:10  Unique         1.92, 3.28 A)
 &rst
  ixpk= 273, nxpk= 10, iat=  -1,1360, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1368,1377,
 &end
#
#   17 LYS  HA           17 LYS  HN          3.50    (#    274:10  Unique         2.79, 2.90 A)
 &rst
  ixpk= 274, nxpk= 10, iat= 268, 266, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:275      0 AMB  10-1:275    3.50    (#    275:10  Double Ambig)
 &rst
  ixpk= 275, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 592, 422,
 igr2= 599, 400, 544,
 &end
#
#   35 GLY  HA+          36 GLN  HN          3.50    (#    277:10  Unique         2.18, 3.02 A)
 &rst
  ixpk= 277, nxpk= 10, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 594, 595,
 &end
#
#   36 GLN  HA            0 AMB  10-1:278    3.50    (#    278:10  Single Ambig)
 &rst
  ixpk= 278, nxpk= 10, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 599, 544,
 &end
#
#    0 AMB  10-2:279      0 AMB  10-1:279    2.80    (#    279:10  Double Ambig)
 &rst
  ixpk= 279, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 594, 595, 383,
 igr2= 599, 400,
 &end
#
#    0 AMB  10-2:280      0 AMB  10-1:280    3.50    (#    280:10  Double Ambig)
 &rst
  ixpk= 280, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 402, 476, 331,
 igr2= 400, 544,
 &end
#
#   36 GLN  HB-          36 GLN  HN          3.50    (#    281:10  Unique         2.24, 2.81 A)
 &rst
  ixpk= 281, nxpk= 10, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 603, 604,
 &end
#
#    0 AMB  10-2:282      0 AMB  10-1:282    2.80    (#    282:10  Double Ambig)
 &rst
  ixpk= 282, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 603, 604, 404, 405,
 igr2= 599, 400,
 &end
#
#    0 AMB  10-2:283      0 AMB  10-1:283    4.50    (#    283:10  Double Ambig)
 &rst
  ixpk= 283, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 572, 580, 588,
 igr2= 599, 544,
 &end
#
#   32 SER  HA            0 AMB  10-1:284    3.50    (#    284:10  Single Ambig)
 &rst
  ixpk= 284, nxpk= 10, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 544, 599,
 &end
#
#    0 AMB  10-2:285      0 AMB  10-1:285    3.50    (#    285:10  Double Ambig)
 &rst
  ixpk= 285, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 548, 549, 548, 549,
 igr2= 544, 599,
 &end
#
#   32 SER  HB-          32 SER  HN          3.50    (#    286:10  Unique         2.12, 3.07 A)
 &rst
  ixpk= 286, nxpk= 10, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 548, 549,
 &end
#
#   31 PHE  HB-          32 SER  HN          5.50    (#    287:10  Unique         1.87, 3.25 A)
 &rst
  ixpk= 287, nxpk= 10, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 528, 529,
 &end
#
#   31 PHE  HB+          32 SER  HN          5.50    (#    288:10  Unique         1.87, 3.25 A)
 &rst
  ixpk= 288, nxpk= 10, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 528, 529,
 &end
#
#    0 AMB  10-2:290     74 PHE  HN          5.50    (#    290:10  Single Ambig)
 &rst
  ixpk= 290, nxpk= 10, iat=  -1,1208, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1210,1293,
 &end
#
#   73 PRO  HA           74 PHE  HN          2.80    (#    291:10  Unique         2.29, 2.39 A)
 &rst
  ixpk= 291, nxpk= 10, iat=1204,1208, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   74 PHE  HB+          74 PHE  HN          3.50    (#    292:10  Unique         2.29, 2.54 A)
 &rst
  ixpk= 292, nxpk= 10, iat=  -1,1208, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1212,1213,
 &end
#
#   74 PHE  HB-          74 PHE  HN          3.50    (#    293:10  Unique         2.29, 2.54 A)
 &rst
  ixpk= 293, nxpk= 10, iat=  -1,1208, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1212,1213,
 &end
#
#    0 AMB  10-2:295     74 PHE  HN          5.50    (#    295:10  Single Ambig)
 &rst
  ixpk= 295, nxpk= 10, iat=  -1,1208, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1201,1202,1144,1145,1146,
 &end
#
#   64 ASN  HN           63 SER  HN          3.50    (#    296:10  Unique         2.68, 2.82 A)
 &rst
  ixpk= 296, nxpk= 10, iat=1052,1041, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 ALA  HN           63 SER  HN          3.50    (#    297:10  Unique         2.79, 2.87 A)
 &rst
  ixpk= 297, nxpk= 10, iat=1031,1041, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   63 SER  HA           63 SER  HN          3.50    (#    298:10  Unique         2.80, 2.82 A)
 &rst
  ixpk= 298, nxpk= 10, iat=1043,1041, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:299     63 SER  HN          2.80    (#    299:10  Single Ambig)
 &rst
  ixpk= 299, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1045,1046,1045,1046,
 &end
#
#   60 GLY  HA-          63 SER  HN          5.50    (#    300:10  Unique         3.33, 4.06 A)
 &rst
  ixpk= 300, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1015,1016,
 &end
#
#   62 ALA  QB           63 SER  HN          3.50    (#    301:10  Unique         2.33, 3.28 A)
 &rst
  ixpk= 301, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1035,1036,1037,
 &end
#
#    0 AMB  10-2:302     63 SER  HN          5.50    (#    302:10  Single Ambig)
 &rst
  ixpk= 302, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1022, 102,
 &end
#
#    0 AMB  10-2:304     55 ILE  HN          5.50    (#    304:10  Single Ambig)
 &rst
  ixpk= 304, nxpk= 10, iat=  -1, 918, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 685, 131, 882,
 &end
#
#   54 VAL  HA           55 ILE  HN          2.80    (#    305:10  Unique         1.84, 2.07 A)
 &rst
  ixpk= 305, nxpk= 10, iat= 904, 918, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   55 ILE  HB           55 ILE  HN          3.50    (#    306:10  Unique         2.20, 2.47 A)
 &rst
  ixpk= 306, nxpk= 10, iat= 922, 918, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:307     55 ILE  HN          3.50    (#    307:10  Single Ambig)
 &rst
  ixpk= 307, nxpk= 10, iat=  -1, 918, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 928, 929, 906,
 &end
#
#   55 ILE  QD1          55 ILE  HN          3.50    (#    308:10  Unique         2.41, 3.17 A)
 &rst
  ixpk= 308, nxpk= 10, iat=  -1, 918, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 931, 932, 933,
 &end
#
#   54 VAL  QG+          55 ILE  HN          3.50    (#    309:10  Unique         1.98, 4.15 A)
 &rst
  ixpk= 309, nxpk= 10, iat=  -1, 918, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 908, 909, 910, 912, 913, 914,
 &end
#
#   94 ILE  HA           95 LYS  HN          3.50    (#    313:10  Unique         3.47, 3.56 A)
 &rst
  ixpk= 313, nxpk= 10, iat=1529,1546, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   94 ILE  QD1          95 LYS  HN          5.50    (#    318:10  Unique         2.56, 4.98 A)
 &rst
  ixpk= 318, nxpk= 10, iat=  -1,1546, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1540,1541,1542,
 &end
#
#   76 ASP  HA           76 ASP  HN          2.80    (#    319:10  Unique         2.20, 2.71 A)
 &rst
  ixpk= 319, nxpk= 10, iat=1251,1249, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   75 TYR  HA           76 ASP  HN          3.50    (#    320:10  Unique         2.18, 2.81 A)
 &rst
  ixpk= 320, nxpk= 10, iat=1230,1249, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    3 MET  HA            4 LEU  HN          2.80    (#    322:10  Unique         2.19, 2.33 A)
 &rst
  ixpk= 322, nxpk= 10, iat=  38,  53, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:323      4 LEU  HN          3.50    (#    323:10  Single Ambig)
 &rst
  ixpk= 323, nxpk= 10, iat=  -1,  53, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  40,  41,  40,  41,
 &end
#
#    4 LEU  HB+           4 LEU  HN          2.80    (#    324:10  Unique         2.19, 3.05 A)
 &rst
  ixpk= 324, nxpk= 10, iat=  -1,  53, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=  57,  58,
 &end
#
#    0 AMB  10-2:325      4 LEU  HN          3.50    (#    325:10  Single Ambig)
 &rst
  ixpk= 325, nxpk= 10, iat=  -1,  53, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  62,  63,  64,  66,  67,  68,  62,  63,  64,  66,
        67,  68,
 &end
#
#  100 GLU  HB+         100 GLU  HN          5.50    (#    333:10  Unique         2.05, 3.01 A)
 &rst
  ixpk= 333, nxpk= 10, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1635,1636,
 &end
#
#  100 GLU  HB-         100 GLU  HN          3.50    (#    336:10  Unique         2.05, 3.01 A)
 &rst
  ixpk= 336, nxpk= 10, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1635,1636,
 &end
#
#   13 ASN  HN           14 LEU  HN          3.50    (#    337:10  Unique         2.25, 2.69 A)
 &rst
  ixpk= 337, nxpk= 10, iat= 204, 218, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   13 ASN  HA           14 LEU  HN          3.50    (#    338:10  Unique         2.44, 2.64 A)
 &rst
  ixpk= 338, nxpk= 10, iat= 206, 218, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   14 LEU  HA           14 LEU  HN          3.50    (#    339:10  Unique         2.85, 2.94 A)
 &rst
  ixpk= 339, nxpk= 10, iat= 220, 218, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   50 GLY  HA+          14 LEU  HN          5.50    (#    340:10  Unique         2.92, 3.83 A)
 &rst
  ixpk= 340, nxpk= 10, iat=  -1, 218, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 850, 851,
 &end
#
#   50 GLY  HA-          14 LEU  HN          5.50    (#    341:10  Unique         2.92, 3.83 A)
 &rst
  ixpk= 341, nxpk= 10, iat=  -1, 218, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 850, 851,
 &end
#
#   14 LEU  HB+          14 LEU  HN          2.80    (#    342:10  Unique         2.06, 2.64 A)
 &rst
  ixpk= 342, nxpk= 10, iat=  -1, 218, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 222, 223,
 &end
#
#   14 LEU  HB-          14 LEU  HN          3.50    (#    343:10  Unique         2.06, 2.64 A)
 &rst
  ixpk= 343, nxpk= 10, iat=  -1, 218, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 222, 223,
 &end
#
#   14 LEU  HG           14 LEU  HN          4.50    (#    344:10  Unique         3.03, 3.93 A)
 &rst
  ixpk= 344, nxpk= 10, iat= 225, 218, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:345     14 LEU  HN          4.50    (#    345:10  Single Ambig)
 &rst
  ixpk= 345, nxpk= 10, iat=  -1, 218, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   58 GLU  HN           57 LYS  HN          3.50    (#    347:10  Unique         2.64, 2.90 A)
 &rst
  ixpk= 347, nxpk= 10, iat= 979, 957, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   56 PHE  HA           57 LYS  HN          3.50    (#    348:10  Unique         2.12, 2.44 A)
 &rst
  ixpk= 348, nxpk= 10, iat= 939, 957, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   37 ILE  HA           57 LYS  HN          4.50    (#    349:10  Unique         3.22, 3.93 A)
 &rst
  ixpk= 349, nxpk= 10, iat= 618, 957, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   57 LYS  HA           57 LYS  HN          3.50    (#    350:10  Unique         2.55, 2.81 A)
 &rst
  ixpk= 350, nxpk= 10, iat= 959, 957, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   56 PHE  HB-          57 LYS  HN          3.50    (#    351:10  Unique         2.21, 3.00 A)
 &rst
  ixpk= 351, nxpk= 10, iat=  -1, 957, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 941, 942,
 &end
#
#   56 PHE  HB+          57 LYS  HN          4.50    (#    352:10  Unique         2.21, 3.00 A)
 &rst
  ixpk= 352, nxpk= 10, iat=  -1, 957, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 941, 942,
 &end
#
#   57 LYS  HB+          57 LYS  HN          3.50    (#    353:10  Unique         2.41, 3.08 A)
 &rst
  ixpk= 353, nxpk= 10, iat=  -1, 957, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 961, 962,
 &end
#
#   57 LYS  HB-          57 LYS  HN          3.50    (#    354:10  Unique         2.41, 3.08 A)
 &rst
  ixpk= 354, nxpk= 10, iat=  -1, 957, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 961, 962,
 &end
#
#    0 AMB  10-2:355     57 LYS  HN          5.50    (#    355:10  Single Ambig)
 &rst
  ixpk= 355, nxpk= 10, iat=  -1, 957, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 639, 640, 642,
 &end
#
#   64 ASN  HN           65 ALA  HN          2.80    (#    356:10  Unique         2.27, 2.74 A)
 &rst
  ixpk= 356, nxpk= 10, iat=1052,1066, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:357     65 ALA  HN          4.50    (#    357:10  Single Ambig)
 &rst
  ixpk= 357, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1033, 576, 577,
 &end
#
#    0 AMB  10-2:358     65 ALA  HN          3.50    (#    358:10  Single Ambig)
 &rst
  ixpk= 358, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1054, 574,
 &end
#
#    0 AMB  10-2:359     65 ALA  HN          2.80    (#    359:10  Single Ambig)
 &rst
  ixpk= 359, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1056,1057,1056,1057,
 &end
#
#   69 MET  HG-          65 ALA  HN          5.50    (#    360:10  Unique         5.16, 6.26 A)
 &rst
  ixpk= 360, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1140,1141,
 &end
#
#   65 ALA  QB           65 ALA  HN          2.80    (#    361:10  Unique         2.40, 2.90 A)
 &rst
  ixpk= 361, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1070,1071,1072,
 &end
#
#   66 LEU  HB-          65 ALA  HN          5.50    (#    362:10  Unique         4.64, 4.96 A)
 &rst
  ixpk= 362, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1080,1081,
 &end
#
#   67 ARG  HN           66 LEU  HN          3.50    (#    363:10  Unique         2.81, 2.96 A)
 &rst
  ixpk= 363, nxpk= 10, iat=1095,1076, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 LEU  HA           66 LEU  HN          3.50    (#    364:10  Unique         2.59, 2.78 A)
 &rst
  ixpk= 364, nxpk= 10, iat=1078,1076, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 LEU  HB+          66 LEU  HN          3.50    (#    365:10  Unique         2.03, 2.46 A)
 &rst
  ixpk= 365, nxpk= 10, iat=  -1,1076, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1080,1081,
 &end
#
#   66 LEU  HB-          66 LEU  HN          2.80    (#    366:10  Unique         2.03, 2.46 A)
 &rst
  ixpk= 366, nxpk= 10, iat=  -1,1076, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1080,1081,
 &end
#
#   65 ALA  QB           66 LEU  HN          3.50    (#    367:10  Unique         2.36, 3.26 A)
 &rst
  ixpk= 367, nxpk= 10, iat=  -1,1076, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1070,1071,1072,
 &end
#
#    9 ILE  QG2          66 LEU  HN          4.50    (#    368:10  Unique         2.84, 4.47 A)
 &rst
  ixpk= 368, nxpk= 10, iat=  -1,1076, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 137, 138, 139,
 &end
#
#   91 VAL  HN           92 ALA  HN          3.50    (#    370:10  Unique         2.81, 2.93 A)
 &rst
  ixpk= 370, nxpk= 10, iat=1479,1495, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 VAL  HA           92 ALA  HN          4.50    (#    373:10  Unique         3.59, 3.63 A)
 &rst
  ixpk= 373, nxpk= 10, iat=1481,1495, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   91 VAL  HB           92 ALA  HN          3.50    (#    374:10  Unique         2.46, 2.70 A)
 &rst
  ixpk= 374, nxpk= 10, iat=1483,1495, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 VAL  QG-          92 ALA  HN          3.50    (#    376:10  Unique         3.39, 4.59 A)
 &rst
  ixpk= 376, nxpk= 10, iat=  -1,1495, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1485,1486,1487,1489,1490,1491,
 &end
#
#   87 ASP  HA           88 SER  HN          4.50    (#    379:10  Unique         2.31, 3.37 A)
 &rst
  ixpk= 379, nxpk= 10, iat=1427,1437, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 TYR  HN           29 ALA  HN          3.50    (#    381:10  Unique         2.69, 2.76 A)
 &rst
  ixpk= 381, nxpk= 10, iat= 474, 495, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:382     29 ALA  HN          5.50    (#    382:10  Single Ambig)
 &rst
  ixpk= 382, nxpk= 10, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 532, 540, 422,
 &end
#
#   26 SER  HA           29 ALA  HN          5.50    (#    383:10  Unique         3.05, 3.37 A)
 &rst
  ixpk= 383, nxpk= 10, iat= 446, 495, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:384     29 ALA  HN          4.50    (#    384:10  Single Ambig)
 &rst
  ixpk= 384, nxpk= 10, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 424, 457,
 &end
#
#   28 TYR  HA           29 ALA  HN          4.50    (#    385:10  Unique         3.38, 3.56 A)
 &rst
  ixpk= 385, nxpk= 10, iat= 476, 495, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 TYR  HB+          29 ALA  HN          3.50    (#    386:10  Unique         2.66, 3.37 A)
 &rst
  ixpk= 386, nxpk= 10, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 478, 479,
 &end
#
#   29 ALA  QB           29 ALA  HN          2.80    (#    387:10  Unique         2.49, 2.92 A)
 &rst
  ixpk= 387, nxpk= 10, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 499, 500, 501,
 &end
#
#   40 ILE  QD1          29 ALA  HN          5.50    (#    388:10  Unique         5.70, 6.57 A)
 &rst
  ixpk= 388, nxpk= 10, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 679, 680, 681,
 &end
#
#   98 PHE  HA           99 LYS  HN          3.50    (#    389:10  Unique         3.02, 3.43 A)
 &rst
  ixpk= 389, nxpk= 10, iat=1591,1609, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   92 ALA  HN           93 LYS  HN          3.50    (#    398:10  Unique         2.48, 2.82 A)
 &rst
  ixpk= 398, nxpk= 10, iat=1495,1505, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   98 PHE  HA           98 PHE  HN          4.50    (#    407:10  Unique         2.16, 2.67 A)
 &rst
  ixpk= 407, nxpk= 10, iat=1591,1589, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   97 THR  HA           98 PHE  HN          5.50    (#    409:10  Unique         2.24, 3.04 A)
 &rst
  ixpk= 409, nxpk= 10, iat=1577,1589, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 PHE  HB+          98 PHE  HN          5.50    (#    411:10  Unique         2.01, 3.12 A)
 &rst
  ixpk= 411, nxpk= 10, iat=  -1,1589, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1593,1594,
 &end
#
#   70 GLN  HN           69 MET  HN          2.80    (#    412:10  Unique         2.47, 2.58 A)
 &rst
  ixpk= 412, nxpk= 10, iat=1150,1133, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   69 MET  HA           69 MET  HN          3.50    (#    413:10  Unique         2.79, 2.93 A)
 &rst
  ixpk= 413, nxpk= 10, iat=1135,1133, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:414     69 MET  HN          3.50    (#    414:10  Single Ambig)
 &rst
  ixpk= 414, nxpk= 10, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1121,1152,
 &end
#
#   68 THR  HB           69 MET  HN          3.50    (#    415:10  Unique         2.68, 2.81 A)
 &rst
  ixpk= 415, nxpk= 10, iat=1123,1133, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   69 MET  HG+          69 MET  HN          2.80    (#    416:10  Unique         2.06, 3.13 A)
 &rst
  ixpk= 416, nxpk= 10, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1140,1141,
 &end
#
#   69 MET  HB+          69 MET  HN          2.80    (#    417:10  Unique         2.25, 3.02 A)
 &rst
  ixpk= 417, nxpk= 10, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1137,1138,
 &end
#
#   81 ILE  QD1          69 MET  HN          5.50    (#    418:10  Unique         3.72, 4.64 A)
 &rst
  ixpk= 418, nxpk= 10, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1344,1345,1346,
 &end
#
#   68 THR  QG2          69 MET  HN          4.50    (#    419:10  Unique         3.92, 4.71 A)
 &rst
  ixpk= 419, nxpk= 10, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1125,1126,1127,
 &end
#
#  103 LYS  HA          104 LYS  HN          2.80    (#    421:10  Unique         2.19, 2.77 A)
 &rst
  ixpk= 421, nxpk= 10, iat=1686,1706, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  104 LYS  HA          104 LYS  HN          3.50    (#    422:10  Unique         2.28, 2.86 A)
 &rst
  ixpk= 422, nxpk= 10, iat=1708,1706, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  101 ARG  HB-         104 LYS  HN          4.50    (#    423:10  Unique         2.20, 4.53 A)
 &rst
  ixpk= 423, nxpk= 10, iat=  -1,1706, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1650,1651,
 &end
#
#   94 ILE  HA           94 ILE  HN          3.50    (#    428:10  Unique         2.80, 2.91 A)
 &rst
  ixpk= 428, nxpk= 10, iat=1529,1527, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 VAL  HA           94 ILE  HN          5.50    (#    429:10  Unique         3.35, 3.57 A)
 &rst
  ixpk= 429, nxpk= 10, iat=1481,1527, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 ILE  HG1+         94 ILE  HN          3.50    (#    432:10  Unique         2.08, 2.81 A)
 &rst
  ixpk= 432, nxpk= 10, iat=  -1,1527, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1537,1538,
 &end
#
#   50 GLY  HA+          51 GLN  HN          3.50    (#    435:10  Unique         2.59, 3.31 A)
 &rst
  ixpk= 435, nxpk= 10, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 850, 851,
 &end
#
#   50 GLY  HA-          51 GLN  HN          3.50    (#    436:10  Unique         2.59, 3.31 A)
 &rst
  ixpk= 436, nxpk= 10, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 850, 851,
 &end
#
#    0 AMB  10-2:437     51 GLN  HN          3.50    (#    437:10  Single Ambig)
 &rst
  ixpk= 437, nxpk= 10, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 859, 860, 859, 860, 862, 863,
 &end
#
#   48 MET  QE           51 GLN  HN          4.50    (#    438:10  Unique         3.84, 5.19 A)
 &rst
  ixpk= 438, nxpk= 10, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 818, 819, 820,
 &end
#
#    0 AMB  10-2:439     51 GLN  HN          4.50    (#    439:10  Single Ambig)
 &rst
  ixpk= 439, nxpk= 10, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 789, 790, 828, 829, 828, 829,
 &end
#
#    0 AMB  10-2:440     51 GLN  HN          5.50    (#    440:10  Single Ambig)
 &rst
  ixpk= 440, nxpk= 10, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 218, 711,
 &end
#
#   50 GLY  HN           51 GLN  HN          5.50    (#    441:10  Unique         2.01, 2.34 A)
 &rst
  ixpk= 441, nxpk= 10, iat= 848, 855, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:442     80 GLN  HN          5.50    (#    442:10  Single Ambig)
 &rst
  ixpk= 442, nxpk= 10, iat=  -1,1314, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 204,1167,1297,
 &end
#
#   80 GLN  HA           80 GLN  HN          3.50    (#    443:10  Unique         2.86, 2.95 A)
 &rst
  ixpk= 443, nxpk= 10, iat=1316,1314, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   79 MET  HA           80 GLN  HN          2.80    (#    444:10  Unique         2.22, 2.27 A)
 &rst
  ixpk= 444, nxpk= 10, iat=1299,1314, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:445     80 GLN  HN          5.50    (#    445:10  Single Ambig)
 &rst
  ixpk= 445, nxpk= 10, iat=  -1,1314, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 194, 195,1304,1305,
 &end
#
#    0 AMB  10-2:446     80 GLN  HN          3.50    (#    446:10  Single Ambig)
 &rst
  ixpk= 446, nxpk= 10, iat=  -1,1314, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1321,1322,1321,1322,
 &end
#
#   80 GLN  HB+          80 GLN  HN          3.50    (#    447:10  Unique         2.61, 3.26 A)
 &rst
  ixpk= 447, nxpk= 10, iat=  -1,1314, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1318,1319,
 &end
#
#    0 AMB  10-2:448     80 GLN  HN          2.80    (#    448:10  Single Ambig)
 &rst
  ixpk= 448, nxpk= 10, iat=  -1,1314, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1301,1302,1318,1319,
 &end
#
#   11 ILE  QG2          80 GLN  HN          3.50    (#    449:10  Unique         3.42, 4.51 A)
 &rst
  ixpk= 449, nxpk= 10, iat=  -1,1314, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 177, 178, 179,
 &end
#
#   91 VAL  HN           90 ILE  HN          3.50    (#    450:10  Unique         2.51, 2.66 A)
 &rst
  ixpk= 450, nxpk= 10, iat=1479,1460, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   89 ASP  HA           90 ILE  HN          3.50    (#    452:10  Unique         3.45, 3.60 A)
 &rst
  ixpk= 452, nxpk= 10, iat=1450,1460, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   88 SER  HB+          90 ILE  HN          5.50    (#    453:10  Unique         4.56, 5.67 A)
 &rst
  ixpk= 453, nxpk= 10, iat=  -1,1460, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1441,1442,
 &end
#
#   90 ILE  HG1-         90 ILE  HN          3.50    (#    457:10  Unique         2.05, 2.78 A)
 &rst
  ixpk= 457, nxpk= 10, iat=  -1,1460, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1470,1471,
 &end
#
#   90 ILE  HG1+         90 ILE  HN          3.50    (#    459:10  Unique         2.05, 2.78 A)
 &rst
  ixpk= 459, nxpk= 10, iat=  -1,1460, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1470,1471,
 &end
#
#   67 ARG  HN           64 ASN  HN          7.00    (#    460:10  Unique         4.69, 4.82 A)
 &rst
  ixpk= 460, nxpk= 10, iat=1095,1052, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   64 ASN  HD2+         64 ASN  HN          7.00    (#    461:10  Unique         4.69, 5.35 A)
 &rst
  ixpk= 461, nxpk= 10, iat=  -1,1052, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1061,1062,
 &end
#
#   65 ALA  HN           64 ASN  HN          2.80    (#    462:10  Unique         2.27, 2.74 A)
 &rst
  ixpk= 462, nxpk= 10, iat=1066,1052, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   63 SER  HN           64 ASN  HN          3.50    (#    463:10  Unique         2.68, 2.82 A)
 &rst
  ixpk= 463, nxpk= 10, iat=1041,1052, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   63 SER  HA           64 ASN  HN          3.50    (#    465:10  Unique         3.37, 3.56 A)
 &rst
  ixpk= 465, nxpk= 10, iat=1043,1052, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   64 ASN  HA           64 ASN  HN          3.50    (#    466:10  Unique         2.83, 2.86 A)
 &rst
  ixpk= 466, nxpk= 10, iat=1054,1052, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 SER  HA           64 ASN  HN          4.50    (#    467:10  Unique         2.70, 3.37 A)
 &rst
  ixpk= 467, nxpk= 10, iat=1022,1052, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:469     64 ASN  HN          2.80    (#    469:10  Single Ambig)
 &rst
  ixpk= 469, nxpk= 10, iat=  -1,1052, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1045,1046,1045,1046,
 &end
#
#   60 GLY  HA-          64 ASN  HN          5.50    (#    470:10  Unique         3.86, 4.49 A)
 &rst
  ixpk= 470, nxpk= 10, iat=  -1,1052, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1015,1016,
 &end
#
#    0 AMB  10-2:471     64 ASN  HN          2.80    (#    471:10  Single Ambig)
 &rst
  ixpk= 471, nxpk= 10, iat=  -1,1052, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1056,1057,1056,1057,
 &end
#
#   65 ALA  QB           64 ASN  HN          5.50    (#    472:10  Unique         4.46, 5.44 A)
 &rst
  ixpk= 472, nxpk= 10, iat=  -1,1052, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1070,1071,1072,
 &end
#
#    0 AMB  10-2:473     64 ASN  HN          5.50    (#    473:10  Single Ambig)
 &rst
  ixpk= 473, nxpk= 10, iat=  -1,1052, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1035,1036,1037, 998,
 &end
#
#   74 PHE  HN           77 LYS  HN          4.50    (#    474:10  Unique         2.87, 4.25 A)
 &rst
  ixpk= 474, nxpk= 10, iat=1208,1261, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   77 LYS  HA           77 LYS  HN          4.50    (#    475:10  Unique         2.85, 2.93 A)
 &rst
  ixpk= 475, nxpk= 10, iat=1263,1261, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:476     77 LYS  HN          5.50    (#    476:10  Single Ambig)
 &rst
  ixpk= 476, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1251,1204,
 &end
#
#   48 MET  HA           49 ARG  HN          3.50    (#    479:10  Unique         2.12, 3.36 A)
 &rst
  ixpk= 479, nxpk= 10, iat= 809, 824, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   49 ARG  HA           49 ARG  HN          3.50    (#    480:10  Unique         2.30, 2.88 A)
 &rst
  ixpk= 480, nxpk= 10, iat= 826, 824, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:481     49 ARG  HN          2.80    (#    481:10  Single Ambig)
 &rst
  ixpk= 481, nxpk= 10, iat=  -1, 824, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 828, 829, 828, 829,
 &end
#
#   49 ARG  HG+          49 ARG  HN          4.50    (#    482:10  Unique         2.70, 3.92 A)
 &rst
  ixpk= 482, nxpk= 10, iat=  -1, 824, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 831, 832,
 &end
#
#    0 AMB  10-2:483     49 ARG  HN          5.50    (#    483:10  Single Ambig)
 &rst
  ixpk= 483, nxpk= 10, iat=  -1, 824, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 773, 715, 716, 770, 771,
 &end
#
#   48 MET  HA           48 MET  HN          3.50    (#    485:10  Unique         2.80, 2.91 A)
 &rst
  ixpk= 485, nxpk= 10, iat= 809, 807, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:486     48 MET  HN          3.50    (#    486:10  Single Ambig)
 &rst
  ixpk= 486, nxpk= 10, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 787, 768,
 &end
#
#   48 MET  HG-          48 MET  HN          5.50    (#    487:10  Unique         2.16, 3.10 A)
 &rst
  ixpk= 487, nxpk= 10, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 814, 815,
 &end
#
#    0 AMB  10-2:488     48 MET  HN          3.50    (#    488:10  Single Ambig)
 &rst
  ixpk= 488, nxpk= 10, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 811, 812, 811, 812,
 &end
#
#    0 AMB  10-2:489     48 MET  HN          4.50    (#    489:10  Single Ambig)
 &rst
  ixpk= 489, nxpk= 10, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 715, 716, 718,
 &end
#
#    0 AMB  10-2:490     48 MET  HN          4.50    (#    490:10  Single Ambig)
 &rst
  ixpk= 490, nxpk= 10, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 859, 860, 859, 860, 862, 863,
 &end
#
#   33 GLN  HN           34 PHE  HN          3.50    (#    491:10  Unique         1.78, 2.63 A)
 &rst
  ixpk= 491, nxpk= 10, iat= 555, 572, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   34 PHE  HA           34 PHE  HN          4.50    (#    492:10  Unique         2.84, 2.97 A)
 &rst
  ixpk= 492, nxpk= 10, iat= 574, 572, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   34 PHE  HB+          34 PHE  HN          4.50    (#    493:10  Unique         2.26, 3.20 A)
 &rst
  ixpk= 493, nxpk= 10, iat=  -1, 572, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 576, 577,
 &end
#
#   34 PHE  HB-          34 PHE  HN          3.50    (#    494:10  Unique         2.26, 3.20 A)
 &rst
  ixpk= 494, nxpk= 10, iat=  -1, 572, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 576, 577,
 &end
#
#    0 AMB  10-2:495      0 AMB  10-1:495    5.50    (#    495:10  Double Ambig)
 &rst
  ixpk= 495, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 559, 560, 559, 560, 795, 796, 795, 796,
 igr2= 572, 807,
 &end
#
#    0 AMB  10-2:496     67 ARG  HN          3.50    (#    496:10  Single Ambig)
 &rst
  ixpk= 496, nxpk= 10, iat=  -1,1095, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1076,1066,
 &end
#
#   68 THR  HN           67 ARG  HN          3.50    (#    497:10  Unique         2.57, 2.82 A)
 &rst
  ixpk= 497, nxpk= 10, iat=1119,1095, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   64 ASN  HA           67 ARG  HN          5.50    (#    498:10  Unique         3.41, 3.64 A)
 &rst
  ixpk= 498, nxpk= 10, iat=1054,1095, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:499     67 ARG  HN          3.50    (#    499:10  Single Ambig)
 &rst
  ixpk= 499, nxpk= 10, iat=  -1,1095, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1097,1045,1046,
 &end
#
#   67 ARG  HB+          67 ARG  HN          2.80    (#    500:10  Unique         2.21, 2.69 A)
 &rst
  ixpk= 500, nxpk= 10, iat=  -1,1095, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1099,1100,
 &end
#
#   67 ARG  HB-          67 ARG  HN          2.80    (#    501:10  Unique         2.21, 2.69 A)
 &rst
  ixpk= 501, nxpk= 10, iat=  -1,1095, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1099,1100,
 &end
#
#   66 LEU  HB+          67 ARG  HN          3.50    (#    502:10  Unique         2.18, 2.90 A)
 &rst
  ixpk= 502, nxpk= 10, iat=  -1,1095, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1080,1081,
 &end
#
#   66 LEU  HB-          67 ARG  HN          4.50    (#    503:10  Unique         2.18, 2.90 A)
 &rst
  ixpk= 503, nxpk= 10, iat=  -1,1095, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1080,1081,
 &end
#
#   66 LEU  MDY          67 ARG  HN          5.50    (#    504:10  Unique         3.32, 4.81 A)
 &rst
  ixpk= 504, nxpk= 10, iat=  -1,1095, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#   36 GLN  HN           35 GLY  HN          5.50    (#    505:10  Unique         1.76, 2.90 A)
 &rst
  ixpk= 505, nxpk= 10, iat= 599, 592, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   35 GLY  HA+          35 GLY  HN          3.50    (#    506:10  Unique         2.59, 2.82 A)
 &rst
  ixpk= 506, nxpk= 10, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 594, 595,
 &end
#
#   34 PHE  HA           35 GLY  HN          3.50    (#    507:10  Unique         2.91, 3.33 A)
 &rst
  ixpk= 507, nxpk= 10, iat= 574, 592, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   35 GLY  HA-          35 GLY  HN          3.50    (#    508:10  Unique         2.59, 2.82 A)
 &rst
  ixpk= 508, nxpk= 10, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 594, 595,
 &end
#
#    0 AMB  10-2:509     25 LYS  HN          3.50    (#    509:10  Single Ambig)
 &rst
  ixpk= 509, nxpk= 10, iat=  -1, 422, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 424, 368,
 &end
#
#    0 AMB  10-2:510     25 LYS  HN          2.80    (#    510:10  Single Ambig)
 &rst
  ixpk= 510, nxpk= 10, iat=  -1, 422, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 426, 427, 426, 427,
 &end
#
#   24 LYS  HB-          25 LYS  HN          3.50    (#    511:10  Unique         2.43, 3.08 A)
 &rst
  ixpk= 511, nxpk= 10, iat=  -1, 422, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 404, 405,
 &end
#
#   25 LYS  HG-          25 LYS  HN          5.50    (#    513:10  Unique         2.45, 4.06 A)
 &rst
  ixpk= 513, nxpk= 10, iat=  -1, 422, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 429, 430,
 &end
#
#   26 SER  HN           25 LYS  HN          3.50    (#    514:10  Unique         2.78, 2.85 A)
 &rst
  ixpk= 514, nxpk= 10, iat= 444, 422, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   55 ILE  HN           39 ASP  HN          4.50    (#    515:10  Unique         2.83, 2.92 A)
 &rst
  ixpk= 515, nxpk= 10, iat= 918, 654, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   38 LEU  HN           39 ASP  HN          3.50    (#    516:10  Unique         1.90, 2.00 A)
 &rst
  ixpk= 516, nxpk= 10, iat= 635, 654, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   39 ASP  HA           39 ASP  HN          3.50    (#    517:10  Unique         2.88, 2.90 A)
 &rst
  ixpk= 517, nxpk= 10, iat= 656, 654, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   39 ASP  HB+          39 ASP  HN          5.50    (#    518:10  Unique         2.94, 3.25 A)
 &rst
  ixpk= 518, nxpk= 10, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 658, 659,
 &end
#
#   39 ASP  HB-          39 ASP  HN          5.50    (#    519:10  Unique         2.94, 3.25 A)
 &rst
  ixpk= 519, nxpk= 10, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 658, 659,
 &end
#
#   55 ILE  HB           39 ASP  HN          3.50    (#    520:10  Unique         2.31, 2.48 A)
 &rst
  ixpk= 520, nxpk= 10, iat= 922, 654, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   38 LEU  HB+          39 ASP  HN          3.50    (#    521:10  Unique         2.59, 3.41 A)
 &rst
  ixpk= 521, nxpk= 10, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 639, 640,
 &end
#
#    0 AMB  10-2:522     39 ASP  HN          3.50    (#    522:10  Single Ambig)
 &rst
  ixpk= 522, nxpk= 10, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 639, 640, 642,
 &end
#
#    0 AMB  10-2:523     39 ASP  HN          3.50    (#    523:10  Single Ambig)
 &rst
  ixpk= 523, nxpk= 10, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 644, 645, 646, 648, 649, 650, 931, 932, 933,
 &end
#
#   37 ILE  QG2          39 ASP  HN          3.50    (#    524:10  Unique         2.51, 3.35 A)
 &rst
  ixpk= 524, nxpk= 10, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 622, 623, 624,
 &end
#
#   90 ILE  HN           91 VAL  HN          3.50    (#    525:10  Unique         2.51, 2.66 A)
 &rst
  ixpk= 525, nxpk= 10, iat=1460,1479, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 VAL  HB           91 VAL  HN          3.50    (#    528:10  Unique         2.34, 2.45 A)
 &rst
  ixpk= 528, nxpk= 10, iat=1483,1479, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:531     33 GLN  HN          4.50    (#    531:10  Single Ambig)
 &rst
  ixpk= 531, nxpk= 10, iat=  -1, 555, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 572, 592,
 &end
#
#   31 PHE  HN           33 GLN  HN          5.50    (#    532:10  Unique         2.40, 4.21 A)
 &rst
  ixpk= 532, nxpk= 10, iat= 524, 555, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:534     33 GLN  HN          3.50    (#    534:10  Single Ambig)
 &rst
  ixpk= 534, nxpk= 10, iat=  -1, 555, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 557, 507,
 &end
#
#   37 ILE  HG1+         33 GLN  HN          5.50    (#    535:10  Unique         5.35, 6.35 A)
 &rst
  ixpk= 535, nxpk= 10, iat=  -1, 555, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 627,
 &end
#
#    0 AMB  10-2:536     33 GLN  HN          3.50    (#    536:10  Single Ambig)
 &rst
  ixpk= 536, nxpk= 10, iat=  -1, 555, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 559, 560, 559, 560,
 &end
#
#   69 MET  HN           70 GLN  HN          2.80    (#    538:10  Unique         2.47, 2.58 A)
 &rst
  ixpk= 538, nxpk= 10, iat=1133,1150, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:539     70 GLN  HN          3.50    (#    539:10  Single Ambig)
 &rst
  ixpk= 539, nxpk= 10, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1152,1121,
 &end
#
#   69 MET  HA           70 GLN  HN          5.50    (#    540:10  Unique         3.24, 3.47 A)
 &rst
  ixpk= 540, nxpk= 10, iat=1135,1150, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   70 GLN  HB+          70 GLN  HN          2.80    (#    542:10  Unique         2.06, 2.83 A)
 &rst
  ixpk= 542, nxpk= 10, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1154,1155,
 &end
#
#   70 GLN  HB-          70 GLN  HN          2.80    (#    543:10  Unique         2.06, 2.83 A)
 &rst
  ixpk= 543, nxpk= 10, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1154,1155,
 &end
#
#   70 GLN  HG-          70 GLN  HN          4.50    (#    544:10  Unique         2.12, 3.33 A)
 &rst
  ixpk= 544, nxpk= 10, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1157,1158,
 &end
#
#   81 ILE  QD1          70 GLN  HN          3.50    (#    545:10  Unique         2.80, 3.97 A)
 &rst
  ixpk= 545, nxpk= 10, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1344,1345,1346,
 &end
#
#    0 AMB  10-2:546     70 GLN  HN          4.50    (#    546:10  Single Ambig)
 &rst
  ixpk= 546, nxpk= 10, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1162,1163,1119,
 &end
#
#   23 LEU  HN           22 GLU  HN          2.80    (#    547:10  Unique         2.54, 2.62 A)
 &rst
  ixpk= 547, nxpk= 10, iat= 381, 366, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:548     22 GLU  HN          3.50    (#    548:10  Single Ambig)
 &rst
  ixpk= 548, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 368, 309,
 &end
#
#   22 GLU  HG+          22 GLU  HN          5.50    (#    549:10  Unique         1.89, 2.96 A)
 &rst
  ixpk= 549, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 373, 374,
 &end
#
#   22 GLU  HG-          22 GLU  HN          3.50    (#    550:10  Unique         1.89, 2.96 A)
 &rst
  ixpk= 550, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 373, 374,
 &end
#
#    0 AMB  10-2:551     22 GLU  HN          2.80    (#    551:10  Single Ambig)
 &rst
  ixpk= 551, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 311, 312, 370, 371, 355, 356,
 &end
#
#   19 LYS  HB-          22 GLU  HN          4.50    (#    552:10  Unique         2.04, 3.24 A)
 &rst
  ixpk= 552, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 311, 312,
 &end
#
#    0 AMB  10-2:553     22 GLU  HN          4.50    (#    553:10  Single Ambig)
 &rst
  ixpk= 553, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 314, 315, 407, 408,
 &end
#
#   18 ILE  QG2          22 GLU  HN          5.50    (#    554:10  Unique         4.15, 4.92 A)
 &rst
  ixpk= 554, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 294, 295, 296,
 &end
#
#   62 ALA  HN           61 SER  HN          2.80    (#    555:10  Unique         2.51, 2.61 A)
 &rst
  ixpk= 555, nxpk= 10, iat=1031,1020, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   60 GLY  HN           61 SER  HN          3.50    (#    556:10  Unique         2.23, 2.58 A)
 &rst
  ixpk= 556, nxpk= 10, iat=1013,1020, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 SER  HA           61 SER  HN          3.50    (#    558:10  Unique         2.83, 2.88 A)
 &rst
  ixpk= 558, nxpk= 10, iat=1022,1020, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   60 GLY  HA+          61 SER  HN          4.50    (#    559:10  Unique         2.51, 3.22 A)
 &rst
  ixpk= 559, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1015,1016,
 &end
#
#   60 GLY  HA-          61 SER  HN          2.80    (#    560:10  Unique         2.51, 3.22 A)
 &rst
  ixpk= 560, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1015,1016,
 &end
#
#   61 SER  HB+          61 SER  HN          2.80    (#    561:10  Unique         2.52, 3.10 A)
 &rst
  ixpk= 561, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1024,1025,
 &end
#
#    0 AMB  10-2:562     61 SER  HN          4.50    (#    562:10  Single Ambig)
 &rst
  ixpk= 562, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 996, 941, 942,
 &end
#
#   61 SER  HB-          61 SER  HN          3.50    (#    563:10  Unique         2.52, 3.10 A)
 &rst
  ixpk= 563, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1024,1025,
 &end
#
#    0 AMB  10-2:564     61 SER  HN          3.50    (#    564:10  Single Ambig)
 &rst
  ixpk= 564, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 983, 984, 986, 987,
 &end
#
#   58 GLU  HB-          61 SER  HN          3.50    (#    565:10  Unique         2.22, 3.24 A)
 &rst
  ixpk= 565, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 983, 984,
 &end
#
#    0 AMB  10-2:566     61 SER  HN          4.50    (#    566:10  Single Ambig)
 &rst
  ixpk= 566, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1035,1036,1037, 998, 967, 968, 967, 968,
 &end
#
#   83 TYR  HB+           6 ASN  HN          5.50    (#    569:10  Unique         3.84, 4.88 A)
 &rst
  ixpk= 569, nxpk= 10, iat=  -1,  86, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1364,1365,
 &end
#
#   61 SER  HN           62 ALA  HN          3.50    (#    571:10  Unique         2.51, 2.61 A)
 &rst
  ixpk= 571, nxpk= 10, iat=1020,1031, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   63 SER  HN           62 ALA  HN          3.50    (#    572:10  Unique         2.79, 2.87 A)
 &rst
  ixpk= 572, nxpk= 10, iat=1041,1031, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 SER  HB+          62 ALA  HN          3.50    (#    573:10  Unique         2.50, 3.20 A)
 &rst
  ixpk= 573, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1024,1025,
 &end
#
#   62 ALA  HA           62 ALA  HN          3.50    (#    574:10  Unique         2.82, 2.84 A)
 &rst
  ixpk= 574, nxpk= 10, iat=1033,1031, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 ALA  QB           62 ALA  HN          2.80    (#    575:10  Unique         2.41, 2.88 A)
 &rst
  ixpk= 575, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1035,1036,1037,
 &end
#
#   61 SER  HB-          62 ALA  HN          5.50    (#    576:10  Unique         2.50, 3.20 A)
 &rst
  ixpk= 576, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1024,1025,
 &end
#
#    7 GLN  HA           62 ALA  HN          5.50    (#    577:10  Unique         3.59, 4.47 A)
 &rst
  ixpk= 577, nxpk= 10, iat= 102,1031, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 LYS  HN           18 ILE  HN          3.50    (#    578:10  Unique         1.79, 2.30 A)
 &rst
  ixpk= 578, nxpk= 10, iat= 266, 288, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 LYS  HA           18 ILE  HN          3.50    (#    580:10  Unique         3.25, 3.36 A)
 &rst
  ixpk= 580, nxpk= 10, iat= 268, 288, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   18 ILE  HA           18 ILE  HN          3.50    (#    581:10  Unique         2.69, 2.86 A)
 &rst
  ixpk= 581, nxpk= 10, iat= 290, 288, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   23 LEU  HB+          18 ILE  HN          7.00    (#    582:10  Unique         5.75, 6.73 A)
 &rst
  ixpk= 582, nxpk= 10, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 385, 386,
 &end
#
#   18 ILE  HB           18 ILE  HN          3.50    (#    583:10  Unique         2.29, 2.44 A)
 &rst
  ixpk= 583, nxpk= 10, iat= 292, 288, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:584     18 ILE  HN          2.80    (#    584:10  Single Ambig)
 &rst
  ixpk= 584, nxpk= 10, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 298, 299, 298, 299,
 &end
#
#   18 ILE  QG2          18 ILE  HN          5.50    (#    585:10  Unique         4.31, 4.54 A)
 &rst
  ixpk= 585, nxpk= 10, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 294, 295, 296,
 &end
#
#   18 ILE  QD1          18 ILE  HN          3.50    (#    587:10  Unique         3.32, 4.18 A)
 &rst
  ixpk= 587, nxpk= 10, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 301, 302, 303,
 &end
#
#    0 AMB  10-2:589     47 LYS  HN          4.50    (#    589:10  Single Ambig)
 &rst
  ixpk= 589, nxpk= 10, iat=  -1, 785, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 787, 768,
 &end
#
#   47 LYS  HG-          47 LYS  HN          5.50    (#    591:10  Unique         2.00, 2.90 A)
 &rst
  ixpk= 591, nxpk= 10, iat=  -1, 785, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 792, 793,
 &end
#
#    0 AMB  10-2:592      0 AMB  10-1:592    3.50    (#    592:10  Double Ambig)
 &rst
  ixpk= 592, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 872, 131, 902,
 igr2= 171, 937,
 &end
#
#   11 ILE  HB           11 ILE  HN          3.50    (#    595:10  Unique         2.23, 2.37 A)
 &rst
  ixpk= 595, nxpk= 10, iat= 175, 171, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:596      0 AMB  10-1:596    3.50    (#    596:10  Double Ambig)
 &rst
  ixpk= 596, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 181, 182, 924, 925, 926,
 igr2= 171, 937,
 &end
#
#    8 THR  HA           56 PHE  HN          4.50    (#    597:10  Unique         2.95, 3.66 A)
 &rst
  ixpk= 597, nxpk= 10, iat= 119, 937, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    8 THR  HB            8 THR  HN          3.50    (#    603:10  Unique         2.54, 2.69 A)
 &rst
  ixpk= 603, nxpk= 10, iat= 121, 117, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    7 GLN  HG-           8 THR  HN          5.50    (#    604:10  Unique         3.62, 4.85 A)
 &rst
  ixpk= 604, nxpk= 10, iat=  -1, 117, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 107, 108,
 &end
#
#   67 ARG  HN           68 THR  HN          3.50    (#    606:10  Unique         2.57, 2.82 A)
 &rst
  ixpk= 606, nxpk= 10, iat=1095,1119, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   68 THR  HA           68 THR  HN          3.50    (#    608:10  Unique         2.80, 2.87 A)
 &rst
  ixpk= 608, nxpk= 10, iat=1121,1119, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   68 THR  HB           68 THR  HN          2.80    (#    609:10  Unique         2.53, 2.58 A)
 &rst
  ixpk= 609, nxpk= 10, iat=1123,1119, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   69 MET  HB+          68 THR  HN          5.50    (#    610:10  Unique         4.72, 5.59 A)
 &rst
  ixpk= 610, nxpk= 10, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1137,1138,
 &end
#
#   67 ARG  HB-          68 THR  HN          3.50    (#    611:10  Unique         1.98, 3.21 A)
 &rst
  ixpk= 611, nxpk= 10, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1099,1100,
 &end
#
#   68 THR  QG2          68 THR  HN          4.50    (#    612:10  Unique         4.41, 4.54 A)
 &rst
  ixpk= 612, nxpk= 10, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1125,1126,1127,
 &end
#
#    0 AMB  10-2:613     68 THR  HN          5.50    (#    613:10  Single Ambig)
 &rst
  ixpk= 613, nxpk= 10, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 576, 577,1056,1057,1056,1057,
 &end
#
#    0 AMB  10-2:614     68 THR  HN          4.50    (#    614:10  Single Ambig)
 &rst
  ixpk= 614, nxpk= 10, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1150,1061,1062,
 &end
#
#    0 AMB  10-2:615     68 THR  HN          5.50    (#    615:10  Single Ambig)
 &rst
  ixpk= 615, nxpk= 10, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1076,1066,
 &end
#
#    0 AMB  10-2:616     43 LEU  HN          3.50    (#    616:10  Single Ambig)
 &rst
  ixpk= 616, nxpk= 10, iat=  -1, 711, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 715, 716, 718,
 &end
#
#    0 AMB  10-2:617     43 LEU  HN          5.50    (#    617:10  Single Ambig)
 &rst
  ixpk= 617, nxpk= 10, iat=  -1, 711, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,
 &end
#
#   55 ILE  HA           55 ILE  HN          4.50    (#    619:10  Unique         2.85, 2.95 A)
 &rst
  ixpk= 619, nxpk= 10, iat= 920, 918, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   39 ASP  HN           55 ILE  HN          4.50    (#    620:10  Unique         2.83, 2.92 A)
 &rst
  ixpk= 620, nxpk= 10, iat= 654, 918, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   21 GLU  HN           22 GLU  HN          4.50    (#    621:10  Unique         2.73, 2.82 A)
 &rst
  ixpk= 621, nxpk= 10, iat= 351, 366, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   51 GLN  HA           51 GLN  HN          3.50    (#    622:10  Unique         2.80, 2.93 A)
 &rst
  ixpk= 622, nxpk= 10, iat= 857, 855, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   37 ILE  QD1          32 SER  HN          4.50    (#    623:10  Unique         2.51, 3.97 A)
 &rst
  ixpk= 623, nxpk= 10, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 629, 630, 631,
 &end
#
#    0 AMB  10-2:628      0 AMB  10-1:628    3.50    (#    628:10  Double Ambig)
 &rst
  ixpk= 628, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 208, 209,1284,1285,
 igr2= 213, 214, 213, 214,
 &end
#
#    0 AMB  10-2:629     13 ASN  HD2-        2.80    (#    629:10  Single Ambig)
 &rst
  ixpk= 629, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 208, 209,1284,1285,
 igr2= 213, 214,
 &end
#
#   13 ASN  HB-          13 ASN  HD2-        3.50    (#    630:10  Unique         2.00, 3.22 A)
 &rst
  ixpk= 630, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 208, 209,
 igr2= 213, 214,
 &end
#
#    0 AMB  10-2:631      0 AMB  10-1:631    4.50    (#    631:10  Double Ambig)
 &rst
  ixpk= 631, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1265,1266,1318,1319,
 igr2= 213, 214, 213, 214,
 &end
#
#   13 ASN  HB-          13 ASN  HD2+        3.50    (#    632:10  Unique         2.00, 3.22 A)
 &rst
  ixpk= 632, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 208, 209,
 igr2= 213, 214,
 &end
#
#    0 AMB  10-2:633     13 ASN  HD2-        4.50    (#    633:10  Single Ambig)
 &rst
  ixpk= 633, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1287,1288,1290,1291,
 igr2= 213, 214,
 &end
#
#    0 AMB  10-2:634      0 AMB  10-1:634    5.50    (#    634:10  Double Ambig)
 &rst
  ixpk= 634, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.25, r4=10.75,
 igr1=1287,1288,1290,1291,1308,1309,1310,
 igr2= 213, 214, 213, 214, 213, 214,
 &end
#
#    0 AMB  10-2:635      0 AMB  10-1:635    2.80    (#    635:10  Double Ambig)
 &rst
  ixpk= 635, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=  90,  91,  90,  91,
 igr2=  95,  96,  95,  96,
 &end
#
#    0 AMB  10-2:636      6 ASN  HD2-        3.50    (#    636:10  Single Ambig)
 &rst
  ixpk= 636, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=  90,  91,  90,  91,
 igr2=  95,  96,
 &end
#
#   15 ASN  HB+          15 ASN  HD2-        3.50    (#    649:10  Unique         2.15, 3.23 A)
 &rst
  ixpk= 649, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 241, 242,
 igr2= 246, 247,
 &end
#
#   15 ASN  HB-          15 ASN  HD2-        3.50    (#    650:10  Unique         2.15, 3.23 A)
 &rst
  ixpk= 650, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 241, 242,
 igr2= 246, 247,
 &end
#
#    0 AMB  10-2:651     15 ASN  HD2-        3.50    (#    651:10  Single Ambig)
 &rst
  ixpk= 651, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1232,1233, 279, 280, 279, 280,
 igr2= 246, 247,
 &end
#
#    0 AMB  10-2:652      0 AMB  10-1:652    4.50    (#    652:10  Double Ambig)
 &rst
  ixpk= 652, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 279, 280, 279, 280,
 igr2= 246, 247, 246, 247,
 &end
#
#   15 ASN  HB+          15 ASN  HD2+        4.50    (#    653:10  Unique         2.15, 3.23 A)
 &rst
  ixpk= 653, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 241, 242,
 igr2= 246, 247,
 &end
#
#    0 AMB  10-2:660      0 AMB  10-1:660    5.50    (#    660:10  Double Ambig)
 &rst
  ixpk= 660, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 574,1054,
 igr2=1061,1062,1061,1062,
 &end
#
#    0 AMB  10-2:661     64 ASN  HD2-        5.50    (#    661:10  Single Ambig)
 &rst
  ixpk= 661, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 574,1054,
 igr2=1061,1062,
 &end
#
#    0 AMB  10-2:662     64 ASN  HD2-        3.50    (#    662:10  Single Ambig)
 &rst
  ixpk= 662, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1056,1057,1056,1057, 576, 577,
 igr2=1061,1062,
 &end
#
#    0 AMB  10-2:663      0 AMB  10-1:663    2.80    (#    663:10  Double Ambig)
 &rst
  ixpk= 663, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1056,1057,1056,1057, 576, 577,
 igr2=1061,1062,1061,1062,1061,1062,
 &end
#
#    0 AMB  10-2:670     13 ASN  HD2-        3.50    (#    670:10  Single Ambig)
 &rst
  ixpk= 670, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1265,1266,1318,1319,
 igr2= 213, 214,
 &end
#
#   36 GLN  HG+          36 GLN  HE2+        3.50    (#    671:10  Unique         2.15, 3.33 A)
 &rst
  ixpk= 671, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 606, 607,
 igr2= 611, 612,
 &end
#
#   36 GLN  HG-          36 GLN  HE2+        5.50    (#    672:10  Unique         2.15, 3.33 A)
 &rst
  ixpk= 672, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 606, 607,
 igr2= 611, 612,
 &end
#
#   36 GLN  HG+          36 GLN  HE2-        5.50    (#    673:10  Unique         2.15, 3.33 A)
 &rst
  ixpk= 673, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 606, 607,
 igr2= 611, 612,
 &end
#
#    0 AMB  10-2:679     51 GLN  HE2-        3.50    (#    679:10  Single Ambig)
 &rst
  ixpk= 679, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 859, 860, 859, 860, 862, 863,
 igr2= 867, 868,
 &end
#
#    0 AMB  10-2:680      0 AMB  10-1:680    3.50    (#    680:10  Double Ambig)
 &rst
  ixpk= 680, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 859, 860, 859, 860, 862, 863,
 igr2= 867, 868, 867, 868, 867, 868,
 &end
#
#    0 AMB  10-2:687     80 GLN  HE2-        3.50    (#    687:10  Single Ambig)
 &rst
  ixpk= 687, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1321,1322,1321,1322,
 igr2=1326,1327,
 &end
#
#    0 AMB  10-2:688      0 AMB  10-1:688    3.50    (#    688:10  Double Ambig)
 &rst
  ixpk= 688, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1321,1322,1321,1322,
 igr2=1326,1327,1326,1327,
 &end
#
#   38 LEU  QD+           7 GLN  HE2-        3.50    (#    697:10  Unique         2.55, 4.83 A)
 &rst
  ixpk= 697, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 644, 645, 646, 648, 649, 650,
 igr2= 112, 113,
 &end
#
#    7 GLN  HG-           7 GLN  HE2-        5.50    (#    698:10  Unique         2.25, 3.13 A)
 &rst
  ixpk= 698, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 107, 108,
 igr2= 112, 113,
 &end
#
#    7 GLN  HG+           7 GLN  HE2-        3.50    (#    699:10  Unique         2.25, 3.13 A)
 &rst
  ixpk= 699, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 107, 108,
 igr2= 112, 113,
 &end
#
#   57 LYS  HA            7 GLN  HE2-        3.50    (#    700:10  Unique         2.64, 3.67 A)
 &rst
  ixpk= 700, nxpk= 10, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 112, 113,
 &end
#
#   57 LYS  HA            7 GLN  HE2+        3.50    (#    701:10  Unique         2.64, 3.67 A)
 &rst
  ixpk= 701, nxpk= 10, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 112, 113,
 &end
#
#   38 LEU  QD+           7 GLN  HE2+        3.50    (#    702:10  Unique         2.55, 4.83 A)
 &rst
  ixpk= 702, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 644, 645, 646, 648, 649, 650,
 igr2= 112, 113,
 &end
#
#    7 GLN  HG-           7 GLN  HE2+        3.50    (#    703:10  Unique         2.25, 3.13 A)
 &rst
  ixpk= 703, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 107, 108,
 igr2= 112, 113,
 &end
#
#    7 GLN  HG+           7 GLN  HE2+        3.50    (#    704:10  Unique         2.25, 3.13 A)
 &rst
  ixpk= 704, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 107, 108,
 igr2= 112, 113,
 &end
#
#   12 ASN  HB-          12 ASN  HD2-        3.50    (#    711:10  Unique         2.26, 3.41 A)
 &rst
  ixpk= 711, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 194, 195,
 igr2= 199, 200,
 &end
#
#   12 ASN  HB-          12 ASN  HD2+        3.50    (#    712:10  Unique         2.26, 3.41 A)
 &rst
  ixpk= 712, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 194, 195,
 igr2= 199, 200,
 &end
#
#   12 ASN  HB+          12 ASN  HD2+        3.50    (#    713:10  Unique         2.26, 3.41 A)
 &rst
  ixpk= 713, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 194, 195,
 igr2= 199, 200,
 &end
#
#   12 ASN  HB+          12 ASN  HD2-        5.50    (#    714:10  Unique         2.26, 3.41 A)
 &rst
  ixpk= 714, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 194, 195,
 igr2= 199, 200,
 &end
#
#    0 AMB  10-2:719     70 GLN  HE2-        3.50    (#    719:10  Single Ambig)
 &rst
  ixpk= 719, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1157,1158,  43,  44,
 igr2=1162,1163,
 &end
#
#   70 GLN  HB+          70 GLN  HE2-        3.50    (#    720:10  Unique         1.95, 3.97 A)
 &rst
  ixpk= 720, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1154,1155,
 igr2=1162,1163,
 &end
#
#   70 GLN  HB+          70 GLN  HE2+        5.50    (#    721:10  Unique         1.95, 3.97 A)
 &rst
  ixpk= 721, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1154,1155,
 igr2=1162,1163,
 &end
#
#    0 AMB  10-2:722      0 AMB  10-1:722    3.50    (#    722:10  Double Ambig)
 &rst
  ixpk= 722, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1157,1158,  43,  44,
 igr2=1162,1163,1162,1163,
 &end
#
#   70 GLN  HG-          70 GLN  HE2-        3.50    (#    723:10  Unique         2.26, 3.34 A)
 &rst
  ixpk= 723, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1157,1158,
 igr2=1162,1163,
 &end
#
#   70 GLN  HG-          70 GLN  HE2+        4.50    (#    724:10  Unique         2.26, 3.34 A)
 &rst
  ixpk= 724, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1157,1158,
 igr2=1162,1163,
 &end
#
#   81 ILE  HB           70 GLN  HE2-        3.50    (#    725:10  Unique         3.15, 3.97 A)
 &rst
  ixpk= 725, nxpk= 10, iat=1335,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1162,1163,
 &end
#
#    0 AMB  10-2:726      0 AMB  10-1:726    4.50    (#    726:10  Double Ambig)
 &rst
  ixpk= 726, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1335,1080,1081,
 igr2=1162,1163,1162,1163,
 &end
#
#   66 LEU  MDY          70 GLN  HE2+        5.50    (#    727:10  Unique         1.99, 4.95 A)
 &rst
  ixpk= 727, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1162,1163,
 &end
#
#   66 LEU  MDY          70 GLN  HE2-        4.50    (#    728:10  Unique         1.99, 4.95 A)
 &rst
  ixpk= 728, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1162,1163,
 &end
#
#   66 LEU  MDX          70 GLN  HE2-        5.50    (#    729:10  Unique         1.99, 4.95 A)
 &rst
  ixpk= 729, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1162,1163,
 &end
#
#   66 LEU  MDX          70 GLN  HE2+        5.50    (#    730:10  Unique         1.99, 4.95 A)
 &rst
  ixpk= 730, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1162,1163,
 &end
#
#   35 GLY  HA+          35 GLY  HN          4.50    (#    731:10  Unique         2.59, 2.82 A)
 &rst
  ixpk= 731, nxpk= 10, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 594, 595,
 &end
#
#   34 PHE  HA           35 GLY  HN          4.50    (#    732:10  Unique         2.91, 3.33 A)
 &rst
  ixpk= 732, nxpk= 10, iat= 574, 592, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:733     35 GLY  HN          5.50    (#    733:10  Single Ambig)
 &rst
  ixpk= 733, nxpk= 10, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 557, 618,
 &end
#
#   35 GLY  HA-          35 GLY  HN          4.50    (#    734:10  Unique         2.59, 2.82 A)
 &rst
  ixpk= 734, nxpk= 10, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 594, 595,
 &end
#
#   77 LYS  HN           74 PHE  HN          5.50    (#    735:10  Unique         2.87, 4.25 A)
 &rst
  ixpk= 735, nxpk= 10, iat=1261,1208, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:736     11 ILE  HN          5.50    (#    736:10  Single Ambig)
 &rst
  ixpk= 736, nxpk= 10, iat=  -1, 171, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 154, 155, 154, 155,
 &end
#
#   79 MET  HB-          81 ILE  HN          5.50    (#    737:10  Unique         4.79, 5.40 A)
 &rst
  ixpk= 737, nxpk= 10, iat=  -1,1331, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1301,1302,
 &end
#
#   70 GLN  HE2-         81 ILE  HN          5.50    (#    738:10  Unique         2.13, 3.52 A)
 &rst
  ixpk= 738, nxpk= 10, iat=  -1,1331, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1162,1163,
 &end
#
#   12 ASN  HB+          12 ASN  HN          5.50    (#    739:10  Unique         2.46, 3.24 A)
 &rst
  ixpk= 739, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 194, 195,
 &end
#
#   28 TYR  HN           27 LEU  HN          4.50    (#    740:10  Unique         2.74, 2.83 A)
 &rst
  ixpk= 740, nxpk= 10, iat= 474, 455, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   42 ALA  QB           52 ALA  HN          5.50    (#    741:10  Unique         5.54, 6.68 A)
 &rst
  ixpk= 741, nxpk= 10, iat=  -1, 872, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 705, 706, 707,
 &end
#
#    0 AMB  10-2:742     54 VAL  HN          4.50    (#    742:10  Single Ambig)
 &rst
  ixpk= 742, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 141, 142, 181, 182,
 &end
#
#    8 THR  QG2          54 VAL  HN          5.50    (#    743:10  Unique         2.76, 3.69 A)
 &rst
  ixpk= 743, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 123, 124, 125,
 &end
#
#   56 PHE  QD           57 LYS  HN          5.50    (#    744:10  Unique         3.19, 4.68 A)
 &rst
  ixpk= 744, nxpk= 10, iat=  -1, 957, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 945, 953,
 &end
#
#   72 PHE  HN           71 GLY  HN          5.50    (#    745:10  Unique         2.55, 2.86 A)
 &rst
  ixpk= 745, nxpk= 10, iat=1174,1167, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:748     77 LYS  HN          4.50    (#    748:10  Single Ambig)
 &rst
  ixpk= 748, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1268,1269,1268,1269,
 &end
#
#   77 LYS  HB+          77 LYS  HN          3.50    (#    749:10  Unique         2.60, 3.36 A)
 &rst
  ixpk= 749, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1265,1266,
 &end
#
#   24 LYS  HN           25 LYS  HN          5.50    (#    750:10  Unique         2.81, 2.87 A)
 &rst
  ixpk= 750, nxpk= 10, iat= 400, 422, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    7 GLN  HG+           6 ASN  HN          7.00    (#    751:10  Unique         6.22, 7.04 A)
 &rst
  ixpk= 751, nxpk= 10, iat=  -1,  86, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 107, 108,
 &end
#
#   33 GLN  HN           32 SER  HN          4.50    (#    752:10  Unique         2.58, 2.91 A)
 &rst
  ixpk= 752, nxpk= 10, iat= 555, 544, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 LYS  HG+          24 LYS  HN          4.50    (#    753:10  Unique         2.49, 3.84 A)
 &rst
  ixpk= 753, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 407, 408,
 &end
#
#    0 AMB  10-2:754     24 LYS  HN          4.50    (#    754:10  Single Ambig)
 &rst
  ixpk= 754, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 410, 411, 333, 334,
 &end
#
#    0 AMB  10-2:755      7 GLN  HN          5.50    (#    755:10  Single Ambig)
 &rst
  ixpk= 755, nxpk= 10, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1=1004,1005, 137, 138, 139,1007,1008,1009, 924, 925,
       926,
 &end
#
#    6 ASN  HA            7 GLN  HN          4.50    (#    756:10  Unique         2.12, 2.49 A)
 &rst
  ixpk= 756, nxpk= 10, iat=  88, 100, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   61 SER  HA           64 ASN  HD2-        5.50    (#    760:10  Unique         4.26, 5.30 A)
 &rst
  ixpk= 760, nxpk= 10, iat=1022,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1061,1062,
 &end
#
#   80 GLN  HB-          80 GLN  HE2+        4.50    (#    761:10  Unique         2.53, 4.40 A)
 &rst
  ixpk= 761, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1318,1319,
 igr2=1326,1327,
 &end
#
#   80 GLN  HB-          80 GLN  HE2-        5.50    (#    762:10  Unique         2.53, 4.40 A)
 &rst
  ixpk= 762, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1318,1319,
 igr2=1326,1327,
 &end
#
#    0 AMB  10-2:764      0 AMB  10-1:764    5.50    (#    764:10  Double Ambig)
 &rst
  ixpk= 764, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 603, 604, 811, 812, 811, 812,
 igr2= 611, 612, 867, 868, 867, 868,
 &end
#
#    0 AMB  10-2:765     76 ASP  HN          5.50    (#    765:10  Single Ambig)
 &rst
  ixpk= 765, nxpk= 10, iat=  -1,1249, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 279, 280, 279, 280,
 &end
#
#   77 LYS  HN           76 ASP  HN          5.50    (#    766:10  Unique         2.83, 3.18 A)
 &rst
  ixpk= 766, nxpk= 10, iat=1261,1249, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 GLN  HN           52 ALA  HN          5.50    (#    767:10  Unique         4.30, 4.37 A)
 &rst
  ixpk= 767, nxpk= 10, iat= 855, 872, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:769     28 TYR  HN          5.50    (#    769:10  Single Ambig)
 &rst
  ixpk= 769, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 476, 402,
 &end
#
#    0 AMB  10-2:771     62 ALA  HN          5.50    (#    771:10  Single Ambig)
 &rst
  ixpk= 771, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 941, 942, 996,
 &end
#
#    0 AMB  10-2:772      8 THR  HN          5.50    (#    772:10  Single Ambig)
 &rst
  ixpk= 772, nxpk= 10, iat=  -1, 117, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  90,  91,  90,  91,
 &end
#
#    6 ASN  HA            6 ASN  HN          5.50    (#    773:10  Unique         2.63, 2.88 A)
 &rst
  ixpk= 773, nxpk= 10, iat=  88,  86, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   12 ASN  HB-          13 ASN  HN          5.50    (#    774:10  Unique         2.19, 3.98 A)
 &rst
  ixpk= 774, nxpk= 10, iat=  -1, 204, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 194, 195,
 &end
#
#  chirality for residue 1 atoms:  CA CG HB2 HB3
 &rst iat=5,10,8,9, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 100., rk3=100.,  &end
#
#  chirality for residue 1 atoms:  CB SD HG2 HG3
 &rst iat=7,13,11,12, &end
#
#  chirality for residue 1 atoms:  N C HA CB
 &rst iat=1,18,6,7, &end
#
#  chirality for residue 2 atoms:  CA CG HB2 HB3
 &rst iat=22,27,25,26, &end
#
#  chirality for residue 2 atoms:  CB CD HG2 HG3
 &rst iat=24,30,28,29, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=20,33,23,24, &end
#
#  chirality for residue 3 atoms:  CA CG HB2 HB3
 &rst iat=37,42,40,41, &end
#
#  chirality for residue 3 atoms:  CB SD HG2 HG3
 &rst iat=39,45,43,44, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=35,50,38,39, &end
#
#  chirality for residue 4 atoms:  CA CG HB2 HB3
 &rst iat=54,59,57,58, &end
#
#  chirality for residue 4 atoms:  CB CD1 CD2 HG
 &rst iat=56,61,65,60, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=52,69,55,56, &end
#
#  chirality for residue 5 atoms:  CA CG HB2 HB3
 &rst iat=81,75,79,80, &end
#
#  chirality for residue 5 atoms:  CB CD HG2 HG3
 &rst iat=78,72,76,77, &end
#
#  chirality for residue 5 atoms:  CG N HD2 HD3
 &rst iat=75,71,73,74, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=71,83,82,78, &end
#
#  chirality for residue 6 atoms:  CA CG HB2 HB3
 &rst iat=87,92,90,91, &end
#
#  chirality for residue 6 atoms:  N C HA CB
 &rst iat=85,97,88,89, &end
#
#  chirality for residue 7 atoms:  CA CG HB2 HB3
 &rst iat=101,106,104,105, &end
#
#  chirality for residue 7 atoms:  CB CD HG2 HG3
 &rst iat=103,109,107,108, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=99,114,102,103, &end
#
#  chirality for residue 8 atoms:  CA CG2 OG1 HB
 &rst iat=118,122,126,121, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=116,128,119,120, &end
#
#  chirality for residue 9 atoms:  CA CG2 CG1 HB
 &rst iat=132,136,140,135, &end
#
#  chirality for residue 9 atoms:  CB CD1 HG12 HG13
 &rst iat=134,143,141,142, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=130,147,133,134, &end
#
#  chirality for residue 10 atoms:  CA CG HB2 HB3
 &rst iat=151,156,154,155, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=149,168,152,153, &end
#
#  chirality for residue 11 atoms:  CA CG2 CG1 HB
 &rst iat=172,176,180,175, &end
#
#  chirality for residue 11 atoms:  CB CD1 HG12 HG13
 &rst iat=174,183,181,182, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=170,187,173,174, &end
#
#  chirality for residue 12 atoms:  CA CG HB2 HB3
 &rst iat=191,196,194,195, &end
#
#  chirality for residue 12 atoms:  N C HA CB
 &rst iat=189,201,192,193, &end
#
#  chirality for residue 13 atoms:  CA CG HB2 HB3
 &rst iat=205,210,208,209, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=203,215,206,207, &end
#
#  chirality for residue 14 atoms:  CA CG HB2 HB3
 &rst iat=219,224,222,223, &end
#
#  chirality for residue 14 atoms:  CB CD1 CD2 HG
 &rst iat=221,226,230,225, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=217,234,220,221, &end
#
#  chirality for residue 15 atoms:  CA CG HB2 HB3
 &rst iat=238,243,241,242, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=236,248,239,240, &end
#
#  chirality for residue 16 atoms:  CA CG HB2 HB3
 &rst iat=252,257,255,256, &end
#
#  chirality for residue 16 atoms:  CB CD HG2 HG3
 &rst iat=254,260,258,259, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=250,263,253,254, &end
#
#  chirality for residue 17 atoms:  CA CG HB2 HB3
 &rst iat=267,272,270,271, &end
#
#  chirality for residue 17 atoms:  CB CD HG2 HG3
 &rst iat=269,275,273,274, &end
#
#  chirality for residue 17 atoms:  CD NZ HE2 HE3
 &rst iat=275,281,279,280, &end
#
#  chirality for residue 17 atoms:  CG CE HD2 HD3
 &rst iat=272,278,276,277, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=265,285,268,269, &end
#
#  chirality for residue 18 atoms:  CA CG2 CG1 HB
 &rst iat=289,293,297,292, &end
#
#  chirality for residue 18 atoms:  CB CD1 HG12 HG13
 &rst iat=291,300,298,299, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=287,304,290,291, &end
#
#  chirality for residue 19 atoms:  CA CG HB2 HB3
 &rst iat=308,313,311,312, &end
#
#  chirality for residue 19 atoms:  CB CD HG2 HG3
 &rst iat=310,316,314,315, &end
#
#  chirality for residue 19 atoms:  CD NZ HE2 HE3
 &rst iat=316,322,320,321, &end
#
#  chirality for residue 19 atoms:  CG CE HD2 HD3
 &rst iat=313,319,317,318, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=306,326,309,310, &end
#
#  chirality for residue 20 atoms:  CA CG HB2 HB3
 &rst iat=330,335,333,334, &end
#
#  chirality for residue 20 atoms:  CB CD HG2 HG3
 &rst iat=332,338,336,337, &end
#
#  chirality for residue 20 atoms:  CD NZ HE2 HE3
 &rst iat=338,344,342,343, &end
#
#  chirality for residue 20 atoms:  CG CE HD2 HD3
 &rst iat=335,341,339,340, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=328,348,331,332, &end
#
#  chirality for residue 21 atoms:  CA CG HB2 HB3
 &rst iat=352,357,355,356, &end
#
#  chirality for residue 21 atoms:  CB CD HG2 HG3
 &rst iat=354,360,358,359, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=350,363,353,354, &end
#
#  chirality for residue 22 atoms:  CA CG HB2 HB3
 &rst iat=367,372,370,371, &end
#
#  chirality for residue 22 atoms:  CB CD HG2 HG3
 &rst iat=369,375,373,374, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=365,378,368,369, &end
#
#  chirality for residue 23 atoms:  CA CG HB2 HB3
 &rst iat=382,387,385,386, &end
#
#  chirality for residue 23 atoms:  CB CD1 CD2 HG
 &rst iat=384,389,393,388, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=380,397,383,384, &end
#
#  chirality for residue 24 atoms:  CA CG HB2 HB3
 &rst iat=401,406,404,405, &end
#
#  chirality for residue 24 atoms:  CB CD HG2 HG3
 &rst iat=403,409,407,408, &end
#
#  chirality for residue 24 atoms:  CD NZ HE2 HE3
 &rst iat=409,415,413,414, &end
#
#  chirality for residue 24 atoms:  CG CE HD2 HD3
 &rst iat=406,412,410,411, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=399,419,402,403, &end
#
#  chirality for residue 25 atoms:  CA CG HB2 HB3
 &rst iat=423,428,426,427, &end
#
#  chirality for residue 25 atoms:  CB CD HG2 HG3
 &rst iat=425,431,429,430, &end
#
#  chirality for residue 25 atoms:  CD NZ HE2 HE3
 &rst iat=431,437,435,436, &end
#
#  chirality for residue 25 atoms:  CG CE HD2 HD3
 &rst iat=428,434,432,433, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=421,441,424,425, &end
#
#  chirality for residue 26 atoms:  CA OG HB2 HB3
 &rst iat=445,450,448,449, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=443,452,446,447, &end
#
#  chirality for residue 27 atoms:  CA CG HB2 HB3
 &rst iat=456,461,459,460, &end
#
#  chirality for residue 27 atoms:  CB CD1 CD2 HG
 &rst iat=458,463,467,462, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=454,471,457,458, &end
#
#  chirality for residue 28 atoms:  CA CG HB2 HB3
 &rst iat=475,480,478,479, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=473,492,476,477, &end
#
#  chirality for residue 29 atoms:  N C HA CB
 &rst iat=494,502,497,498, &end
#
#  chirality for residue 30 atoms:  CA CG2 CG1 HB
 &rst iat=506,510,514,509, &end
#
#  chirality for residue 30 atoms:  CB CD1 HG12 HG13
 &rst iat=508,517,515,516, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=504,521,507,508, &end
#
#  chirality for residue 31 atoms:  CA CG HB2 HB3
 &rst iat=525,530,528,529, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=523,541,526,527, &end
#
#  chirality for residue 32 atoms:  CA OG HB2 HB3
 &rst iat=545,550,548,549, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=543,552,546,547, &end
#
#  chirality for residue 33 atoms:  CA CG HB2 HB3
 &rst iat=556,561,559,560, &end
#
#  chirality for residue 33 atoms:  CB CD HG2 HG3
 &rst iat=558,564,562,563, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=554,569,557,558, &end
#
#  chirality for residue 34 atoms:  CA CG HB2 HB3
 &rst iat=573,578,576,577, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=571,589,574,575, &end
#
#  chirality for residue 35 atoms:  N C HA2 HA3
 &rst iat=591,596,594,595, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=600,605,603,604, &end
#
#  chirality for residue 36 atoms:  CB CD HG2 HG3
 &rst iat=602,608,606,607, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=598,613,601,602, &end
#
#  chirality for residue 37 atoms:  CA CG2 CG1 HB
 &rst iat=617,621,625,620, &end
#
#  chirality for residue 37 atoms:  CB CD1 HG12 HG13
 &rst iat=619,628,626,627, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=615,632,618,619, &end
#
#  chirality for residue 38 atoms:  CA CG HB2 HB3
 &rst iat=636,641,639,640, &end
#
#  chirality for residue 38 atoms:  CB CD1 CD2 HG
 &rst iat=638,643,647,642, &end
#
#  chirality for residue 38 atoms:  N C HA CB
 &rst iat=634,651,637,638, &end
#
#  chirality for residue 39 atoms:  CA CG HB2 HB3
 &rst iat=655,660,658,659, &end
#
#  chirality for residue 39 atoms:  N C HA CB
 &rst iat=653,663,656,657, &end
#
#  chirality for residue 40 atoms:  CA CG2 CG1 HB
 &rst iat=667,671,675,670, &end
#
#  chirality for residue 40 atoms:  CB CD1 HG12 HG13
 &rst iat=669,678,676,677, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=665,682,668,669, &end
#
#  chirality for residue 41 atoms:  CA CG1 CG2 HB
 &rst iat=686,690,694,689, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=684,698,687,688, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=700,708,703,704, &end
#
#  chirality for residue 43 atoms:  CA CG HB2 HB3
 &rst iat=712,717,715,716, &end
#
#  chirality for residue 43 atoms:  CB CD1 CD2 HG
 &rst iat=714,719,723,718, &end
#
#  chirality for residue 43 atoms:  N C HA CB
 &rst iat=710,727,713,714, &end
#
#  chirality for residue 44 atoms:  CA CG HB2 HB3
 &rst iat=731,736,734,735, &end
#
#  chirality for residue 44 atoms:  CB CD HG2 HG3
 &rst iat=733,739,737,738, &end
#
#  chirality for residue 44 atoms:  CD NZ HE2 HE3
 &rst iat=739,745,743,744, &end
#
#  chirality for residue 44 atoms:  CG CE HD2 HD3
 &rst iat=736,742,740,741, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=729,749,732,733, &end
#
#  chirality for residue 45 atoms:  CA CG2 OG1 HB
 &rst iat=753,757,761,756, &end
#
#  chirality for residue 45 atoms:  N C HA CB
 &rst iat=751,763,754,755, &end
#
#  chirality for residue 46 atoms:  CA CG HB2 HB3
 &rst iat=767,772,770,771, &end
#
#  chirality for residue 46 atoms:  CB CD1 CD2 HG
 &rst iat=769,774,778,773, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=765,782,768,769, &end
#
#  chirality for residue 47 atoms:  CA CG HB2 HB3
 &rst iat=786,791,789,790, &end
#
#  chirality for residue 47 atoms:  CB CD HG2 HG3
 &rst iat=788,794,792,793, &end
#
#  chirality for residue 47 atoms:  CD NZ HE2 HE3
 &rst iat=794,800,798,799, &end
#
#  chirality for residue 47 atoms:  CG CE HD2 HD3
 &rst iat=791,797,795,796, &end
#
#  chirality for residue 47 atoms:  N C HA CB
 &rst iat=784,804,787,788, &end
#
#  chirality for residue 48 atoms:  CA CG HB2 HB3
 &rst iat=808,813,811,812, &end
#
#  chirality for residue 48 atoms:  CB SD HG2 HG3
 &rst iat=810,816,814,815, &end
#
#  chirality for residue 48 atoms:  N C HA CB
 &rst iat=806,821,809,810, &end
#
#  chirality for residue 49 atoms:  CA CG HB2 HB3
 &rst iat=825,830,828,829, &end
#
#  chirality for residue 49 atoms:  CB CD HG2 HG3
 &rst iat=827,833,831,832, &end
#
#  chirality for residue 49 atoms:  CG NE HD2 HD3
 &rst iat=830,836,834,835, &end
#
#  chirality for residue 49 atoms:  N C HA CB
 &rst iat=823,845,826,827, &end
#
#  chirality for residue 50 atoms:  N C HA2 HA3
 &rst iat=847,852,850,851, &end
#
#  chirality for residue 51 atoms:  CA CG HB2 HB3
 &rst iat=856,861,859,860, &end
#
#  chirality for residue 51 atoms:  CB CD HG2 HG3
 &rst iat=858,864,862,863, &end
#
#  chirality for residue 51 atoms:  N C HA CB
 &rst iat=854,869,857,858, &end
#
#  chirality for residue 52 atoms:  N C HA CB
 &rst iat=871,879,874,875, &end
#
#  chirality for residue 53 atoms:  CA CG HB2 HB3
 &rst iat=883,888,886,887, &end
#
#  chirality for residue 53 atoms:  N C HA CB
 &rst iat=881,899,884,885, &end
#
#  chirality for residue 54 atoms:  CA CG1 CG2 HB
 &rst iat=903,907,911,906, &end
#
#  chirality for residue 54 atoms:  N C HA CB
 &rst iat=901,915,904,905, &end
#
#  chirality for residue 55 atoms:  CA CG2 CG1 HB
 &rst iat=919,923,927,922, &end
#
#  chirality for residue 55 atoms:  CB CD1 HG12 HG13
 &rst iat=921,930,928,929, &end
#
#  chirality for residue 55 atoms:  N C HA CB
 &rst iat=917,934,920,921, &end
#
#  chirality for residue 56 atoms:  CA CG HB2 HB3
 &rst iat=938,943,941,942, &end
#
#  chirality for residue 56 atoms:  N C HA CB
 &rst iat=936,954,939,940, &end
#
#  chirality for residue 57 atoms:  CA CG HB2 HB3
 &rst iat=958,963,961,962, &end
#
#  chirality for residue 57 atoms:  CB CD HG2 HG3
 &rst iat=960,966,964,965, &end
#
#  chirality for residue 57 atoms:  CD NZ HE2 HE3
 &rst iat=966,972,970,971, &end
#
#  chirality for residue 57 atoms:  CG CE HD2 HD3
 &rst iat=963,969,967,968, &end
#
#  chirality for residue 57 atoms:  N C HA CB
 &rst iat=956,976,959,960, &end
#
#  chirality for residue 58 atoms:  CA CG HB2 HB3
 &rst iat=980,985,983,984, &end
#
#  chirality for residue 58 atoms:  CB CD HG2 HG3
 &rst iat=982,988,986,987, &end
#
#  chirality for residue 58 atoms:  N C HA CB
 &rst iat=978,991,981,982, &end
#
#  chirality for residue 59 atoms:  CA CG2 CG1 HB
 &rst iat=995,999,1003,998, &end
#
#  chirality for residue 59 atoms:  CB CD1 HG12 HG13
 &rst iat=997,1006,1004,1005, &end
#
#  chirality for residue 59 atoms:  N C HA CB
 &rst iat=993,1010,996,997, &end
#
#  chirality for residue 60 atoms:  N C HA2 HA3
 &rst iat=1012,1017,1015,1016, &end
#
#  chirality for residue 61 atoms:  CA OG HB2 HB3
 &rst iat=1021,1026,1024,1025, &end
#
#  chirality for residue 61 atoms:  N C HA CB
 &rst iat=1019,1028,1022,1023, &end
#
#  chirality for residue 62 atoms:  N C HA CB
 &rst iat=1030,1038,1033,1034, &end
#
#  chirality for residue 63 atoms:  CA OG HB2 HB3
 &rst iat=1042,1047,1045,1046, &end
#
#  chirality for residue 63 atoms:  N C HA CB
 &rst iat=1040,1049,1043,1044, &end
#
#  chirality for residue 64 atoms:  CA CG HB2 HB3
 &rst iat=1053,1058,1056,1057, &end
#
#  chirality for residue 64 atoms:  N C HA CB
 &rst iat=1051,1063,1054,1055, &end
#
#  chirality for residue 65 atoms:  N C HA CB
 &rst iat=1065,1073,1068,1069, &end
#
#  chirality for residue 66 atoms:  CA CG HB2 HB3
 &rst iat=1077,1082,1080,1081, &end
#
#  chirality for residue 66 atoms:  CB CD1 CD2 HG
 &rst iat=1079,1084,1088,1083, &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=1075,1092,1078,1079, &end
#
#  chirality for residue 67 atoms:  CA CG HB2 HB3
 &rst iat=1096,1101,1099,1100, &end
#
#  chirality for residue 67 atoms:  CB CD HG2 HG3
 &rst iat=1098,1104,1102,1103, &end
#
#  chirality for residue 67 atoms:  CG NE HD2 HD3
 &rst iat=1101,1107,1105,1106, &end
#
#  chirality for residue 67 atoms:  N C HA CB
 &rst iat=1094,1116,1097,1098, &end
#
#  chirality for residue 68 atoms:  CA CG2 OG1 HB
 &rst iat=1120,1124,1128,1123, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=1118,1130,1121,1122, &end
#
#  chirality for residue 69 atoms:  CA CG HB2 HB3
 &rst iat=1134,1139,1137,1138, &end
#
#  chirality for residue 69 atoms:  CB SD HG2 HG3
 &rst iat=1136,1142,1140,1141, &end
#
#  chirality for residue 69 atoms:  N C HA CB
 &rst iat=1132,1147,1135,1136, &end
#
#  chirality for residue 70 atoms:  CA CG HB2 HB3
 &rst iat=1151,1156,1154,1155, &end
#
#  chirality for residue 70 atoms:  CB CD HG2 HG3
 &rst iat=1153,1159,1157,1158, &end
#
#  chirality for residue 70 atoms:  N C HA CB
 &rst iat=1149,1164,1152,1153, &end
#
#  chirality for residue 71 atoms:  N C HA2 HA3
 &rst iat=1166,1171,1169,1170, &end
#
#  chirality for residue 72 atoms:  CA CG HB2 HB3
 &rst iat=1175,1180,1178,1179, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=1173,1191,1176,1177, &end
#
#  chirality for residue 73 atoms:  CA CG HB2 HB3
 &rst iat=1203,1197,1201,1202, &end
#
#  chirality for residue 73 atoms:  CB CD HG2 HG3
 &rst iat=1200,1194,1198,1199, &end
#
#  chirality for residue 73 atoms:  CG N HD2 HD3
 &rst iat=1197,1193,1195,1196, &end
#
#  chirality for residue 73 atoms:  N C HA CB
 &rst iat=1193,1205,1204,1200, &end
#
#  chirality for residue 74 atoms:  CA CG HB2 HB3
 &rst iat=1209,1214,1212,1213, &end
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=1207,1225,1210,1211, &end
#
#  chirality for residue 75 atoms:  CA CG HB2 HB3
 &rst iat=1229,1234,1232,1233, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=1227,1246,1230,1231, &end
#
#  chirality for residue 76 atoms:  CA CG HB2 HB3
 &rst iat=1250,1255,1253,1254, &end
#
#  chirality for residue 76 atoms:  N C HA CB
 &rst iat=1248,1258,1251,1252, &end
#
#  chirality for residue 77 atoms:  CA CG HB2 HB3
 &rst iat=1262,1267,1265,1266, &end
#
#  chirality for residue 77 atoms:  CB CD HG2 HG3
 &rst iat=1264,1270,1268,1269, &end
#
#  chirality for residue 77 atoms:  CD NZ HE2 HE3
 &rst iat=1270,1276,1274,1275, &end
#
#  chirality for residue 77 atoms:  CG CE HD2 HD3
 &rst iat=1267,1273,1271,1272, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=1260,1280,1263,1264, &end
#
#  chirality for residue 78 atoms:  CA CG HB2 HB3
 &rst iat=1292,1286,1290,1291, &end
#
#  chirality for residue 78 atoms:  CB CD HG2 HG3
 &rst iat=1289,1283,1287,1288, &end
#
#  chirality for residue 78 atoms:  CG N HD2 HD3
 &rst iat=1286,1282,1284,1285, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=1282,1294,1293,1289, &end
#
#  chirality for residue 79 atoms:  CA CG HB2 HB3
 &rst iat=1298,1303,1301,1302, &end
#
#  chirality for residue 79 atoms:  CB SD HG2 HG3
 &rst iat=1300,1306,1304,1305, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=1296,1311,1299,1300, &end
#
#  chirality for residue 80 atoms:  CA CG HB2 HB3
 &rst iat=1315,1320,1318,1319, &end
#
#  chirality for residue 80 atoms:  CB CD HG2 HG3
 &rst iat=1317,1323,1321,1322, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=1313,1328,1316,1317, &end
#
#  chirality for residue 81 atoms:  CA CG2 CG1 HB
 &rst iat=1332,1336,1340,1335, &end
#
#  chirality for residue 81 atoms:  CB CD1 HG12 HG13
 &rst iat=1334,1343,1341,1342, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=1330,1347,1333,1334, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=1349,1357,1352,1353, &end
#
#  chirality for residue 83 atoms:  CA CG HB2 HB3
 &rst iat=1361,1366,1364,1365, &end
#
#  chirality for residue 83 atoms:  N C HA CB
 &rst iat=1359,1378,1362,1363, &end
#
#  chirality for residue 84 atoms:  CA OG HB2 HB3
 &rst iat=1382,1387,1385,1386, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=1380,1389,1383,1384, &end
#
#  chirality for residue 85 atoms:  CA CG HB2 HB3
 &rst iat=1393,1398,1396,1397, &end
#
#  chirality for residue 85 atoms:  CB CD HG2 HG3
 &rst iat=1395,1401,1399,1400, &end
#
#  chirality for residue 85 atoms:  CD NZ HE2 HE3
 &rst iat=1401,1407,1405,1406, &end
#
#  chirality for residue 85 atoms:  CG CE HD2 HD3
 &rst iat=1398,1404,1402,1403, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=1391,1411,1394,1395, &end
#
#  chirality for residue 86 atoms:  CA OG HB2 HB3
 &rst iat=1415,1420,1418,1419, &end
#
#  chirality for residue 86 atoms:  N C HA CB
 &rst iat=1413,1422,1416,1417, &end
#
#  chirality for residue 87 atoms:  CA CG HB2 HB3
 &rst iat=1426,1431,1429,1430, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=1424,1434,1427,1428, &end
#
#  chirality for residue 88 atoms:  CA OG HB2 HB3
 &rst iat=1438,1443,1441,1442, &end
#
#  chirality for residue 88 atoms:  N C HA CB
 &rst iat=1436,1445,1439,1440, &end
#
#  chirality for residue 89 atoms:  CA CG HB2 HB3
 &rst iat=1449,1454,1452,1453, &end
#
#  chirality for residue 89 atoms:  N C HA CB
 &rst iat=1447,1457,1450,1451, &end
#
#  chirality for residue 90 atoms:  CA CG2 CG1 HB
 &rst iat=1461,1465,1469,1464, &end
#
#  chirality for residue 90 atoms:  CB CD1 HG12 HG13
 &rst iat=1463,1472,1470,1471, &end
#
#  chirality for residue 90 atoms:  N C HA CB
 &rst iat=1459,1476,1462,1463, &end
#
#  chirality for residue 91 atoms:  CA CG1 CG2 HB
 &rst iat=1480,1484,1488,1483, &end
#
#  chirality for residue 91 atoms:  N C HA CB
 &rst iat=1478,1492,1481,1482, &end
#
#  chirality for residue 92 atoms:  N C HA CB
 &rst iat=1494,1502,1497,1498, &end
#
#  chirality for residue 93 atoms:  CA CG HB2 HB3
 &rst iat=1506,1511,1509,1510, &end
#
#  chirality for residue 93 atoms:  CB CD HG2 HG3
 &rst iat=1508,1514,1512,1513, &end
#
#  chirality for residue 93 atoms:  CD NZ HE2 HE3
 &rst iat=1514,1520,1518,1519, &end
#
#  chirality for residue 93 atoms:  CG CE HD2 HD3
 &rst iat=1511,1517,1515,1516, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=1504,1524,1507,1508, &end
#
#  chirality for residue 94 atoms:  CA CG2 CG1 HB
 &rst iat=1528,1532,1536,1531, &end
#
#  chirality for residue 94 atoms:  CB CD1 HG12 HG13
 &rst iat=1530,1539,1537,1538, &end
#
#  chirality for residue 94 atoms:  N C HA CB
 &rst iat=1526,1543,1529,1530, &end
#
#  chirality for residue 95 atoms:  CA CG HB2 HB3
 &rst iat=1547,1552,1550,1551, &end
#
#  chirality for residue 95 atoms:  CB CD HG2 HG3
 &rst iat=1549,1555,1553,1554, &end
#
#  chirality for residue 95 atoms:  CD NZ HE2 HE3
 &rst iat=1555,1561,1559,1560, &end
#
#  chirality for residue 95 atoms:  CG CE HD2 HD3
 &rst iat=1552,1558,1556,1557, &end
#
#  chirality for residue 95 atoms:  N C HA CB
 &rst iat=1545,1565,1548,1549, &end
#
#  chirality for residue 96 atoms:  N C HA2 HA3
 &rst iat=1567,1572,1570,1571, &end
#
#  chirality for residue 97 atoms:  CA CG2 OG1 HB
 &rst iat=1576,1580,1584,1579, &end
#
#  chirality for residue 97 atoms:  N C HA CB
 &rst iat=1574,1586,1577,1578, &end
#
#  chirality for residue 98 atoms:  CA CG HB2 HB3
 &rst iat=1590,1595,1593,1594, &end
#
#  chirality for residue 98 atoms:  N C HA CB
 &rst iat=1588,1606,1591,1592, &end
#
#  chirality for residue 99 atoms:  CA CG HB2 HB3
 &rst iat=1610,1615,1613,1614, &end
#
#  chirality for residue 99 atoms:  CB CD HG2 HG3
 &rst iat=1612,1618,1616,1617, &end
#
#  chirality for residue 99 atoms:  CD NZ HE2 HE3
 &rst iat=1618,1624,1622,1623, &end
#
#  chirality for residue 99 atoms:  CG CE HD2 HD3
 &rst iat=1615,1621,1619,1620, &end
#
#  chirality for residue 99 atoms:  N C HA CB
 &rst iat=1608,1628,1611,1612, &end
#
#  chirality for residue 100 atoms:  CA CG HB2 HB3
 &rst iat=1632,1637,1635,1636, &end
#
#  chirality for residue 100 atoms:  CB CD HG2 HG3
 &rst iat=1634,1640,1638,1639, &end
#
#  chirality for residue 100 atoms:  N C HA CB
 &rst iat=1630,1643,1633,1634, &end
#
#  chirality for residue 101 atoms:  CA CG HB2 HB3
 &rst iat=1647,1652,1650,1651, &end
#
#  chirality for residue 101 atoms:  CB CD HG2 HG3
 &rst iat=1649,1655,1653,1654, &end
#
#  chirality for residue 101 atoms:  CG NE HD2 HD3
 &rst iat=1652,1658,1656,1657, &end
#
#  chirality for residue 101 atoms:  N C HA CB
 &rst iat=1645,1667,1648,1649, &end
#
#  chirality for residue 102 atoms:  CA CG HB2 HB3
 &rst iat=1679,1673,1677,1678, &end
#
#  chirality for residue 102 atoms:  CB CD HG2 HG3
 &rst iat=1676,1670,1674,1675, &end
#
#  chirality for residue 102 atoms:  CG N HD2 HD3
 &rst iat=1673,1669,1671,1672, &end
#
#  chirality for residue 102 atoms:  N C HA CB
 &rst iat=1669,1681,1680,1676, &end
#
#  chirality for residue 103 atoms:  CA CG HB2 HB3
 &rst iat=1685,1690,1688,1689, &end
#
#  chirality for residue 103 atoms:  CB CD HG2 HG3
 &rst iat=1687,1693,1691,1692, &end
#
#  chirality for residue 103 atoms:  CD NZ HE2 HE3
 &rst iat=1693,1699,1697,1698, &end
#
#  chirality for residue 103 atoms:  CG CE HD2 HD3
 &rst iat=1690,1696,1694,1695, &end
#
#  chirality for residue 103 atoms:  N C HA CB
 &rst iat=1683,1703,1686,1687, &end
#
#  chirality for residue 104 atoms:  CA CG HB2 HB3
 &rst iat=1707,1712,1710,1711, &end
#
#  chirality for residue 104 atoms:  CB CD HG2 HG3
 &rst iat=1709,1715,1713,1714, &end
#
#  chirality for residue 104 atoms:  CD NZ HE2 HE3
 &rst iat=1715,1721,1719,1720, &end
#
#  chirality for residue 104 atoms:  CG CE HD2 HD3
 &rst iat=1712,1718,1716,1717, &end
#
#  chirality for residue 104 atoms:  N C HA CB
 &rst iat=1705,1725,1708,1709, &end
#
#  trans-omega constraint for residue 2
 &rst iat=22,20,18,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 150., rk3=150.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=37,35,33,22, &end
#
#  trans-omega constraint for residue 4
 &rst iat=54,52,50,37, &end
#
#  trans-omega constraint for residue 5
 &rst iat=81,71,69,54, &end
#
#  trans-omega constraint for residue 6
 &rst iat=87,85,83,81, &end
#
#  trans-omega constraint for residue 7
 &rst iat=101,99,97,87, &end
#
#  trans-omega constraint for residue 8
 &rst iat=118,116,114,101, &end
#
#  trans-omega constraint for residue 9
 &rst iat=132,130,128,118, &end
#
#  trans-omega constraint for residue 10
 &rst iat=151,149,147,132, &end
#
#  trans-omega constraint for residue 11
 &rst iat=172,170,168,151, &end
#
#  trans-omega constraint for residue 12
 &rst iat=191,189,187,172, &end
#
#  trans-omega constraint for residue 13
 &rst iat=205,203,201,191, &end
#
#  trans-omega constraint for residue 14
 &rst iat=219,217,215,205, &end
#
#  trans-omega constraint for residue 15
 &rst iat=238,236,234,219, &end
#
#  trans-omega constraint for residue 16
 &rst iat=252,250,248,238, &end
#
#  trans-omega constraint for residue 17
 &rst iat=267,265,263,252, &end
#
#  trans-omega constraint for residue 18
 &rst iat=289,287,285,267, &end
#
#  trans-omega constraint for residue 19
 &rst iat=308,306,304,289, &end
#
#  trans-omega constraint for residue 20
 &rst iat=330,328,326,308, &end
#
#  trans-omega constraint for residue 21
 &rst iat=352,350,348,330, &end
#
#  trans-omega constraint for residue 22
 &rst iat=367,365,363,352, &end
#
#  trans-omega constraint for residue 23
 &rst iat=382,380,378,367, &end
#
#  trans-omega constraint for residue 24
 &rst iat=401,399,397,382, &end
#
#  trans-omega constraint for residue 25
 &rst iat=423,421,419,401, &end
#
#  trans-omega constraint for residue 26
 &rst iat=445,443,441,423, &end
#
#  trans-omega constraint for residue 27
 &rst iat=456,454,452,445, &end
#
#  trans-omega constraint for residue 28
 &rst iat=475,473,471,456, &end
#
#  trans-omega constraint for residue 29
 &rst iat=496,494,492,475, &end
#
#  trans-omega constraint for residue 30
 &rst iat=506,504,502,496, &end
#
#  trans-omega constraint for residue 31
 &rst iat=525,523,521,506, &end
#
#  trans-omega constraint for residue 32
 &rst iat=545,543,541,525, &end
#
#  trans-omega constraint for residue 33
 &rst iat=556,554,552,545, &end
#
#  trans-omega constraint for residue 34
 &rst iat=573,571,569,556, &end
#
#  trans-omega constraint for residue 35
 &rst iat=593,591,589,573, &end
#
#  trans-omega constraint for residue 36
 &rst iat=600,598,596,593, &end
#
#  trans-omega constraint for residue 37
 &rst iat=617,615,613,600, &end
#
#  trans-omega constraint for residue 38
 &rst iat=636,634,632,617, &end
#
#  trans-omega constraint for residue 39
 &rst iat=655,653,651,636, &end
#
#  trans-omega constraint for residue 40
 &rst iat=667,665,663,655, &end
#
#  trans-omega constraint for residue 41
 &rst iat=686,684,682,667, &end
#
#  trans-omega constraint for residue 42
 &rst iat=702,700,698,686, &end
#
#  trans-omega constraint for residue 43
 &rst iat=712,710,708,702, &end
#
#  trans-omega constraint for residue 44
 &rst iat=731,729,727,712, &end
#
#  trans-omega constraint for residue 45
 &rst iat=753,751,749,731, &end
#
#  trans-omega constraint for residue 46
 &rst iat=767,765,763,753, &end
#
#  trans-omega constraint for residue 47
 &rst iat=786,784,782,767, &end
#
#  trans-omega constraint for residue 48
 &rst iat=808,806,804,786, &end
#
#  trans-omega constraint for residue 49
 &rst iat=825,823,821,808, &end
#
#  trans-omega constraint for residue 50
 &rst iat=849,847,845,825, &end
#
#  trans-omega constraint for residue 51
 &rst iat=856,854,852,849, &end
#
#  trans-omega constraint for residue 52
 &rst iat=873,871,869,856, &end
#
#  trans-omega constraint for residue 53
 &rst iat=883,881,879,873, &end
#
#  trans-omega constraint for residue 54
 &rst iat=903,901,899,883, &end
#
#  trans-omega constraint for residue 55
 &rst iat=919,917,915,903, &end
#
#  trans-omega constraint for residue 56
 &rst iat=938,936,934,919, &end
#
#  trans-omega constraint for residue 57
 &rst iat=958,956,954,938, &end
#
#  trans-omega constraint for residue 58
 &rst iat=980,978,976,958, &end
#
#  trans-omega constraint for residue 59
 &rst iat=995,993,991,980, &end
#
#  trans-omega constraint for residue 60
 &rst iat=1014,1012,1010,995, &end
#
#  trans-omega constraint for residue 61
 &rst iat=1021,1019,1017,1014, &end
#
#  trans-omega constraint for residue 62
 &rst iat=1032,1030,1028,1021, &end
#
#  trans-omega constraint for residue 63
 &rst iat=1042,1040,1038,1032, &end
#
#  trans-omega constraint for residue 64
 &rst iat=1053,1051,1049,1042, &end
#
#  trans-omega constraint for residue 65
 &rst iat=1067,1065,1063,1053, &end
#
#  trans-omega constraint for residue 66
 &rst iat=1077,1075,1073,1067, &end
#
#  trans-omega constraint for residue 67
 &rst iat=1096,1094,1092,1077, &end
#
#  trans-omega constraint for residue 68
 &rst iat=1120,1118,1116,1096, &end
#
#  trans-omega constraint for residue 69
 &rst iat=1134,1132,1130,1120, &end
#
#  trans-omega constraint for residue 70
 &rst iat=1151,1149,1147,1134, &end
#
#  trans-omega constraint for residue 71
 &rst iat=1168,1166,1164,1151, &end
#
#  trans-omega constraint for residue 72
 &rst iat=1175,1173,1171,1168, &end
#
#  trans-omega constraint for residue 73
 &rst iat=1203,1193,1191,1175, &end
#
#  trans-omega constraint for residue 74
 &rst iat=1209,1207,1205,1203, &end
#
#  trans-omega constraint for residue 75
 &rst iat=1229,1227,1225,1209, &end
#
#  trans-omega constraint for residue 76
 &rst iat=1250,1248,1246,1229, &end
#
#  trans-omega constraint for residue 77
 &rst iat=1262,1260,1258,1250, &end
#
#  trans-omega constraint for residue 78
 &rst iat=1292,1282,1280,1262, &end
#
#  trans-omega constraint for residue 79
 &rst iat=1298,1296,1294,1292, &end
#
#  trans-omega constraint for residue 80
 &rst iat=1315,1313,1311,1298, &end
#
#  trans-omega constraint for residue 81
 &rst iat=1332,1330,1328,1315, &end
#
#  trans-omega constraint for residue 82
 &rst iat=1351,1349,1347,1332, &end
#
#  trans-omega constraint for residue 83
 &rst iat=1361,1359,1357,1351, &end
#
#  trans-omega constraint for residue 84
 &rst iat=1382,1380,1378,1361, &end
#
#  trans-omega constraint for residue 85
 &rst iat=1393,1391,1389,1382, &end
#
#  trans-omega constraint for residue 86
 &rst iat=1415,1413,1411,1393, &end
#
#  trans-omega constraint for residue 87
 &rst iat=1426,1424,1422,1415, &end
#
#  trans-omega constraint for residue 88
 &rst iat=1438,1436,1434,1426, &end
#
#  trans-omega constraint for residue 89
 &rst iat=1449,1447,1445,1438, &end
#
#  trans-omega constraint for residue 90
 &rst iat=1461,1459,1457,1449, &end
#
#  trans-omega constraint for residue 91
 &rst iat=1480,1478,1476,1461, &end
#
#  trans-omega constraint for residue 92
 &rst iat=1496,1494,1492,1480, &end
#
#  trans-omega constraint for residue 93
 &rst iat=1506,1504,1502,1496, &end
#
#  trans-omega constraint for residue 94
 &rst iat=1528,1526,1524,1506, &end
#
#  trans-omega constraint for residue 95
 &rst iat=1547,1545,1543,1528, &end
#
#  trans-omega constraint for residue 96
 &rst iat=1569,1567,1565,1547, &end
#
#  trans-omega constraint for residue 97
 &rst iat=1576,1574,1572,1569, &end
#
#  trans-omega constraint for residue 98
 &rst iat=1590,1588,1586,1576, &end
#
#  trans-omega constraint for residue 99
 &rst iat=1610,1608,1606,1590, &end
#
#  trans-omega constraint for residue 100
 &rst iat=1632,1630,1628,1610, &end
#
#  trans-omega constraint for residue 101
 &rst iat=1647,1645,1643,1632, &end
#
#  trans-omega constraint for residue 102
 &rst iat=1679,1669,1667,1647, &end
#
#  trans-omega constraint for residue 103
 &rst iat=1685,1683,1681,1679, &end
#
#  trans-omega constraint for residue 104
 &rst iat=1707,1705,1703,1685, &end
#
#    4 LEU  HN            3 MET  HA          2.80    (#      0:25  Unique         2.19, 2.33 A)
 &rst
  ixpk= 0, nxpk= 25, iat=  53,  38, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
#    0 AMB  25-3:2        3 MET  HA          3.50    (#      2:25  Single Ambig)
 &rst
  ixpk= 2, nxpk= 25, iat=  -1,  38, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  40,  41,  40,  41,
 &end
#
#    0 AMB  25-3:3        3 MET  HA          3.50    (#      3:25  Single Ambig)
 &rst
  ixpk= 3, nxpk= 25, iat=  -1,  38, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  43,  44,  43,  44,
 &end
#
#    4 LEU  HG            3 MET  HA          5.50    (#      4:25  Unique         3.27, 5.52 A)
 &rst
  ixpk= 4, nxpk= 25, iat=  60,  38, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:5        3 MET  HA          3.50    (#      5:25  Single Ambig)
 &rst
  ixpk= 5, nxpk= 25, iat=  -1,  38, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  62,  63,  64,  66,  67,  68,  62,  63,  64,  66,
        67,  68,
 &end
#
#    0 AMB  25-3:6        0 AMB  25-1:6      4.50    (#      6:25  Double Ambig)
 &rst
  ixpk= 6, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=  43,  44,  43,  44,
 igr2=  40,  41,  40,  41,
 &end
#
#    0 AMB  25-3:7        0 AMB  25-1:7      4.50    (#      7:25  Double Ambig)
 &rst
  ixpk= 7, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=  43,  44,  43,  44,  43,  44,
 igr2=  40,  41,  40,  41,  40,  41,
 &end
#
#    0 AMB  25-3:8        0 AMB  25-1:8      3.50    (#      8:25  Double Ambig)
 &rst
  ixpk= 8, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  38,1043,
 igr2=  40,  41,  40,  41,  40,  41,
 &end
#
#    0 AMB  25-3:9        0 AMB  25-1:9      4.50    (#      9:25  Double Ambig)
 &rst
  ixpk= 9, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=  40,  41,  40,  41,
 igr2=  43,  44,  43,  44,
 &end
#
#    0 AMB  25-3:10       0 AMB  25-1:10     3.50    (#     10:25  Double Ambig)
 &rst
  ixpk= 10, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=  40,  41,  40,  41,  25,  26,
 igr2=  43,  44,  43,  44,  43,  44,
 &end
#
#    5 PRO  HD-           4 LEU  HA          2.80    (#     11:25  Unique         2.02, 2.43 A)
 &rst
  ixpk= 11, nxpk= 25, iat=  -1,  55, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=  73,  74,
 &end
#
#    5 PRO  HD+           4 LEU  HA          3.50    (#     12:25  Unique         2.02, 2.43 A)
 &rst
  ixpk= 12, nxpk= 25, iat=  -1,  55, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  73,  74,
 &end
#
#    0 AMB  25-3:13       4 LEU  HA          2.80    (#     13:25  Single Ambig)
 &rst
  ixpk= 13, nxpk= 25, iat=  -1,  55, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=  62,  63,  64,  66,  67,  68,  62,  63,  64,  66,
        67,  68,
 &end
#
#    4 LEU  HB-           4 LEU  HA          3.50    (#     14:25  Unique         2.23, 2.71 A)
 &rst
  ixpk= 14, nxpk= 25, iat=  -1,  55, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  57,  58,
 &end
#
#    0 AMB  25-3:15       4 LEU  HA          3.50    (#     15:25  Single Ambig)
 &rst
  ixpk= 15, nxpk= 25, iat=  -1,  55, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  57,  58,  60,
 &end
#
#    4 LEU  HN            4 LEU  HA          5.50    (#     16:25  Unique         2.49, 2.84 A)
 &rst
  ixpk= 16, nxpk= 25, iat=  53,  55, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    4 LEU  HN            4 LEU  HB+         4.50    (#     17:25  Unique         2.19, 3.05 A)
 &rst
  ixpk= 17, nxpk= 25, iat=  53,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  57,  58,
 &end
#
#   70 GLN  HN           66 LEU  HB+         5.50    (#     18:25  Unique         5.71, 6.18 A)
 &rst
  ixpk= 18, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1080,1081,
 &end
#
#    0 AMB  25-3:19       0 AMB  25-1:19     4.50    (#     19:25  Double Ambig)
 &rst
  ixpk= 19, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1043,  55,
 igr2=1080,1081,  57,  58,
 &end
#
#    0 AMB  25-3:20       0 AMB  25-1:20     5.50    (#     20:25  Double Ambig)
 &rst
  ixpk= 20, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  73,  74,1078,
 igr2=  57,  58,1080,1081,
 &end
#
#    0 AMB  25-3:22       0 AMB  25-1:22     2.80    (#     22:25  Double Ambig)
 &rst
  ixpk= 22, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1=  62,  63,  64,  66,  67,  68,  62,  63,  64,  66,
        67,  68,
 igr2=  57,  58,  57,  58,
 &end
#
#    4 LEU  HA            4 LEU  HB-         4.50    (#     23:25  Unique         2.23, 2.71 A)
 &rst
  ixpk= 23, nxpk= 25, iat=  55,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  57,  58,
 &end
#
#    5 PRO  HD-           4 LEU  HB-         5.50    (#     25:25  Unique         2.25, 4.01 A)
 &rst
  ixpk= 25, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  73,  74,
 igr2=  57,  58,
 &end
#
#    0 AMB  25-3:27       4 LEU  HB-         2.80    (#     27:25  Single Ambig)
 &rst
  ixpk= 27, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=  62,  63,  64,  66,  67,  68,  62,  63,  64,  66,
        67,  68,
 igr2=  57,  58,
 &end
#
#    4 LEU  HN            4 LEU  HG          4.50    (#     28:25  Unique         2.20, 3.73 A)
 &rst
  ixpk= 28, nxpk= 25, iat=  53,  60, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:29       0 AMB  25-1:29     4.50    (#     29:25  Double Ambig)
 &rst
  ixpk= 29, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  55, 713,  38,
 igr2=  60, 718,
 &end
#
#    0 AMB  25-3:30       0 AMB  25-1:30     2.80    (#     30:25  Double Ambig)
 &rst
  ixpk= 30, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,  62,  63,  64,  66,  67,  68,  62,  63,
        64,  66,  67,  68,
 igr2= 718,  60,
 &end
#
#    0 AMB  25-3:31       4 LEU  HG          2.80    (#     31:25  Single Ambig)
 &rst
  ixpk= 31, nxpk= 25, iat=  -1,  60, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=  57,  58,  79,  80,
 &end
#
#    0 AMB  25-3:32       0 AMB  25-1:32     3.50    (#     32:25  Double Ambig)
 &rst
  ixpk= 32, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=  55, 713,
 igr2=  62,  63,  64,  66,  67,  68, 720, 721, 722, 724,
       725, 726,
 &end
#
#    5 PRO  HD-           4 LEU  MDX         5.50    (#     33:25  Unique         2.51, 5.26 A)
 &rst
  ixpk= 33, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  73,  74,
 igr2=  62,  63,  64,  66,  67,  68,
 &end
#
#    5 PRO  HD+           4 LEU  MDX         4.50    (#     34:25  Unique         2.51, 5.26 A)
 &rst
  ixpk= 34, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=  73,  74,
 igr2=  62,  63,  64,  66,  67,  68,
 &end
#
#    0 AMB  25-3:35       0 AMB  25-1:35     4.50    (#     35:25  Double Ambig)
 &rst
  ixpk= 35, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.42, r4= 9.92,
 igr1=  40,  41,  40,  41, 818, 819, 820,
 igr2=  62,  63,  64,  66,  67,  68, 720, 721, 722, 724,
       725, 726,
 &end
#
#    0 AMB  25-3:36       0 AMB  25-1:36     2.80    (#     36:25  Double Ambig)
 &rst
  ixpk= 36, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1=  57,  58,  57,  58, 737, 738,
 igr2=  62,  63,  64,  66,  67,  68, 720, 721, 722, 724,
       725, 726,
 &end
#
#    4 LEU  HG            4 LEU  MDX         2.80    (#     37:25  Unique         2.28, 2.65 A)
 &rst
  ixpk= 37, nxpk= 25, iat=  60,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=  62,  63,  64,  66,  67,  68,
 &end
#
#    0 AMB  25-3:40      55 ILE  QG2         2.80    (#     40:25  Single Ambig)
 &rst
  ixpk= 40, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 639, 640, 928, 929,
 igr2= 924, 925, 926,
 &end
#
#   55 ILE  HG1+         55 ILE  QG2         2.80    (#     41:25  Unique         2.28, 3.06 A)
 &rst
  ixpk= 41, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 928, 929,
 igr2= 924, 925, 926,
 &end
#
#   55 ILE  HB           55 ILE  QG2         2.80    (#     42:25  Unique         2.32, 2.66 A)
 &rst
  ixpk= 42, nxpk= 25, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 924, 925, 926,
 &end
#
#   55 ILE  HA           55 ILE  QG2         3.50    (#     43:25  Unique         2.42, 3.12 A)
 &rst
  ixpk= 43, nxpk= 25, iat= 920,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 924, 925, 926,
 &end
#
#   55 ILE  HN           55 ILE  QG2         5.50    (#     44:25  Unique         3.90, 4.54 A)
 &rst
  ixpk= 44, nxpk= 25, iat= 918,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 924, 925, 926,
 &end
#
#  102 PRO  HD+         101 ARG  HA          3.50    (#     45:25  Unique         2.00, 2.45 A)
 &rst
  ixpk= 45, nxpk= 25, iat=  -1,1648, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1671,1672,
 &end
#
#    0 AMB  25-3:60      22 GLU  HA          4.50    (#     60:25  Single Ambig)
 &rst
  ixpk= 60, nxpk= 25, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 358, 359, 358, 359,
 &end
#
#   46 LEU  QD2           0 AMB  25-1:62     4.50    (#     62:25  Single Ambig)
 &rst
  ixpk= 62, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 779, 780, 781,
 igr2= 768, 787,
 &end
#
#    7 GLN  HB-           7 GLN  HA          5.50    (#     64:25  Unique         2.26, 2.79 A)
 &rst
  ixpk= 64, nxpk= 25, iat=  -1, 102, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 104, 105,
 &end
#
#   19 LYS  HN           19 LYS  HB-         5.50    (#     78:25  Unique         2.36, 2.59 A)
 &rst
  ixpk= 78, nxpk= 25, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 311, 312,
 &end
#
#   97 THR  QG2          97 THR  HA          3.50    (#     82:25  Unique         2.06, 2.93 A)
 &rst
  ixpk= 82, nxpk= 25, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1581,1582,1583,
 &end
#
#   97 THR  QG2          97 THR  HB          2.80    (#     85:25  Unique         2.06, 2.66 A)
 &rst
  ixpk= 85, nxpk= 25, iat=  -1,1579, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1581,1582,1583,
 &end
#
#   97 THR  HA           97 THR  QG2         3.50    (#     96:25  Unique         2.06, 2.93 A)
 &rst
  ixpk= 96, nxpk= 25, iat=1577,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1581,1582,1583,
 &end
#
#    9 ILE  HB            9 ILE  HA          3.50    (#     98:25  Unique         2.02, 2.32 A)
 &rst
  ixpk= 98, nxpk= 25, iat= 135, 133, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  25-3:99       9 ILE  HA          5.50    (#     99:25  Single Ambig)
 &rst
  ixpk= 99, nxpk= 25, iat=  -1, 133, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1083, 123, 124, 125,
 &end
#
#    9 ILE  QG2           9 ILE  HA          3.50    (#    100:25  Unique         2.45, 3.20 A)
 &rst
  ixpk= 100, nxpk= 25, iat=  -1, 133, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 137, 138, 139,
 &end
#
#   84 SER  HN            9 ILE  HA          5.50    (#    102:25  Unique         2.18, 2.56 A)
 &rst
  ixpk= 102, nxpk= 25, iat=1381, 133, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   10 TYR  HN            9 ILE  HA          3.50    (#    103:25  Unique         2.04, 2.31 A)
 &rst
  ixpk= 103, nxpk= 25, iat= 150, 133, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    9 ILE  QD1           9 ILE  HB          4.50    (#    105:25  Unique         2.43, 3.27 A)
 &rst
  ixpk= 105, nxpk= 25, iat=  -1, 135, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 144, 145, 146,
 &end
#
#    9 ILE  QG2           9 ILE  HB          3.50    (#    106:25  Unique         2.06, 2.64 A)
 &rst
  ixpk= 106, nxpk= 25, iat=  -1, 135, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 137, 138, 139,
 &end
#
#   81 ILE  QG2           9 ILE  HB          3.50    (#    107:25  Unique         2.49, 3.20 A)
 &rst
  ixpk= 107, nxpk= 25, iat=  -1, 135, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1337,1338,1339,
 &end
#
#   66 LEU  HG            9 ILE  HB          5.50    (#    108:25  Unique         2.33, 2.72 A)
 &rst
  ixpk= 108, nxpk= 25, iat=1083, 135, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    9 ILE  HA            9 ILE  HB          4.50    (#    109:25  Unique         2.02, 2.32 A)
 &rst
  ixpk= 109, nxpk= 25, iat= 133, 135, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   10 TYR  HN            9 ILE  HB          5.50    (#    110:25  Unique         2.17, 2.50 A)
 &rst
  ixpk= 110, nxpk= 25, iat= 150, 135, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:111      0 AMB  25-1:111    4.50    (#    111:25  Double Ambig)
 &rst
  ixpk= 111, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 908, 909, 910, 912, 913, 914, 144, 145, 146,
 igr2= 141, 142, 141, 142,
 &end
#
#    0 AMB  25-3:112      9 ILE  HG1-        4.50    (#    112:25  Single Ambig)
 &rst
  ixpk= 112, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 908, 909, 910, 912, 913, 914, 144, 145, 146,
 igr2= 141, 142,
 &end
#
#   81 ILE  QG2           9 ILE  QD1         3.50    (#    115:25  Unique         2.16, 3.80 A)
 &rst
  ixpk= 115, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1337,1338,1339,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  25-3:116      9 ILE  QD1         2.80    (#    116:25  Single Ambig)
 &rst
  ixpk= 116, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 137, 138, 139,1344,1345,1346, 181, 182,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  25-3:117      9 ILE  QD1         3.50    (#    117:25  Single Ambig)
 &rst
  ixpk= 117, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1083,1070,1071,1072,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  25-3:118      9 ILE  QD1         3.50    (#    118:25  Single Ambig)
 &rst
  ixpk= 118, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 141, 142,1080,1081, 181, 182,
 igr2= 144, 145, 146,
 &end
#
#    9 ILE  HG1+          9 ILE  QD1         3.50    (#    119:25  Unique         2.24, 2.65 A)
 &rst
  ixpk= 119, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 141, 142,
 igr2= 144, 145, 146,
 &end
#
#    9 ILE  HB            9 ILE  QD1         3.50    (#    120:25  Unique         2.43, 3.27 A)
 &rst
  ixpk= 120, nxpk= 25, iat= 135,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 144, 145, 146,
 &end
#
#   31 PHE  QE            9 ILE  QD1         5.50    (#    121:25  Unique         2.27, 5.32 A)
 &rst
  ixpk= 121, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 534, 538,
 igr2= 144, 145, 146,
 &end
#
#   56 PHE  QE            9 ILE  QD1         3.50    (#    122:25  Unique         2.29, 4.40 A)
 &rst
  ixpk= 122, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 947, 951,
 igr2= 144, 145, 146,
 &end
#
#   56 PHE  QD            9 ILE  QD1         4.50    (#    123:25  Unique         3.57, 6.06 A)
 &rst
  ixpk= 123, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 945, 953,
 igr2= 144, 145, 146,
 &end
#
#    9 ILE  HN            9 ILE  QD1         4.50    (#    125:25  Unique         4.34, 4.88 A)
 &rst
  ixpk= 125, nxpk= 25, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  25-3:126      9 ILE  QD1         4.50    (#    126:25  Single Ambig)
 &rst
  ixpk= 126, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1080,1081,1335,
 igr2= 144, 145, 146,
 &end
#
#    0 AMB  25-3:127      9 ILE  QD1         2.80    (#    127:25  Single Ambig)
 &rst
  ixpk= 127, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 184, 185, 186,1085,1086,1087,1089,1090,1091,
 igr2= 144, 145, 146,
 &end
#
#   66 LEU  MDY           9 ILE  QG2         5.50    (#    128:25  Unique         2.30, 5.24 A)
 &rst
  ixpk= 128, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2= 137, 138, 139,
 &end
#
#    9 ILE  QD1           9 ILE  QG2         3.50    (#    129:25  Unique         2.26, 3.63 A)
 &rst
  ixpk= 129, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 144, 145, 146,
 igr2= 137, 138, 139,
 &end
#
#   66 LEU  MDX           9 ILE  QG2         5.50    (#    130:25  Unique         2.30, 5.24 A)
 &rst
  ixpk= 130, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2= 137, 138, 139,
 &end
#
#    9 ILE  HA            9 ILE  QG2         3.50    (#    131:25  Unique         2.45, 3.20 A)
 &rst
  ixpk= 131, nxpk= 25, iat= 133,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 137, 138, 139,
 &end
#
#    9 ILE  HN            9 ILE  QG2         4.50    (#    132:25  Unique         2.50, 3.62 A)
 &rst
  ixpk= 132, nxpk= 25, iat= 131,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 137, 138, 139,
 &end
#
#    0 AMB  25-3:133      9 ILE  QG2         5.50    (#    133:25  Single Ambig)
 &rst
  ixpk= 133, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1381,1360, 100,
 igr2= 137, 138, 139,
 &end
#
#   55 ILE  HN            0 AMB  25-1:134    5.50    (#    134:25  Single Ambig)
 &rst
  ixpk= 134, nxpk= 25, iat= 918,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 924, 925, 926, 137, 138, 139,
 &end
#
#   10 TYR  HN            9 ILE  QG2         5.50    (#    135:25  Unique         3.95, 4.70 A)
 &rst
  ixpk= 135, nxpk= 25, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 137, 138, 139,
 &end
#
#   56 PHE  QD            9 ILE  QG2         3.50    (#    136:25  Unique         2.66, 5.74 A)
 &rst
  ixpk= 136, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 945, 953,
 igr2= 137, 138, 139,
 &end
#
#    0 AMB  25-3:137      9 ILE  QG2         3.50    (#    137:25  Single Ambig)
 &rst
  ixpk= 137, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1083,1070,1071,1072,
 igr2= 137, 138, 139,
 &end
#
#    0 AMB  25-3:138      0 AMB  25-1:138    2.80    (#    138:25  Double Ambig)
 &rst
  ixpk= 138, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1080,1081, 928, 929, 141, 142,
 igr2= 137, 138, 139, 924, 925, 926,
 &end
#
#    0 AMB  25-3:139      0 AMB  25-1:139    2.80    (#    139:25  Double Ambig)
 &rst
  ixpk= 139, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 639, 640, 141, 142,
 igr2= 924, 925, 926, 137, 138, 139,
 &end
#
#    0 AMB  25-3:140      9 ILE  QG2         2.80    (#    140:25  Single Ambig)
 &rst
  ixpk= 140, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 135,1035,1036,1037,
 igr2= 137, 138, 139,
 &end
#
#   66 LEU  HN            9 ILE  QG2         5.50    (#    141:25  Unique         2.84, 4.47 A)
 &rst
  ixpk= 141, nxpk= 25, iat=1076,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 137, 138, 139,
 &end
#
#   53 PHE  HA           10 TYR  HA          5.50    (#    143:25  Unique         2.51, 2.91 A)
 &rst
  ixpk= 143, nxpk= 25, iat= 884, 152, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   12 ASN  HD2-         10 TYR  HA          5.50    (#    144:25  Unique         4.31, 5.81 A)
 &rst
  ixpk= 144, nxpk= 25, iat=  -1, 152, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 199, 200,
 &end
#
#   11 ILE  HN           10 TYR  HA          5.50    (#    145:25  Unique         2.00, 2.18 A)
 &rst
  ixpk= 145, nxpk= 25, iat= 171, 152, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   10 TYR  QD            0 AMB  25-1:158    5.50    (#    158:25  Single Ambig)
 &rst
  ixpk= 158, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 158, 167,
 igr2= 154, 155, 154, 155,
 &end
#
#    0 AMB  25-3:162      0 AMB  25-1:162    5.50    (#    162:25  Double Ambig)
 &rst
  ixpk= 162, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 152, 133,
 igr2= 154, 155, 154, 155,
 &end
#
#   91 VAL  HN           87 ASP  HB+         5.50    (#    163:25  Unique         5.11, 5.93 A)
 &rst
  ixpk= 163, nxpk= 25, iat=1479,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1429,1430,
 &end
#
#   10 TYR  HN            0 AMB  25-1:166    5.50    (#    166:25  Single Ambig)
 &rst
  ixpk= 166, nxpk= 25, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 154, 155, 154, 155,
 &end
#
#   11 ILE  QG2          11 ILE  HA          3.50    (#    168:25  Unique         2.32, 3.24 A)
 &rst
  ixpk= 168, nxpk= 25, iat=  -1, 173, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 177, 178, 179,
 &end
#
#   81 ILE  HA           11 ILE  HA          4.50    (#    172:25  Unique         2.32, 2.43 A)
 &rst
  ixpk= 172, nxpk= 25, iat=1333, 173, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   12 ASN  HN           11 ILE  HA          4.50    (#    173:25  Unique         2.16, 2.23 A)
 &rst
  ixpk= 173, nxpk= 25, iat= 190, 173, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   52 ALA  QB           11 ILE  HB          4.50    (#    178:25  Unique         2.22, 3.48 A)
 &rst
  ixpk= 178, nxpk= 25, iat=  -1, 175, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 876, 877, 878,
 &end
#
#   11 ILE  QG2          11 ILE  HB          3.50    (#    179:25  Unique         2.14, 2.66 A)
 &rst
  ixpk= 179, nxpk= 25, iat=  -1, 175, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 177, 178, 179,
 &end
#
#   11 ILE  QD1          11 ILE  HB          5.50    (#    181:25  Unique         2.49, 3.18 A)
 &rst
  ixpk= 181, nxpk= 25, iat=  -1, 175, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 184, 185, 186,
 &end
#
#   52 ALA  HN           11 ILE  HB          5.50    (#    182:25  Unique         2.56, 2.77 A)
 &rst
  ixpk= 182, nxpk= 25, iat= 872, 175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 ILE  HN           11 ILE  HB          5.50    (#    183:25  Unique         2.23, 2.37 A)
 &rst
  ixpk= 183, nxpk= 25, iat= 171, 175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 ILE  HG1+         11 ILE  HB          4.50    (#    185:25  Unique         2.47, 2.80 A)
 &rst
  ixpk= 185, nxpk= 25, iat=  -1, 175, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 181, 182,
 &end
#
#   11 ILE  QD1          11 ILE  HG1+        3.50    (#    192:25  Unique         2.23, 2.65 A)
 &rst
  ixpk= 192, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 184, 185, 186,
 igr2= 181, 182,
 &end
#
#   11 ILE  QD1          11 ILE  HG1-        4.50    (#    193:25  Unique         2.23, 2.65 A)
 &rst
  ixpk= 193, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 184, 185, 186,
 igr2= 181, 182,
 &end
#
#   11 ILE  HB           11 ILE  HG1+        4.50    (#    194:25  Unique         2.47, 2.80 A)
 &rst
  ixpk= 194, nxpk= 25, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 181, 182,
 &end
#
#   11 ILE  HB           11 ILE  HG1-        4.50    (#    195:25  Unique         2.47, 2.80 A)
 &rst
  ixpk= 195, nxpk= 25, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 181, 182,
 &end
#
#    0 AMB  25-3:196      0 AMB  25-1:196    5.50    (#    196:25  Double Ambig)
 &rst
  ixpk= 196, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1341,1342,1341,1342,
 igr2= 181, 182, 181, 182,
 &end
#
#    0 AMB  25-3:197     11 ILE  HG1-        4.50    (#    197:25  Single Ambig)
 &rst
  ixpk= 197, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1341,1342,1341,1342,
 igr2= 181, 182,
 &end
#
#   82 ALA  HN           11 ILE  HG1-        4.50    (#    198:25  Unique         4.44, 5.14 A)
 &rst
  ixpk= 198, nxpk= 25, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 181, 182,
 &end
#
#   11 ILE  HN           11 ILE  HG1+        5.50    (#    199:25  Unique         2.23, 3.12 A)
 &rst
  ixpk= 199, nxpk= 25, iat= 171,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 181, 182,
 &end
#
#    0 AMB  25-3:200     11 ILE  HG1-        5.50    (#    200:25  Single Ambig)
 &rst
  ixpk= 200, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1333, 152,
 igr2= 181, 182,
 &end
#
#    0 AMB  25-3:201      0 AMB  25-1:201    5.50    (#    201:25  Double Ambig)
 &rst
  ixpk= 201, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1333, 152,
 igr2= 181, 182, 181, 182,
 &end
#
#    0 AMB  25-3:202     11 ILE  QD1         2.80    (#    202:25  Single Ambig)
 &rst
  ixpk= 202, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 908, 909, 910, 912, 913, 914, 144, 145, 146,
 igr2= 184, 185, 186,
 &end
#
#   81 ILE  QG2          11 ILE  QD1         3.50    (#    203:25  Unique         3.10, 5.31 A)
 &rst
  ixpk= 203, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1337,1338,1339,
 igr2= 184, 185, 186,
 &end
#
#    0 AMB  25-3:204     11 ILE  QD1         3.50    (#    204:25  Single Ambig)
 &rst
  ixpk= 204, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 177, 178, 179,1344,1345,1346,
 igr2= 184, 185, 186,
 &end
#
#   52 ALA  QB           11 ILE  QD1         3.50    (#    205:25  Unique         2.35, 4.75 A)
 &rst
  ixpk= 205, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 876, 877, 878,
 igr2= 184, 185, 186,
 &end
#
#    0 AMB  25-3:206     11 ILE  QD1         3.50    (#    206:25  Single Ambig)
 &rst
  ixpk= 206, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 181, 182, 141, 142,
 igr2= 184, 185, 186,
 &end
#
#    0 AMB  25-3:207     11 ILE  QD1         2.80    (#    207:25  Single Ambig)
 &rst
  ixpk= 207, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 175, 906,
 igr2= 184, 185, 186,
 &end
#
#   31 PHE  QE           11 ILE  QD1         5.50    (#    208:25  Unique         2.59, 4.55 A)
 &rst
  ixpk= 208, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 534, 538,
 igr2= 184, 185, 186,
 &end
#
#   56 PHE  QE           11 ILE  QD1         4.50    (#    209:25  Unique         4.84, 6.80 A)
 &rst
  ixpk= 209, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 947, 951,
 igr2= 184, 185, 186,
 &end
#
#   31 PHE  QD           11 ILE  QD1         5.50    (#    210:25  Unique         3.55, 5.58 A)
 &rst
  ixpk= 210, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 532, 540,
 igr2= 184, 185, 186,
 &end
#
#    0 AMB  25-3:211     11 ILE  QD1         5.50    (#    211:25  Single Ambig)
 &rst
  ixpk= 211, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1350, 455,
 igr2= 184, 185, 186,
 &end
#
#    0 AMB  25-3:212     11 ILE  QD1         4.50    (#    212:25  Single Ambig)
 &rst
  ixpk= 212, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 902, 872, 131, 685,
 igr2= 184, 185, 186,
 &end
#
#   53 PHE  HA           11 ILE  QD1         5.50    (#    213:25  Unique         4.52, 5.90 A)
 &rst
  ixpk= 213, nxpk= 25, iat= 884,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 184, 185, 186,
 &end
#
#    0 AMB  25-3:214     11 ILE  QD1         5.50    (#    214:25  Single Ambig)
 &rst
  ixpk= 214, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 874, 133,
 igr2= 184, 185, 186,
 &end
#
#   69 MET  QE           11 ILE  QD1         5.50    (#    215:25  Unique         4.42, 7.87 A)
 &rst
  ixpk= 215, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1144,1145,1146,
 igr2= 184, 185, 186,
 &end
#
#   54 VAL  QG+          11 ILE  QD1         5.50    (#    217:25  Unique         2.33, 4.69 A)
 &rst
  ixpk= 217, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 184, 185, 186,
 &end
#
#   11 ILE  QD1          11 ILE  QG2         3.50    (#    218:25  Unique         2.25, 3.82 A)
 &rst
  ixpk= 218, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 184, 185, 186,
 igr2= 177, 178, 179,
 &end
#
#    0 AMB  25-3:219     11 ILE  QG2         3.50    (#    219:25  Single Ambig)
 &rst
  ixpk= 219, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 igr2= 177, 178, 179,
 &end
#
#    0 AMB  25-3:220     11 ILE  QG2         2.80    (#    220:25  Single Ambig)
 &rst
  ixpk= 220, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 225, 876, 877, 878,
 igr2= 177, 178, 179,
 &end
#
#    0 AMB  25-3:221     11 ILE  QG2         4.50    (#    221:25  Single Ambig)
 &rst
  ixpk= 221, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 181, 182, 222, 223,
 igr2= 177, 178, 179,
 &end
#
#   11 ILE  HB           11 ILE  QG2         2.80    (#    222:25  Unique         2.14, 2.66 A)
 &rst
  ixpk= 222, nxpk= 25, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 177, 178, 179,
 &end
#
#   79 MET  HB-          11 ILE  QG2         4.50    (#    224:25  Unique         3.12, 5.34 A)
 &rst
  ixpk= 224, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1301,1302,
 igr2= 177, 178, 179,
 &end
#
#    0 AMB  25-3:225     11 ILE  QG2         4.50    (#    225:25  Single Ambig)
 &rst
  ixpk= 225, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1301,1302, 859, 860, 859, 860, 208, 209,
 igr2= 177, 178, 179,
 &end
#
#   79 MET  HG-          11 ILE  QG2         5.50    (#    226:25  Unique         4.29, 5.53 A)
 &rst
  ixpk= 226, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1304,1305,
 igr2= 177, 178, 179,
 &end
#
#   11 ILE  HA           11 ILE  QG2         3.50    (#    227:25  Unique         2.32, 3.24 A)
 &rst
  ixpk= 227, nxpk= 25, iat= 173,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 177, 178, 179,
 &end
#
#    0 AMB  25-3:228     11 ILE  QG2         5.50    (#    228:25  Single Ambig)
 &rst
  ixpk= 228, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1314, 855,
 igr2= 177, 178, 179,
 &end
#
#   52 ALA  HN           11 ILE  QG2         4.50    (#    229:25  Unique         3.52, 4.54 A)
 &rst
  ixpk= 229, nxpk= 25, iat= 872,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 177, 178, 179,
 &end
#
#   12 ASN  HN           11 ILE  QG2         4.50    (#    230:25  Unique         2.25, 3.54 A)
 &rst
  ixpk= 230, nxpk= 25, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 177, 178, 179,
 &end
#
#   12 ASN  HB+          12 ASN  HA          4.50    (#    232:25  Unique         2.39, 2.66 A)
 &rst
  ixpk= 232, nxpk= 25, iat=  -1, 192, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 194, 195,
 &end
#
#   51 GLN  HA           12 ASN  HA          4.50    (#    233:25  Unique         2.05, 2.55 A)
 &rst
  ixpk= 233, nxpk= 25, iat= 857, 192, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13 ASN  HN           12 ASN  HA          4.50    (#    234:25  Unique         2.45, 2.96 A)
 &rst
  ixpk= 234, nxpk= 25, iat= 204, 192, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   41 VAL  HB            0 AMB  25-1:237    5.50    (#    237:25  Single Ambig)
 &rst
  ixpk= 237, nxpk= 25, iat= 689,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 886, 887, 886, 887,
 &end
#
#   12 ASN  HA           12 ASN  HB-         4.50    (#    240:25  Unique         2.39, 2.66 A)
 &rst
  ixpk= 240, nxpk= 25, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 194, 195,
 &end
#
#   12 ASN  HA           12 ASN  HB+         4.50    (#    241:25  Unique         2.39, 2.66 A)
 &rst
  ixpk= 241, nxpk= 25, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 194, 195,
 &end
#
#   53 PHE  QD            0 AMB  25-1:242    5.50    (#    242:25  Single Ambig)
 &rst
  ixpk= 242, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 890, 898,
 igr2= 886, 887, 886, 887,
 &end
#
#   12 ASN  HN           12 ASN  HB-         4.50    (#    243:25  Unique         2.46, 3.24 A)
 &rst
  ixpk= 243, nxpk= 25, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 194, 195,
 &end
#
#    0 AMB  25-3:244      0 AMB  25-1:244    3.50    (#    244:25  Double Ambig)
 &rst
  ixpk= 244, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 882, 190, 685,
 igr2= 886, 887, 886, 887, 194, 195, 886, 887,
 &end
#
#    8 THR  QG2           0 AMB  25-1:245    5.50    (#    245:25  Single Ambig)
 &rst
  ixpk= 245, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 123, 124, 125,
 igr2= 886, 887, 886, 887,
 &end
#
#    0 AMB  25-3:247     13 ASN  HA          5.50    (#    247:25  Single Ambig)
 &rst
  ixpk= 247, nxpk= 25, iat=  -1, 206, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1271,1272,1271,1272,
 &end
#
#    0 AMB  25-3:248     13 ASN  HA          4.50    (#    248:25  Single Ambig)
 &rst
  ixpk= 248, nxpk= 25, iat=  -1, 206, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1318,1319,1265,1266,
 &end
#
#   13 ASN  HB-          13 ASN  HA          4.50    (#    249:25  Unique         2.33, 2.77 A)
 &rst
  ixpk= 249, nxpk= 25, iat=  -1, 206, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 208, 209,
 &end
#
#   15 ASN  HB-          13 ASN  HA          7.00    (#    250:25  Unique         6.99, 7.77 A)
 &rst
  ixpk= 250, nxpk= 25, iat=  -1, 206, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 241, 242,
 &end
#
#   13 ASN  HB+          13 ASN  HA          5.50    (#    251:25  Unique         2.33, 2.77 A)
 &rst
  ixpk= 251, nxpk= 25, iat=  -1, 206, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 208, 209,
 &end
#
#    0 AMB  25-3:252     13 ASN  HA          5.50    (#    252:25  Single Ambig)
 &rst
  ixpk= 252, nxpk= 25, iat=  -1, 206, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 220,1299,
 &end
#
#   14 LEU  HN           13 ASN  HA          4.50    (#    255:25  Unique         2.44, 2.64 A)
 &rst
  ixpk= 255, nxpk= 25, iat= 218, 206, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13 ASN  HN           13 ASN  HA          3.50    (#    257:25  Unique         2.21, 2.68 A)
 &rst
  ixpk= 257, nxpk= 25, iat= 204, 206, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   80 GLN  HB-          13 ASN  HB-         5.50    (#    258:25  Unique         2.16, 3.44 A)
 &rst
  ixpk= 258, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1318,1319,
 igr2= 208, 209,
 &end
#
#    0 AMB  25-3:259      0 AMB  25-1:259    5.50    (#    259:25  Double Ambig)
 &rst
  ixpk= 259, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1318,1319,1318,1319,
 igr2= 208, 209, 208, 209,
 &end
#
#   13 ASN  HA           13 ASN  HB-         4.50    (#    260:25  Unique         2.33, 2.77 A)
 &rst
  ixpk= 260, nxpk= 25, iat= 206,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 208, 209,
 &end
#
#   13 ASN  HD2+         13 ASN  HB-         4.50    (#    261:25  Unique         2.00, 3.22 A)
 &rst
  ixpk= 261, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 213, 214,
 igr2= 208, 209,
 &end
#
#   13 ASN  HD2+         13 ASN  HB+         5.50    (#    262:25  Unique         2.00, 3.22 A)
 &rst
  ixpk= 262, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 213, 214,
 igr2= 208, 209,
 &end
#
#   13 ASN  HD2-         13 ASN  HB-         5.50    (#    263:25  Unique         2.00, 3.22 A)
 &rst
  ixpk= 263, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 213, 214,
 igr2= 208, 209,
 &end
#
#   80 GLN  HA           13 ASN  HB-         5.50    (#    264:25  Unique         4.33, 5.01 A)
 &rst
  ixpk= 264, nxpk= 25, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 208, 209,
 &end
#
#    0 AMB  25-3:265     14 LEU  HA          5.50    (#    265:25  Single Ambig)
 &rst
  ixpk= 265, nxpk= 25, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   14 LEU  HG           14 LEU  HA          3.50    (#    266:25  Unique         2.21, 2.47 A)
 &rst
  ixpk= 266, nxpk= 25, iat= 225, 220, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  25-3:267     14 LEU  HA          5.50    (#    267:25  Single Ambig)
 &rst
  ixpk= 267, nxpk= 25, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1271,1272, 292,
 &end
#
#   14 LEU  HB-          14 LEU  HA          4.50    (#    268:25  Unique         2.50, 2.87 A)
 &rst
  ixpk= 268, nxpk= 25, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 222, 223,
 &end
#
#    0 AMB  25-3:269     14 LEU  HA          5.50    (#    269:25  Single Ambig)
 &rst
  ixpk= 269, nxpk= 25, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 241, 242,1304,1305,
 &end
#
#   14 LEU  HN           14 LEU  HA          5.50    (#    273:25  Unique         2.85, 2.94 A)
 &rst
  ixpk= 273, nxpk= 25, iat= 218, 220, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 ASN  HN           14 LEU  HA          4.50    (#    274:25  Unique         2.05, 2.37 A)
 &rst
  ixpk= 274, nxpk= 25, iat= 237, 220, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:275     14 LEU  HB-         3.50    (#    275:25  Single Ambig)
 &rst
  ixpk= 275, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 igr2= 222, 223,
 &end
#
#    0 AMB  25-3:276      0 AMB  25-1:276    5.50    (#    276:25  Double Ambig)
 &rst
  ixpk= 276, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 igr2= 222, 223, 222, 223,
 &end
#
#   14 LEU  HN           14 LEU  HB+         5.50    (#    277:25  Unique         2.06, 2.64 A)
 &rst
  ixpk= 277, nxpk= 25, iat= 218,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 222, 223,
 &end
#
#    0 AMB  25-3:278      0 AMB  25-1:278    5.50    (#    278:25  Double Ambig)
 &rst
  ixpk= 278, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 532, 540,1216,1224,
 igr2= 459, 460, 222, 223,
 &end
#
#    0 AMB  25-3:279      0 AMB  25-1:279    5.50    (#    279:25  Double Ambig)
 &rst
  ixpk= 279, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 288, 534, 538, 484, 489,
 igr2= 222, 223, 459, 460,
 &end
#
#    0 AMB  25-3:280     14 LEU  HG          2.80    (#    280:25  Single Ambig)
 &rst
  ixpk= 280, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   11 ILE  QG2          14 LEU  HG          2.80    (#    281:25  Unique         2.56, 3.55 A)
 &rst
  ixpk= 281, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 177, 178, 179,
 &end
#
#   14 LEU  HB-          14 LEU  HG          2.80    (#    282:25  Unique         2.30, 2.77 A)
 &rst
  ixpk= 282, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 222, 223,
 &end
#
#   14 LEU  HB+          14 LEU  HG          2.80    (#    283:25  Unique         2.30, 2.77 A)
 &rst
  ixpk= 283, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 222, 223,
 &end
#
#   23 LEU  HB+          14 LEU  HG          5.50    (#    284:25  Unique         5.47, 6.49 A)
 &rst
  ixpk= 284, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 385, 386,
 &end
#
#   14 LEU  HA           14 LEU  HG          3.50    (#    285:25  Unique         2.21, 2.47 A)
 &rst
  ixpk= 285, nxpk= 25, iat= 220, 225, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   74 PHE  QE           14 LEU  HG          5.50    (#    287:25  Unique         2.85, 5.74 A)
 &rst
  ixpk= 287, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1218,1222,
 &end
#
#   74 PHE  QD           14 LEU  HG          4.50    (#    288:25  Unique         3.12, 5.63 A)
 &rst
  ixpk= 288, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1216,1224,
 &end
#
#    0 AMB  25-3:289     14 LEU  HG          5.50    (#    289:25  Single Ambig)
 &rst
  ixpk= 289, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1265,1266,1301,1302,
 &end
#
#    0 AMB  25-3:290     14 LEU  HG          5.50    (#    290:25  Single Ambig)
 &rst
  ixpk= 290, nxpk= 25, iat=  -1, 225, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1271,1272,1341,1342,1341,1342,
 &end
#
#    0 AMB  25-3:291      0 AMB  25-1:291    4.50    (#    291:25  Double Ambig)
 &rst
  ixpk= 291, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1= 294, 295, 296, 184, 185, 186,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#    0 AMB  25-3:292      0 AMB  25-1:292    3.50    (#    292:25  Double Ambig)
 &rst
  ixpk= 292, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 298, 299, 298, 299, 298, 299, 177, 178, 179,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#    0 AMB  25-3:293      0 AMB  25-1:293    2.80    (#    293:25  Double Ambig)
 &rst
  ixpk= 293, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 225, 876, 877, 878,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   14 LEU  HB-           0 AMB  25-1:294    3.50    (#    294:25  Single Ambig)
 &rst
  ixpk= 294, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 222, 223,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#    0 AMB  25-3:295      0 AMB  25-1:295    3.50    (#    295:25  Double Ambig)
 &rst
  ixpk= 295, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 222, 223, 222, 223,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#    0 AMB  25-3:296      0 AMB  25-1:296    4.50    (#    296:25  Double Ambig)
 &rst
  ixpk= 296, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 292, 388, 385, 386,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   12 ASN  HA            0 AMB  25-1:298    5.50    (#    298:25  Single Ambig)
 &rst
  ixpk= 298, nxpk= 25, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   52 ALA  HN            0 AMB  25-1:299    4.50    (#    299:25  Single Ambig)
 &rst
  ixpk= 299, nxpk= 25, iat= 872,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   15 ASN  HB+          15 ASN  HA          4.50    (#    301:25  Unique         2.31, 2.77 A)
 &rst
  ixpk= 301, nxpk= 25, iat=  -1, 239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 241, 242,
 &end
#
#    0 AMB  25-3:302     15 ASN  HA          4.50    (#    302:25  Single Ambig)
 &rst
  ixpk= 302, nxpk= 25, iat=  -1, 239, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1274,1275, 241, 242,
 &end
#
#   77 LYS  HD-          15 ASN  HA          4.50    (#    303:25  Unique         2.03, 3.08 A)
 &rst
  ixpk= 303, nxpk= 25, iat=  -1, 239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1271,1272,
 &end
#
#   77 LYS  HD+          15 ASN  HA          4.50    (#    304:25  Unique         2.03, 3.08 A)
 &rst
  ixpk= 304, nxpk= 25, iat=  -1, 239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1271,1272,
 &end
#
#    0 AMB  25-3:305     15 ASN  HA          2.80    (#    305:25  Single Ambig)
 &rst
  ixpk= 305, nxpk= 25, iat=  -1, 239, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 251, 237,
 &end
#
#   17 LYS  HN           15 ASN  HA          5.50    (#    306:25  Unique         4.03, 4.23 A)
 &rst
  ixpk= 306, nxpk= 25, iat= 266, 239, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 ASN  HA           15 ASN  HB+         5.50    (#    309:25  Unique         2.31, 2.77 A)
 &rst
  ixpk= 309, nxpk= 25, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 241, 242,
 &end
#
#   15 ASN  HA           15 ASN  HB-         5.50    (#    310:25  Unique         2.31, 2.77 A)
 &rst
  ixpk= 310, nxpk= 25, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 241, 242,
 &end
#
#    0 AMB  25-3:312      0 AMB  25-1:312    5.50    (#    312:25  Double Ambig)
 &rst
  ixpk= 312, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 237, 251,
 igr2= 241, 242, 241, 242,
 &end
#
#    0 AMB  25-3:313     15 ASN  HB-         5.50    (#    313:25  Single Ambig)
 &rst
  ixpk= 313, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 237, 251,
 igr2= 241, 242,
 &end
#
#   17 LYS  HN           15 ASN  HB+         5.50    (#    314:25  Unique         3.45, 4.49 A)
 &rst
  ixpk= 314, nxpk= 25, iat= 266,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 241, 242,
 &end
#
#   16 GLU  HN           16 GLU  HA          4.50    (#    315:25  Unique         2.22, 2.69 A)
 &rst
  ixpk= 315, nxpk= 25, iat= 251, 253, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:317     16 GLU  HA          2.80    (#    317:25  Single Ambig)
 &rst
  ixpk= 317, nxpk= 25, iat=  -1, 253, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 255, 256, 258, 259,
 &end
#
#   17 LYS  HN           16 GLU  HA          5.50    (#    320:25  Unique         2.93, 3.37 A)
 &rst
  ixpk= 320, nxpk= 25, iat= 266, 253, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:321      0 AMB  25-1:321    3.50    (#    321:25  Double Ambig)
 &rst
  ixpk= 321, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 102, 368,
 igr2= 104, 105, 370, 371,
 &end
#
#    0 AMB  25-3:323      0 AMB  25-1:323    5.50    (#    323:25  Double Ambig)
 &rst
  ixpk= 323, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.76, r4=11.26,
 igr1= 385, 386, 928, 929, 292, 429, 430,
 igr2= 370, 371, 104, 105, 370, 371, 370, 371,
 &end
#
#   18 ILE  QG2          22 GLU  HB+         5.50    (#    324:25  Unique         2.27, 3.25 A)
 &rst
  ixpk= 324, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 294, 295, 296,
 igr2= 370, 371,
 &end
#
#   22 GLU  HN           22 GLU  HB+         3.50    (#    325:25  Unique         2.07, 2.97 A)
 &rst
  ixpk= 325, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 370, 371,
 &end
#
#    0 AMB  25-3:326      0 AMB  25-1:326    4.50    (#    326:25  Double Ambig)
 &rst
  ixpk= 326, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 100, 381,
 igr2= 104, 105, 370, 371,
 &end
#
#    0 AMB  25-3:327      0 AMB  25-1:327    4.50    (#    327:25  Double Ambig)
 &rst
  ixpk= 327, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 102, 368,
 igr2= 104, 105, 370, 371,
 &end
#
#    0 AMB  25-3:328      0 AMB  25-1:328    4.50    (#    328:25  Double Ambig)
 &rst
  ixpk= 328, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1316, 981,
 igr2=1318,1319, 104, 105,
 &end
#
#   22 GLU  HN           22 GLU  HB-         4.50    (#    329:25  Unique         2.07, 2.97 A)
 &rst
  ixpk= 329, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 370, 371,
 &end
#
#    0 AMB  25-3:330      0 AMB  25-1:330    5.50    (#    330:25  Double Ambig)
 &rst
  ixpk= 330, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1314,1162,1163,
 igr2=1318,1319,1318,1319,
 &end
#
#   36 GLN  HA           36 GLN  HB+         4.50    (#    331:25  Unique         2.22, 2.74 A)
 &rst
  ixpk= 331, nxpk= 25, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 603, 604,
 &end
#
#   36 GLN  HA           36 GLN  HB-         4.50    (#    332:25  Unique         2.22, 2.74 A)
 &rst
  ixpk= 332, nxpk= 25, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 603, 604,
 &end
#
#    0 AMB  25-3:334      0 AMB  25-1:334    5.50    (#    334:25  Double Ambig)
 &rst
  ixpk= 334, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 268, 768, 787,
 igr2= 255, 256, 255, 256, 255, 256,
 &end
#
#    0 AMB  25-3:335      0 AMB  25-1:335    5.50    (#    335:25  Double Ambig)
 &rst
  ixpk= 335, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 599, 266,
 igr2= 603, 604, 255, 256,
 &end
#
#    0 AMB  25-3:336      0 AMB  25-1:336    4.50    (#    336:25  Double Ambig)
 &rst
  ixpk= 336, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 599, 266,
 igr2= 603, 604, 255, 256,
 &end
#
#   36 GLN  HG-          36 GLN  HB+         5.50    (#    337:25  Unique         2.32, 2.60 A)
 &rst
  ixpk= 337, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 606, 607,
 igr2= 603, 604,
 &end
#
#   36 GLN  HG-          36 GLN  HB-         5.50    (#    338:25  Unique         2.32, 2.60 A)
 &rst
  ixpk= 338, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 606, 607,
 igr2= 603, 604,
 &end
#
#    0 AMB  25-3:339      0 AMB  25-1:339    4.50    (#    339:25  Double Ambig)
 &rst
  ixpk= 339, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 601, 239,
 igr2= 603, 604, 255, 256,
 &end
#
#    0 AMB  25-3:340      0 AMB  25-1:340    5.50    (#    340:25  Double Ambig)
 &rst
  ixpk= 340, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1314,1162,1163,
 igr2=1318,1319,1318,1319,
 &end
#
#    0 AMB  25-3:341      0 AMB  25-1:341    4.50    (#    341:25  Double Ambig)
 &rst
  ixpk= 341, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.02, r4= 8.52,
 igr1= 967, 968, 967, 968, 831, 832, 831, 832,
 igr2= 603, 604, 255, 256,
 &end
#
#   16 GLU  HB+          16 GLU  HG+         2.80    (#    342:25  Unique         2.17, 2.70 A)
 &rst
  ixpk= 342, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 255, 256,
 igr2= 258, 259,
 &end
#
#   16 GLU  HB+          16 GLU  HG-         2.80    (#    343:25  Unique         2.17, 2.70 A)
 &rst
  ixpk= 343, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 255, 256,
 igr2= 258, 259,
 &end
#
#    0 AMB  25-3:344      0 AMB  25-1:344    4.50    (#    344:25  Double Ambig)
 &rst
  ixpk= 344, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 850, 851, 253,
 igr2= 258, 259, 258, 259,
 &end
#
#    0 AMB  25-3:345     16 GLU  HG-         3.50    (#    345:25  Single Ambig)
 &rst
  ixpk= 345, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 850, 851, 253,
 igr2= 258, 259,
 &end
#
#   16 GLU  HN           16 GLU  HG+         5.50    (#    346:25  Unique         2.08, 3.20 A)
 &rst
  ixpk= 346, nxpk= 25, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 258, 259,
 &end
#
#   16 GLU  HN           16 GLU  HG-         5.50    (#    347:25  Unique         2.08, 3.20 A)
 &rst
  ixpk= 347, nxpk= 25, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 258, 259,
 &end
#
#   17 LYS  HN           17 LYS  HA          3.50    (#    350:25  Unique         2.79, 2.90 A)
 &rst
  ixpk= 350, nxpk= 25, iat= 266, 268, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  25-3:351      0 AMB  25-1:351    4.50    (#    351:25  Double Ambig)
 &rst
  ixpk= 351, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 311, 312, 255, 256, 333, 334,
 igr2= 309, 268,
 &end
#
#    0 AMB  25-3:352      0 AMB  25-1:352    2.80    (#    352:25  Double Ambig)
 &rst
  ixpk= 352, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 270, 271, 311, 312,
 igr2= 268, 309,
 &end
#
#    0 AMB  25-3:353     17 LYS  HA          3.50    (#    353:25  Single Ambig)
 &rst
  ixpk= 353, nxpk= 25, iat=  -1, 268, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 831, 832, 831, 832, 276, 277, 276, 277,
 &end
#
#   17 LYS  HG-          17 LYS  HA          3.50    (#    354:25  Unique         3.66, 3.89 A)
 &rst
  ixpk= 354, nxpk= 25, iat=  -1, 268, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 273, 274,
 &end
#
#    0 AMB  25-3:356      0 AMB  25-1:356    4.50    (#    356:25  Double Ambig)
 &rst
  ixpk= 356, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 402, 290,
 igr2= 404, 405, 270, 271,
 &end
#
#   17 LYS  HN           17 LYS  HB-         4.50    (#    357:25  Unique         2.05, 3.35 A)
 &rst
  ixpk= 357, nxpk= 25, iat= 266,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 270, 271,
 &end
#
#    0 AMB  25-3:358      0 AMB  25-1:358    4.50    (#    358:25  Double Ambig)
 &rst
  ixpk= 358, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.63, r4=10.13,
 igr1= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726, 298, 299, 298, 299,
 igr2= 342, 343, 279, 280, 279, 280,
 &end
#
#    0 AMB  25-3:361      0 AMB  25-1:361    3.50    (#    361:25  Double Ambig)
 &rst
  ixpk= 361, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
 igr1= 426, 427, 426, 427, 426, 427, 961, 962, 961, 962,
      
 igr2= 435, 436, 435, 436, 435, 436, 970, 971, 970, 971,
      
 &end
#
#    0 AMB  25-3:363      0 AMB  25-1:363    3.50    (#    363:25  Double Ambig)
 &rst
  ixpk= 363, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 258, 259, 258, 259, 358, 359,
 igr2= 279, 280, 279, 280, 413, 414, 413, 414, 435, 436,
      
 &end
#
#    0 AMB  25-3:364      0 AMB  25-1:364    3.50    (#    364:25  Double Ambig)
 &rst
  ixpk= 364, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
 igr1=1364,1365,  90,  91,  90,  91,  90,  91,
 igr2=1405,1406,1405,1406,1405,1406,1405,1406,
 &end
#
#   18 ILE  QD1          18 ILE  HA          3.50    (#    369:25  Unique         2.13, 3.11 A)
 &rst
  ixpk= 369, nxpk= 25, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 301, 302, 303,
 &end
#
#   18 ILE  QG2          18 ILE  HA          3.50    (#    370:25  Unique         2.57, 3.25 A)
 &rst
  ixpk= 370, nxpk= 25, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 294, 295, 296,
 &end
#
#    0 AMB  25-3:371     18 ILE  HA          4.50    (#    371:25  Single Ambig)
 &rst
  ixpk= 371, nxpk= 25, iat=  -1, 290, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 292, 314, 315,
 &end
#
#   19 LYS  HN           18 ILE  HA          2.80    (#    372:25  Unique         1.94, 2.17 A)
 &rst
  ixpk= 372, nxpk= 25, iat= 307, 290, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   18 ILE  QD1          18 ILE  HB          4.50    (#    373:25  Unique         2.41, 3.94 A)
 &rst
  ixpk= 373, nxpk= 25, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 301, 302, 303,
 &end
#
#   18 ILE  QG2          18 ILE  HB          3.50    (#    374:25  Unique         2.28, 2.65 A)
 &rst
  ixpk= 374, nxpk= 25, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 294, 295, 296,
 &end
#
#    0 AMB  25-3:375     18 ILE  HB          3.50    (#    375:25  Single Ambig)
 &rst
  ixpk= 375, nxpk= 25, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 298, 299, 298, 299,
 &end
#
#   23 LEU  QD2          18 ILE  HB          5.50    (#    376:25  Unique         4.48, 5.97 A)
 &rst
  ixpk= 376, nxpk= 25, iat=  -1, 292, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 394, 395, 396,
 &end
#
#   18 ILE  HN           18 ILE  HB          4.50    (#    377:25  Unique         2.29, 2.44 A)
 &rst
  ixpk= 377, nxpk= 25, iat= 288, 292, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   18 ILE  QD1           0 AMB  25-1:379    3.50    (#    379:25  Single Ambig)
 &rst
  ixpk= 379, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 301, 302, 303,
 igr2= 298, 299, 298, 299,
 &end
#
#   18 ILE  QD1          18 ILE  HG1+        3.50    (#    380:25  Unique         2.22, 2.66 A)
 &rst
  ixpk= 380, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 301, 302, 303,
 igr2= 298, 299,
 &end
#
#   18 ILE  HB            0 AMB  25-1:381    3.50    (#    381:25  Single Ambig)
 &rst
  ixpk= 381, nxpk= 25, iat= 292,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 298, 299, 298, 299,
 &end
#
#    0 AMB  25-3:382      0 AMB  25-1:382    2.80    (#    382:25  Double Ambig)
 &rst
  ixpk= 382, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr1= 388, 292, 385, 386,
 igr2= 390, 391, 392, 298, 299,
 &end
#
#   18 ILE  QG2          18 ILE  QD1         2.80    (#    383:25  Unique         2.25, 3.75 A)
 &rst
  ixpk= 383, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 294, 295, 296,
 igr2= 301, 302, 303,
 &end
#
#    0 AMB  25-3:384     18 ILE  QD1         3.50    (#    384:25  Single Ambig)
 &rst
  ixpk= 384, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 298, 299, 298, 299,
 igr2= 301, 302, 303,
 &end
#
#   18 ILE  HB           18 ILE  QD1         4.50    (#    385:25  Unique         2.41, 3.94 A)
 &rst
  ixpk= 385, nxpk= 25, iat= 292,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 301, 302, 303,
 &end
#
#    0 AMB  25-3:386     18 ILE  QD1         5.50    (#    386:25  Single Ambig)
 &rst
  ixpk= 386, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 385, 386, 270, 271,
 igr2= 301, 302, 303,
 &end
#
#   15 ASN  HB-          18 ILE  QD1         5.50    (#    387:25  Unique         2.39, 4.75 A)
 &rst
  ixpk= 387, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 241, 242,
 igr2= 301, 302, 303,
 &end
#
#   18 ILE  HA           18 ILE  QD1         3.50    (#    388:25  Unique         2.13, 3.11 A)
 &rst
  ixpk= 388, nxpk= 25, iat= 290,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 301, 302, 303,
 &end
#
#   75 TYR  QD           18 ILE  QD1         4.50    (#    389:25  Unique         2.90, 4.47 A)
 &rst
  ixpk= 389, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1236,1245,
 igr2= 301, 302, 303,
 &end
#
#   75 TYR  QE           18 ILE  QD1         5.50    (#    390:25  Unique         2.83, 4.61 A)
 &rst
  ixpk= 390, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1238,1243,
 igr2= 301, 302, 303,
 &end
#
#   18 ILE  HN           18 ILE  QD1         4.50    (#    391:25  Unique         3.32, 4.18 A)
 &rst
  ixpk= 391, nxpk= 25, iat= 288,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 301, 302, 303,
 &end
#
#   19 LYS  HN           18 ILE  QD1         5.50    (#    392:25  Unique         3.66, 4.86 A)
 &rst
  ixpk= 392, nxpk= 25, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 301, 302, 303,
 &end
#
#    0 AMB  25-3:395     18 ILE  QG2         3.50    (#    395:25  Single Ambig)
 &rst
  ixpk= 395, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 298, 299, 298, 299,
 igr2= 294, 295, 296,
 &end
#
#   23 LEU  QD2          18 ILE  QG2         4.50    (#    396:25  Unique         3.56, 5.49 A)
 &rst
  ixpk= 396, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 394, 395, 396,
 igr2= 294, 295, 296,
 &end
#
#    0 AMB  25-3:397     18 ILE  QG2         2.80    (#    397:25  Single Ambig)
 &rst
  ixpk= 397, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 292, 385, 386,
 igr2= 294, 295, 296,
 &end
#
#   23 LEU  HB+          18 ILE  QG2         4.50    (#    398:25  Unique         2.31, 3.71 A)
 &rst
  ixpk= 398, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 385, 386,
 igr2= 294, 295, 296,
 &end
#
#   22 GLU  HB-          18 ILE  QG2         3.50    (#    399:25  Unique         2.27, 3.25 A)
 &rst
  ixpk= 399, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 370, 371,
 igr2= 294, 295, 296,
 &end
#
#   22 GLU  HG-          18 ILE  QG2         5.50    (#    400:25  Unique         4.04, 5.45 A)
 &rst
  ixpk= 400, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 373, 374,
 igr2= 294, 295, 296,
 &end
#
#   18 ILE  HA           18 ILE  QG2         3.50    (#    401:25  Unique         2.57, 3.25 A)
 &rst
  ixpk= 401, nxpk= 25, iat= 290,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 294, 295, 296,
 &end
#
#   23 LEU  HA           18 ILE  QG2         5.50    (#    402:25  Unique         2.98, 3.66 A)
 &rst
  ixpk= 402, nxpk= 25, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 294, 295, 296,
 &end
#
#    0 AMB  25-3:403     18 ILE  QG2         5.50    (#    403:25  Single Ambig)
 &rst
  ixpk= 403, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 309, 368,
 igr2= 294, 295, 296,
 &end
#
#   75 TYR  QE           18 ILE  QG2         4.50    (#    405:25  Unique         2.39, 4.95 A)
 &rst
  ixpk= 405, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1238,1243,
 igr2= 294, 295, 296,
 &end
#
#   23 LEU  HN           18 ILE  QG2         3.50    (#    406:25  Unique         2.58, 3.42 A)
 &rst
  ixpk= 406, nxpk= 25, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 294, 295, 296,
 &end
#
#    0 AMB  25-3:408     18 ILE  QG2         5.50    (#    408:25  Single Ambig)
 &rst
  ixpk= 408, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 329, 455,
 igr2= 294, 295, 296,
 &end
#
#   15 ASN  HN           18 ILE  QG2         5.50    (#    409:25  Unique         4.72, 6.13 A)
 &rst
  ixpk= 409, nxpk= 25, iat= 237,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 294, 295, 296,
 &end
#
#   18 ILE  HN           18 ILE  QG2         5.50    (#    410:25  Unique         4.31, 4.54 A)
 &rst
  ixpk= 410, nxpk= 25, iat= 288,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 294, 295, 296,
 &end
#
#   18 ILE  QD1          18 ILE  QG2         2.80    (#    411:25  Unique         2.25, 3.75 A)
 &rst
  ixpk= 411, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 301, 302, 303,
 igr2= 294, 295, 296,
 &end
#
#   19 LYS  HN           18 ILE  QG2         4.50    (#    412:25  Unique         3.00, 3.72 A)
 &rst
  ixpk= 412, nxpk= 25, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 294, 295, 296,
 &end
#
#   37 ILE  HN           36 GLN  HA          4.50    (#    413:25  Unique         2.01, 2.08 A)
 &rst
  ixpk= 413, nxpk= 25, iat= 616, 601, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   36 GLN  HG-          36 GLN  HA          4.50    (#    414:25  Unique         2.31, 3.43 A)
 &rst
  ixpk= 414, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 606, 607,
 &end
#
#   36 GLN  HB-          36 GLN  HA          3.50    (#    415:25  Unique         2.22, 2.74 A)
 &rst
  ixpk= 415, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 603, 604,
 &end
#
#   36 GLN  HG+          36 GLN  HA          4.50    (#    416:25  Unique         2.31, 3.43 A)
 &rst
  ixpk= 416, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 606, 607,
 &end
#
#   36 GLN  HB+          36 GLN  HA          5.50    (#    417:25  Unique         2.22, 2.74 A)
 &rst
  ixpk= 417, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 603, 604,
 &end
#
#   37 ILE  HB           36 GLN  HA          5.50    (#    418:25  Unique         4.15, 4.31 A)
 &rst
  ixpk= 418, nxpk= 25, iat= 620, 601, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:420      0 AMB  25-1:420    2.80    (#    420:25  Double Ambig)
 &rst
  ixpk= 420, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 429, 430, 429, 430, 314, 315, 432, 433, 432, 433,
       432, 433,
 igr2= 426, 427, 426, 427, 311, 312, 426, 427, 426, 427,
      
 &end
#
#    0 AMB  25-3:422      0 AMB  25-1:422    3.50    (#    422:25  Double Ambig)
 &rst
  ixpk= 422, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 424, 309, 368,
 igr2= 426, 427, 426, 427, 311, 312, 426, 427,
 &end
#
#   22 GLU  HN           19 LYS  HB+         4.50    (#    424:25  Unique         2.04, 3.24 A)
 &rst
  ixpk= 424, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 311, 312,
 &end
#
#    0 AMB  25-3:425      0 AMB  25-1:425    5.50    (#    425:25  Double Ambig)
 &rst
  ixpk= 425, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 307, 444,
 igr2= 311, 312, 426, 427, 426, 427,
 &end
#
#   20 LYS  HN           19 LYS  HB+         5.50    (#    426:25  Unique         2.12, 3.76 A)
 &rst
  ixpk= 426, nxpk= 25, iat= 329,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 311, 312,
 &end
#
#    0 AMB  25-3:427      0 AMB  25-1:427    2.80    (#    427:25  Double Ambig)
 &rst
  ixpk= 427, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 317, 318, 317, 318,
 igr2= 314, 315, 314, 315,
 &end
#
#    0 AMB  25-3:428     19 LYS  HG-         2.80    (#    428:25  Single Ambig)
 &rst
  ixpk= 428, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 317, 318, 317, 318,
 igr2= 314, 315,
 &end
#
#    0 AMB  25-3:429     19 LYS  HG-         3.50    (#    429:25  Single Ambig)
 &rst
  ixpk= 429, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 311, 312, 355, 356, 355, 356,
 igr2= 314, 315,
 &end
#
#    0 AMB  25-3:430      0 AMB  25-1:430    2.80    (#    430:25  Double Ambig)
 &rst
  ixpk= 430, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 426, 427, 426, 427, 311, 312, 355, 356, 355, 356,
      
 igr2= 429, 430, 429, 430, 314, 315, 314, 315, 314, 315,
      
 &end
#
#    0 AMB  25-3:431     19 LYS  HG-         4.50    (#    431:25  Single Ambig)
 &rst
  ixpk= 431, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 320, 321, 320, 321,
 igr2= 314, 315,
 &end
#
#    0 AMB  25-3:432      0 AMB  25-1:432    5.50    (#    432:25  Double Ambig)
 &rst
  ixpk= 432, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 320, 321, 320, 321,
 igr2= 314, 315, 314, 315,
 &end
#
#   19 LYS  HA           19 LYS  HG-         4.50    (#    433:25  Unique         2.37, 2.84 A)
 &rst
  ixpk= 433, nxpk= 25, iat= 309,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 314, 315,
 &end
#
#    0 AMB  25-3:434      0 AMB  25-1:434    4.50    (#    434:25  Double Ambig)
 &rst
  ixpk= 434, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 424, 309,
 igr2= 429, 430, 314, 315,
 &end
#
#   19 LYS  HN           19 LYS  HG-         5.50    (#    436:25  Unique         2.35, 4.22 A)
 &rst
  ixpk= 436, nxpk= 25, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 314, 315,
 &end
#
#    0 AMB  25-3:437      0 AMB  25-1:437    5.50    (#    437:25  Double Ambig)
 &rst
  ixpk= 437, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 307, 444,
 igr2= 314, 315, 429, 430,
 &end
#
#    0 AMB  25-3:438      0 AMB  25-1:438    2.80    (#    438:25  Double Ambig)
 &rst
  ixpk= 438, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 311, 312, 311, 312, 355, 356, 355, 356,
 igr2= 317, 318, 317, 318, 317, 318,
 &end
#
#    0 AMB  25-3:439      0 AMB  25-1:439    2.80    (#    439:25  Double Ambig)
 &rst
  ixpk= 439, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 320, 321, 320, 321, 320, 321,
 igr2= 317, 318, 317, 318, 317, 318,
 &end
#
#   19 LYS  HA            0 AMB  25-1:440    5.50    (#    440:25  Single Ambig)
 &rst
  ixpk= 440, nxpk= 25, iat= 309,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 317, 318, 317, 318,
 &end
#
#   19 LYS  HN            0 AMB  25-1:441    5.50    (#    441:25  Single Ambig)
 &rst
  ixpk= 441, nxpk= 25, iat= 307,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 317, 318, 317, 318,
 &end
#
#    0 AMB  25-3:446      0 AMB  25-1:446    2.80    (#    446:25  Double Ambig)
 &rst
  ixpk= 446, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 317, 318, 317, 318, 317, 318,
 igr2= 320, 321, 320, 321, 320, 321,
 &end
#
#   98 PHE  HN           99 LYS  HE-         7.00    (#    451:25  Unique         5.96, 7.56 A)
 &rst
  ixpk= 451, nxpk= 25, iat=1589,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1622,1623,
 &end
#
#    0 AMB  25-3:453     20 LYS  HA          3.50    (#    453:25  Single Ambig)
 &rst
  ixpk= 453, nxpk= 25, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 336, 337, 388,
 &end
#
#    0 AMB  25-3:454     20 LYS  HA          4.50    (#    454:25  Single Ambig)
 &rst
  ixpk= 454, nxpk= 25, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 339, 340, 407, 408, 314, 315,
 &end
#
#    0 AMB  25-3:455     20 LYS  HA          3.50    (#    455:25  Single Ambig)
 &rst
  ixpk= 455, nxpk= 25, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 385, 386, 333, 334,
 &end
#
#   20 LYS  HB+          20 LYS  HA          4.50    (#    456:25  Unique         2.36, 2.79 A)
 &rst
  ixpk= 456, nxpk= 25, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 333, 334,
 &end
#
#    0 AMB  25-3:457     20 LYS  HA          5.50    (#    457:25  Single Ambig)
 &rst
  ixpk= 457, nxpk= 25, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 311, 312, 370, 371, 370, 371, 355, 356, 355, 356,
      
 &end
#
#    0 AMB  25-3:458     20 LYS  HA          5.50    (#    458:25  Single Ambig)
 &rst
  ixpk= 458, nxpk= 25, iat=  -1, 331, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 381, 400,
 &end
#
#    0 AMB  25-3:459      0 AMB  25-1:459    4.50    (#    459:25  Double Ambig)
 &rst
  ixpk= 459, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 314, 315, 407, 408, 715, 716,
 igr2= 333, 334, 333, 334, 333, 334,
 &end
#
#    0 AMB  25-3:460      0 AMB  25-1:460    4.50    (#    460:25  Double Ambig)
 &rst
  ixpk= 460, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 336, 337, 737, 738,
 igr2= 333, 334, 333, 334,
 &end
#
#    0 AMB  25-3:461     20 LYS  HB-         3.50    (#    461:25  Single Ambig)
 &rst
  ixpk= 461, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 336, 337, 314, 315,
 igr2= 333, 334,
 &end
#
#   20 LYS  HA           20 LYS  HB-         4.50    (#    462:25  Unique         2.36, 2.79 A)
 &rst
  ixpk= 462, nxpk= 25, iat= 331,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 333, 334,
 &end
#
#   20 LYS  HA           20 LYS  HB+         5.50    (#    464:25  Unique         2.36, 2.79 A)
 &rst
  ixpk= 464, nxpk= 25, iat= 331,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 333, 334,
 &end
#
#    0 AMB  25-3:466     58 GLU  HB-         4.50    (#    466:25  Single Ambig)
 &rst
  ixpk= 466, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1004,1005,1007,1008,1009,
 igr2= 983, 984,
 &end
#
#   23 LEU  QD2          20 LYS  HG+         5.50    (#    468:25  Unique         6.72, 7.57 A)
 &rst
  ixpk= 468, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 394, 395, 396,
 igr2= 336, 337,
 &end
#
#    0 AMB  25-3:469      0 AMB  25-1:469    3.50    (#    469:25  Double Ambig)
 &rst
  ixpk= 469, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 333, 334, 404, 405,
 igr2= 336, 337, 336, 337,
 &end
#
#    0 AMB  25-3:470      0 AMB  25-1:470    3.50    (#    470:25  Double Ambig)
 &rst
  ixpk= 470, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 342, 343, 413, 414, 413, 414,
 igr2= 336, 337, 336, 337, 336, 337,
 &end
#
#   77 LYS  HA            0 AMB  25-1:474    5.50    (#    474:25  Single Ambig)
 &rst
  ixpk= 474, nxpk= 25, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1268,1269,1268,1269,
 &end
#
#    0 AMB  25-3:478      0 AMB  25-1:478    5.50    (#    478:25  Double Ambig)
 &rst
  ixpk= 478, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 258, 259, 258, 259,
 igr2= 276, 277, 276, 277,
 &end
#
#    0 AMB  25-3:480      0 AMB  25-1:480    3.50    (#    480:25  Double Ambig)
 &rst
  ixpk= 480, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 687, 309, 268,
 igr2= 339, 340, 339, 340, 339, 340, 276, 277, 276, 277,
      
 &end
#
#   15 ASN  HB-           0 AMB  25-1:483    5.50    (#    483:25  Single Ambig)
 &rst
  ixpk= 483, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 241, 242,
 igr2= 276, 277, 276, 277,
 &end
#
#   72 PHE  HB-          74 PHE  HB-         4.50    (#    485:25  Unique         3.41, 5.48 A)
 &rst
  ixpk= 485, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1178,1179,
 igr2=1212,1213,
 &end
#
#    0 AMB  25-3:486      0 AMB  25-1:486    2.80    (#    486:25  Double Ambig)
 &rst
  ixpk= 486, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 743, 744, 743, 744, 743, 744,
 igr2= 320, 321, 320, 321, 320, 321,
 &end
#
#    0 AMB  25-3:488      0 AMB  25-1:488    2.80    (#    488:25  Double Ambig)
 &rst
  ixpk= 488, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 317, 318, 317, 318, 317, 318,
 igr2= 320, 321, 320, 321, 320, 321,
 &end
#
#  100 GLU  HB-          99 LYS  HE-         4.50    (#    489:25  Unique         2.25, 5.67 A)
 &rst
  ixpk= 489, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1635,1636,
 igr2=1622,1623,
 &end
#
#   21 GLU  HG+          21 GLU  HA          4.50    (#    490:25  Unique         1.99, 3.02 A)
 &rst
  ixpk= 490, nxpk= 25, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 358, 359,
 &end
#
#    0 AMB  25-3:491     21 GLU  HA          2.80    (#    491:25  Single Ambig)
 &rst
  ixpk= 491, nxpk= 25, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 355, 356, 355, 356,
 &end
#
#   24 LYS  HB-          21 GLU  HA          4.50    (#    492:25  Unique         1.88, 3.28 A)
 &rst
  ixpk= 492, nxpk= 25, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 404, 405,
 &end
#
#   21 GLU  HN           21 GLU  HA          5.50    (#    493:25  Unique         2.79, 2.83 A)
 &rst
  ixpk= 493, nxpk= 25, iat= 351, 353, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 LEU  HN           21 GLU  HA          5.50    (#    494:25  Unique         4.19, 4.64 A)
 &rst
  ixpk= 494, nxpk= 25, iat= 381, 353, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:495     21 GLU  HB-         2.80    (#    495:25  Single Ambig)
 &rst
  ixpk= 495, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 358, 359, 358, 359,
 igr2= 355, 356,
 &end
#
#    0 AMB  25-3:496      0 AMB  25-1:496    2.80    (#    496:25  Double Ambig)
 &rst
  ixpk= 496, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 358, 359, 358, 359,
 igr2= 355, 356, 355, 356,
 &end
#
#    0 AMB  25-3:497      0 AMB  25-1:497    2.80    (#    497:25  Double Ambig)
 &rst
  ixpk= 497, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 311, 312, 404, 405, 333, 334,
 igr2= 370, 371, 355, 356, 355, 356, 355, 356,
 &end
#
#    0 AMB  25-3:498      0 AMB  25-1:498    3.50    (#    498:25  Double Ambig)
 &rst
  ixpk= 498, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 404, 405, 333, 334,
 igr2= 355, 356, 370, 371,
 &end
#
#   21 GLU  HA           21 GLU  HB-         2.80    (#    499:25  Unique         2.14, 2.72 A)
 &rst
  ixpk= 499, nxpk= 25, iat= 353,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 355, 356,
 &end
#
#   21 GLU  HA           21 GLU  HB+         2.80    (#    500:25  Unique         2.14, 2.72 A)
 &rst
  ixpk= 500, nxpk= 25, iat= 353,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 355, 356,
 &end
#
#   22 GLU  HN           21 GLU  HB+         4.50    (#    501:25  Unique         2.44, 3.35 A)
 &rst
  ixpk= 501, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 355, 356,
 &end
#
#   21 GLU  HN           21 GLU  HB+         5.50    (#    503:25  Unique         2.11, 2.41 A)
 &rst
  ixpk= 503, nxpk= 25, iat= 351,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 355, 356,
 &end
#
#   21 GLU  HN            0 AMB  25-1:504    5.50    (#    504:25  Single Ambig)
 &rst
  ixpk= 504, nxpk= 25, iat= 351,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 355, 356, 355, 356,
 &end
#
#    0 AMB  25-3:505     21 GLU  HG-         2.80    (#    505:25  Single Ambig)
 &rst
  ixpk= 505, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 355, 356, 355, 356,
 igr2= 358, 359,
 &end
#
#    0 AMB  25-3:506      0 AMB  25-1:506    2.80    (#    506:25  Double Ambig)
 &rst
  ixpk= 506, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 355, 356, 355, 356,
 igr2= 358, 359, 358, 359,
 &end
#
#   22 GLU  HG-          21 GLU  HG-         4.50    (#    509:25  Unique         3.64, 4.99 A)
 &rst
  ixpk= 509, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 373, 374,
 igr2= 358, 359,
 &end
#
#   22 GLU  HG-          21 GLU  HG+         3.50    (#    510:25  Unique         3.64, 4.99 A)
 &rst
  ixpk= 510, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 373, 374,
 igr2= 358, 359,
 &end
#
#   21 GLU  HA           21 GLU  HG-         3.50    (#    511:25  Unique         1.99, 3.02 A)
 &rst
  ixpk= 511, nxpk= 25, iat= 353,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 358, 359,
 &end
#
#    0 AMB  25-3:512      0 AMB  25-1:512    3.50    (#    512:25  Double Ambig)
 &rst
  ixpk= 512, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 353, 850, 851, 253,
 igr2= 358, 359, 258, 259, 258, 259,
 &end
#
#    0 AMB  25-3:516      0 AMB  25-1:516    3.50    (#    516:25  Double Ambig)
 &rst
  ixpk= 516, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1035,1036,1037, 432, 433, 432, 433, 429, 430,
 igr2= 102, 368,
 &end
#
#    0 AMB  25-3:517     22 GLU  HA          2.80    (#    517:25  Single Ambig)
 &rst
  ixpk= 517, nxpk= 25, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 370, 371, 370, 371, 426, 427, 426, 427,
 &end
#
#   22 GLU  HG-          22 GLU  HA          4.50    (#    518:25  Unique         2.51, 2.89 A)
 &rst
  ixpk= 518, nxpk= 25, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 373, 374,
 &end
#
#    0 AMB  25-3:519     22 GLU  HA          3.50    (#    519:25  Single Ambig)
 &rst
  ixpk= 519, nxpk= 25, iat=  -1, 368, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 373, 374, 358, 359,
 &end
#
#   22 GLU  HN           22 GLU  HA          4.50    (#    520:25  Unique         2.86, 2.87 A)
 &rst
  ixpk= 520, nxpk= 25, iat= 366, 368, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   23 LEU  HN           22 GLU  HA          4.50    (#    521:25  Unique         3.56, 3.58 A)
 &rst
  ixpk= 521, nxpk= 25, iat= 381, 368, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   25 LYS  HN           22 GLU  HA          4.50    (#    522:25  Unique         3.32, 3.54 A)
 &rst
  ixpk= 522, nxpk= 25, iat= 422, 368, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   20 LYS  HN           22 GLU  HA          7.00    (#    523:25  Unique         6.89, 7.06 A)
 &rst
  ixpk= 523, nxpk= 25, iat= 329, 368, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   18 ILE  QG2          22 GLU  HB+         5.50    (#    524:25  Unique         2.27, 3.25 A)
 &rst
  ixpk= 524, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 294, 295, 296,
 igr2= 370, 371,
 &end
#
#   18 ILE  QG2          22 GLU  HB-         5.50    (#    525:25  Unique         2.27, 3.25 A)
 &rst
  ixpk= 525, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 294, 295, 296,
 igr2= 370, 371,
 &end
#
#    0 AMB  25-3:526      0 AMB  25-1:526    4.50    (#    526:25  Double Ambig)
 &rst
  ixpk= 526, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.80, r4= 9.30,
 igr1= 385, 386, 336, 337, 292, 429, 430,
 igr2= 370, 371, 355, 356, 370, 371, 370, 371,
 &end
#
#    0 AMB  25-3:527      0 AMB  25-1:527    4.50    (#    527:25  Double Ambig)
 &rst
  ixpk= 527, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.49, r4= 9.99,
 igr1= 385, 386, 292,1271,1272,1335, 429, 430,  79,  80,
       388,
 igr2= 370, 371, 255, 256,1318,1319, 104, 105,
 &end
#
#    0 AMB  25-3:528      0 AMB  25-1:528    2.80    (#    528:25  Double Ambig)
 &rst
  ixpk= 528, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 373, 374, 107, 108,
 igr2= 370, 371, 104, 105,
 &end
#
#    0 AMB  25-3:529      0 AMB  25-1:529    2.80    (#    529:25  Double Ambig)
 &rst
  ixpk= 529, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 358, 359, 373, 374, 107, 108,
 igr2= 355, 356, 370, 371, 104, 105,
 &end
#
#    0 AMB  25-3:530      0 AMB  25-1:530    2.80    (#    530:25  Double Ambig)
 &rst
  ixpk= 530, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 358, 359, 373, 374, 107, 108,
 igr2= 355, 356, 370, 371, 104, 105,
 &end
#
#    0 AMB  25-3:531      0 AMB  25-1:531    2.80    (#    531:25  Double Ambig)
 &rst
  ixpk= 531, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 373, 374, 107, 108,
 igr2= 370, 371, 104, 105,
 &end
#
#    0 AMB  25-3:532      0 AMB  25-1:532    3.50    (#    532:25  Double Ambig)
 &rst
  ixpk= 532, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.44, r4= 8.94,
 igr1= 314, 315, 831, 832,1035,1036,1037, 276, 277, 276,
       277, 998, 314, 315,
 igr2= 355, 356, 255, 256, 104, 105, 255, 256, 255, 256,
       104, 105, 370, 371,
 &end
#
#    0 AMB  25-3:533      0 AMB  25-1:533    4.50    (#    533:25  Double Ambig)
 &rst
  ixpk= 533, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 314, 315,1035,1036,1037, 998, 314, 315,
 igr2= 355, 356, 104, 105, 370, 371,
 &end
#
#    0 AMB  25-3:534      0 AMB  25-1:534    3.50    (#    534:25  Double Ambig)
 &rst
  ixpk= 534, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 102, 368,
 igr2= 104, 105, 370, 371,
 &end
#
#    0 AMB  25-3:535      0 AMB  25-1:535    4.50    (#    535:25  Double Ambig)
 &rst
  ixpk= 535, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 102, 368, 268,
 igr2= 104, 105, 370, 371, 255, 256,
 &end
#
#   22 GLU  HN           22 GLU  HB+         3.50    (#    538:25  Unique         2.07, 2.97 A)
 &rst
  ixpk= 538, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 370, 371,
 &end
#
#   22 GLU  HN            0 AMB  25-1:539    4.50    (#    539:25  Single Ambig)
 &rst
  ixpk= 539, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 370, 371, 355, 356,
 &end
#
#    0 AMB  25-3:540      0 AMB  25-1:540    5.50    (#    540:25  Double Ambig)
 &rst
  ixpk= 540, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 100, 381, 266,
 igr2= 104, 105, 370, 371, 255, 256,
 &end
#
#    0 AMB  25-3:541      0 AMB  25-1:541    4.50    (#    541:25  Double Ambig)
 &rst
  ixpk= 541, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 100, 381, 266,
 igr2= 104, 105, 370, 371, 255, 256,
 &end
#
#    8 THR  HN            7 GLN  HB+         5.50    (#    542:25  Unique         2.78, 3.78 A)
 &rst
  ixpk= 542, nxpk= 25, iat= 117,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 104, 105,
 &end
#
#    0 AMB  25-3:543     23 LEU  HA          4.50    (#    543:25  Single Ambig)
 &rst
  ixpk= 543, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 381, 400,
 &end
#
#   75 TYR  QE           23 LEU  HA          5.50    (#    545:25  Unique         3.35, 5.42 A)
 &rst
  ixpk= 545, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1238,1243,
 &end
#
#    0 AMB  25-3:547     23 LEU  HA          5.50    (#    547:25  Single Ambig)
 &rst
  ixpk= 547, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 457, 424, 309,
 &end
#
#   23 LEU  HB+          23 LEU  HA          3.50    (#    548:25  Unique         1.97, 2.70 A)
 &rst
  ixpk= 548, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 385, 386,
 &end
#
#   23 LEU  HB-          23 LEU  HA          3.50    (#    549:25  Unique         1.97, 2.70 A)
 &rst
  ixpk= 549, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 385, 386,
 &end
#
#   23 LEU  QD1          23 LEU  HA          4.50    (#    551:25  Unique         3.67, 4.36 A)
 &rst
  ixpk= 551, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 390, 391, 392,
 &end
#
#   23 LEU  QD2          23 LEU  HA          4.50    (#    552:25  Unique         2.47, 3.17 A)
 &rst
  ixpk= 552, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 394, 395, 396,
 &end
#
#   18 ILE  QG2          23 LEU  HA          4.50    (#    553:25  Unique         2.98, 3.66 A)
 &rst
  ixpk= 553, nxpk= 25, iat=  -1, 383, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 294, 295, 296,
 &end
#
#   57 LYS  HB+          57 LYS  HA          5.50    (#    554:25  Unique         2.35, 2.49 A)
 &rst
  ixpk= 554, nxpk= 25, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 961, 962,
 &end
#
#   26 SER  HA           23 LEU  HA          5.50    (#    555:25  Unique         5.36, 5.56 A)
 &rst
  ixpk= 555, nxpk= 25, iat= 446, 383, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 LEU  QD1          23 LEU  HB+         4.50    (#    556:25  Unique         2.37, 3.51 A)
 &rst
  ixpk= 556, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 390, 391, 392,
 igr2= 385, 386,
 &end
#
#   23 LEU  QD1          23 LEU  HB-         4.50    (#    557:25  Unique         2.37, 3.51 A)
 &rst
  ixpk= 557, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 390, 391, 392,
 igr2= 385, 386,
 &end
#
#   20 LYS  HA           23 LEU  HB+         4.50    (#    558:25  Unique         2.28, 3.17 A)
 &rst
  ixpk= 558, nxpk= 25, iat= 331,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 385, 386,
 &end
#
#   23 LEU  HA           23 LEU  HB+         5.50    (#    559:25  Unique         1.97, 2.70 A)
 &rst
  ixpk= 559, nxpk= 25, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 385, 386,
 &end
#
#   23 LEU  HA           23 LEU  HB-         4.50    (#    560:25  Unique         1.97, 2.70 A)
 &rst
  ixpk= 560, nxpk= 25, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 385, 386,
 &end
#
#   20 LYS  HA           23 LEU  HB-         5.50    (#    561:25  Unique         2.28, 3.17 A)
 &rst
  ixpk= 561, nxpk= 25, iat= 331,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 385, 386,
 &end
#
#   23 LEU  HN           23 LEU  HB-         4.50    (#    562:25  Unique         1.86, 2.40 A)
 &rst
  ixpk= 562, nxpk= 25, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 385, 386,
 &end
#
#   23 LEU  HN           23 LEU  HB+         4.50    (#    563:25  Unique         1.86, 2.40 A)
 &rst
  ixpk= 563, nxpk= 25, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 385, 386,
 &end
#
#    0 AMB  25-3:564     23 LEU  HB-         5.50    (#    564:25  Single Ambig)
 &rst
  ixpk= 564, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.21, r4= 9.71,
 igr1= 370, 371, 370, 371, 462, 311, 312, 355, 356, 355,
       356,
 igr2= 385, 386,
 &end
#
#   23 LEU  QD2          23 LEU  HB-         5.50    (#    565:25  Unique         2.35, 3.57 A)
 &rst
  ixpk= 565, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 394, 395, 396,
 igr2= 385, 386,
 &end
#
#   23 LEU  QD2          23 LEU  HB+         5.50    (#    566:25  Unique         2.35, 3.57 A)
 &rst
  ixpk= 566, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 394, 395, 396,
 igr2= 385, 386,
 &end
#
#   23 LEU  QD1          23 LEU  HG          2.80    (#    567:25  Unique         2.05, 2.62 A)
 &rst
  ixpk= 567, nxpk= 25, iat=  -1, 388, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 390, 391, 392,
 &end
#
#   23 LEU  QD2          23 LEU  HG          4.50    (#    568:25  Unique         2.26, 2.65 A)
 &rst
  ixpk= 568, nxpk= 25, iat=  -1, 388, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 394, 395, 396,
 &end
#
#    0 AMB  25-3:569     23 LEU  HG          5.50    (#    569:25  Single Ambig)
 &rst
  ixpk= 569, nxpk= 25, iat=  -1, 388, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 294, 295, 296, 184, 185, 186,
 &end
#
#   23 LEU  HB+          23 LEU  HG          4.50    (#    570:25  Unique         2.28, 2.40 A)
 &rst
  ixpk= 570, nxpk= 25, iat=  -1, 388, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 385, 386,
 &end
#
#   23 LEU  HA           23 LEU  HG          5.50    (#    571:25  Unique         3.78, 3.89 A)
 &rst
  ixpk= 571, nxpk= 25, iat= 383, 388, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 LEU  HN           23 LEU  HG          5.50    (#    572:25  Unique         4.09, 4.43 A)
 &rst
  ixpk= 572, nxpk= 25, iat= 381, 388, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   42 ALA  HN           23 LEU  HG          5.50    (#    573:25  Unique         5.40, 5.57 A)
 &rst
  ixpk= 573, nxpk= 25, iat= 701, 388, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:574      0 AMB  25-1:574    2.80    (#    574:25  Double Ambig)
 &rst
  ixpk= 574, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 igr2= 298, 299, 298, 299, 390, 391, 392,
 &end
#
#   42 ALA  QB           23 LEU  QD1         3.50    (#    575:25  Unique         2.31, 3.58 A)
 &rst
  ixpk= 575, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 705, 706, 707,
 igr2= 390, 391, 392,
 &end
#
#   17 LYS  HG-          18 ILE  HG1+        3.50    (#    576:25  Unique         2.77, 4.83 A)
 &rst
  ixpk= 576, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 273, 274,
 igr2= 298, 299,
 &end
#
#    0 AMB  25-3:577      0 AMB  25-1:577    2.80    (#    577:25  Double Ambig)
 &rst
  ixpk= 577, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
 igr1= 388, 292, 336, 337,
 igr2= 390, 391, 392, 298, 299,
 &end
#
#    0 AMB  25-3:578     23 LEU  QD1         3.50    (#    578:25  Single Ambig)
 &rst
  ixpk= 578, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 385, 386, 333, 334, 410, 411,
 igr2= 390, 391, 392,
 &end
#
#    0 AMB  25-3:579      0 AMB  25-1:579    4.50    (#    579:25  Double Ambig)
 &rst
  ixpk= 579, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 462, 818, 819, 820,
 igr2= 390, 391, 392, 720, 721, 722, 724, 725, 726,
 &end
#
#    0 AMB  25-3:580      0 AMB  25-1:580    5.50    (#    580:25  Double Ambig)
 &rst
  ixpk= 580, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 290, 331,
 igr2= 298, 299, 390, 391, 392,
 &end
#
#    0 AMB  25-3:581      0 AMB  25-1:581    4.50    (#    581:25  Double Ambig)
 &rst
  ixpk= 581, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
 igr1= 383, 850, 851,
 igr2= 390, 391, 392, 298, 299, 298, 299,
 &end
#
#   18 ILE  HN           18 ILE  HG1+        5.50    (#    583:25  Unique         2.04, 2.89 A)
 &rst
  ixpk= 583, nxpk= 25, iat= 288,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 298, 299,
 &end
#
#    0 AMB  25-3:584      0 AMB  25-1:584    4.50    (#    584:25  Double Ambig)
 &rst
  ixpk= 584, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 400, 266,
 igr2= 390, 391, 392, 298, 299,
 &end
#
#   74 PHE  QD           18 ILE  HG1+        5.50    (#    585:25  Unique         3.88, 7.53 A)
 &rst
  ixpk= 585, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1216,1224,
 igr2= 298, 299,
 &end
#
#   74 PHE  QE            0 AMB  25-1:586    5.50    (#    586:25  Single Ambig)
 &rst
  ixpk= 586, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1218,1222,
 igr2= 298, 299, 390, 391, 392,
 &end
#
#    0 AMB  25-3:587     23 LEU  QD2         4.50    (#    587:25  Single Ambig)
 &rst
  ixpk= 587, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 181, 182, 298, 299,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:588     23 LEU  QD2         3.50    (#    588:25  Single Ambig)
 &rst
  ixpk= 588, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:589     23 LEU  QD2         4.50    (#    589:25  Single Ambig)
 &rst
  ixpk= 589, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 184, 185, 186, 294, 295, 296,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:591     23 LEU  QD2         3.50    (#    591:25  Single Ambig)
 &rst
  ixpk= 591, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 705, 706, 707, 222, 223,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:592     23 LEU  QD2         4.50    (#    592:25  Single Ambig)
 &rst
  ixpk= 592, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 459, 460, 222, 223,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:593      0 AMB  25-1:593    2.80    (#    593:25  Double Ambig)
 &rst
  ixpk= 593, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 388, 792, 793, 795, 796, 795, 796,
 igr2= 394, 395, 396, 775, 776, 777,
 &end
#
#    0 AMB  25-3:594     46 LEU  QD1         2.80    (#    594:25  Single Ambig)
 &rst
  ixpk= 594, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 770, 771, 773,
 igr2= 775, 776, 777,
 &end
#
#   23 LEU  HA           23 LEU  QD2         3.50    (#    595:25  Unique         2.47, 3.17 A)
 &rst
  ixpk= 595, nxpk= 25, iat= 383,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:596     23 LEU  QD2         5.50    (#    596:25  Single Ambig)
 &rst
  ixpk= 596, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 402, 331,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:597     46 LEU  QD1         4.50    (#    597:25  Single Ambig)
 &rst
  ixpk= 597, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 768, 787,
 igr2= 775, 776, 777,
 &end
#
#   74 PHE  QE           23 LEU  QD2         3.50    (#    599:25  Unique         2.33, 4.66 A)
 &rst
  ixpk= 599, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1218,1222,
 igr2= 394, 395, 396,
 &end
#
#   23 LEU  HN           23 LEU  QD2         5.50    (#    601:25  Unique         4.65, 5.19 A)
 &rst
  ixpk= 601, nxpk= 25, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 394, 395, 396,
 &end
#
#   27 LEU  HN           23 LEU  QD2         5.50    (#    602:25  Unique         3.33, 4.85 A)
 &rst
  ixpk= 602, nxpk= 25, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 394, 395, 396,
 &end
#
#    0 AMB  25-3:604      0 AMB  25-1:604    5.50    (#    604:25  Double Ambig)
 &rst
  ixpk= 604, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 462, 255, 256,
 igr2= 394, 395, 396, 775, 776, 777,
 &end
#
#    0 AMB  25-3:605     24 LYS  HA          4.50    (#    605:25  Single Ambig)
 &rst
  ixpk= 605, nxpk= 25, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 679, 680, 681, 672, 673, 674,
 &end
#
#   27 LEU  HB-          24 LYS  HA          5.50    (#    606:25  Unique         2.59, 3.64 A)
 &rst
  ixpk= 606, nxpk= 25, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 459, 460,
 &end
#
#   24 LYS  HG-          24 LYS  HA          4.50    (#    607:25  Unique         2.31, 2.77 A)
 &rst
  ixpk= 607, nxpk= 25, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 407, 408,
 &end
#
#   24 LYS  HG+          24 LYS  HA          4.50    (#    608:25  Unique         2.31, 2.77 A)
 &rst
  ixpk= 608, nxpk= 25, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 407, 408,
 &end
#
#    0 AMB  25-3:609     24 LYS  HA          3.50    (#    609:25  Single Ambig)
 &rst
  ixpk= 609, nxpk= 25, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 404, 405, 404, 405,
 &end
#
#    0 AMB  25-3:610     24 LYS  HA          5.50    (#    610:25  Single Ambig)
 &rst
  ixpk= 610, nxpk= 25, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 410, 411, 410, 411, 385, 386, 626, 627,
 &end
#
#   27 LEU  HB+          24 LYS  HA          5.50    (#    611:25  Unique         2.59, 3.64 A)
 &rst
  ixpk= 611, nxpk= 25, iat=  -1, 402, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 459, 460,
 &end
#
#   25 LYS  HN           24 LYS  HA          5.50    (#    612:25  Unique         3.58, 3.64 A)
 &rst
  ixpk= 612, nxpk= 25, iat= 422, 402, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 LYS  HN           24 LYS  HA          4.50    (#    613:25  Unique         2.71, 2.82 A)
 &rst
  ixpk= 613, nxpk= 25, iat= 400, 402, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 LEU  HN           24 LYS  HA          5.50    (#    614:25  Unique         3.57, 3.69 A)
 &rst
  ixpk= 614, nxpk= 25, iat= 455, 402, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 LYS  HA           24 LYS  HB+         4.50    (#    615:25  Unique         2.45, 2.81 A)
 &rst
  ixpk= 615, nxpk= 25, iat= 402,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 404, 405,
 &end
#
#    0 AMB  25-3:617      0 AMB  25-1:617    5.50    (#    617:25  Double Ambig)
 &rst
  ixpk= 617, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.17, r4=10.67,
 igr1= 424, 368, 768, 687,
 igr2= 404, 405, 404, 405, 811, 812, 811, 812, 404, 405,
      
 &end
#
#    0 AMB  25-3:618      0 AMB  25-1:618    4.50    (#    618:25  Double Ambig)
 &rst
  ixpk= 618, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 787, 268,
 igr2= 789, 790, 270, 271,
 &end
#
#    0 AMB  25-3:619      0 AMB  25-1:619    4.50    (#    619:25  Double Ambig)
 &rst
  ixpk= 619, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 867, 868, 422,
 igr2= 789, 790, 404, 405,
 &end
#
#   25 LYS  HN           24 LYS  HB+         4.50    (#    620:25  Unique         2.43, 3.08 A)
 &rst
  ixpk= 620, nxpk= 25, iat= 422,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 404, 405,
 &end
#
#    0 AMB  25-3:621      0 AMB  25-1:621    4.50    (#    621:25  Double Ambig)
 &rst
  ixpk= 621, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 266, 400,
 igr2= 270, 271, 404, 405,
 &end
#
#   24 LYS  HN           24 LYS  HB+         4.50    (#    622:25  Unique         2.32, 2.71 A)
 &rst
  ixpk= 622, nxpk= 25, iat= 400,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 404, 405,
 &end
#
#    0 AMB  25-3:623     24 LYS  HG-         3.50    (#    623:25  Single Ambig)
 &rst
  ixpk= 623, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 410, 411, 410, 411,
 igr2= 407, 408,
 &end
#
#    0 AMB  25-3:625      0 AMB  25-1:625    5.50    (#    625:25  Double Ambig)
 &rst
  ixpk= 625, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 413, 414, 413, 414,
 igr2= 407, 408, 407, 408,
 &end
#
#    0 AMB  25-3:627     24 LYS  HG-         5.50    (#    627:25  Single Ambig)
 &rst
  ixpk= 627, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 402, 331,
 igr2= 407, 408,
 &end
#
#    0 AMB  25-3:628     24 LYS  HG-         4.50    (#    628:25  Single Ambig)
 &rst
  ixpk= 628, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 672, 673, 674, 679, 680, 681,
 igr2= 407, 408,
 &end
#
#    0 AMB  25-3:629      0 AMB  25-1:629    2.80    (#    629:25  Double Ambig)
 &rst
  ixpk= 629, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 320, 321, 320, 321, 320, 321,
 igr2= 317, 318, 317, 318, 317, 318,
 &end
#
#   21 GLU  HB-           0 AMB  25-1:630    3.50    (#    630:25  Single Ambig)
 &rst
  ixpk= 630, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 355, 356,
 igr2= 317, 318, 317, 318,
 &end
#
#   24 LYS  HG-           0 AMB  25-1:631    3.50    (#    631:25  Single Ambig)
 &rst
  ixpk= 631, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 407, 408,
 igr2= 410, 411, 410, 411,
 &end
#
#   42 ALA  HN            0 AMB  25-1:633    5.50    (#    633:25  Single Ambig)
 &rst
  ixpk= 633, nxpk= 25, iat= 701,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 410, 411, 410, 411,
 &end
#
#   24 LYS  HN            0 AMB  25-1:634    5.50    (#    634:25  Single Ambig)
 &rst
  ixpk= 634, nxpk= 25, iat= 400,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 410, 411, 410, 411,
 &end
#
#   21 GLU  HA            0 AMB  25-1:636    5.50    (#    636:25  Single Ambig)
 &rst
  ixpk= 636, nxpk= 25, iat= 353,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 410, 411, 410, 411,
 &end
#
#   21 GLU  HA            0 AMB  25-1:637    5.50    (#    637:25  Single Ambig)
 &rst
  ixpk= 637, nxpk= 25, iat= 353,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 413, 414, 413, 414,
 &end
#
#    0 AMB  25-3:639      0 AMB  25-1:639    4.50    (#    639:25  Double Ambig)
 &rst
  ixpk= 639, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 941, 942, 941, 942,
 igr2= 970, 971, 970, 971,
 &end
#
#    0 AMB  25-3:641      0 AMB  25-1:641    5.50    (#    641:25  Double Ambig)
 &rst
  ixpk= 641, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 679, 680, 681, 672, 673, 674,
 igr2= 413, 414, 413, 414, 413, 414,
 &end
#
#   24 LYS  HG-           0 AMB  25-1:642    4.50    (#    642:25  Single Ambig)
 &rst
  ixpk= 642, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 407, 408,
 igr2= 413, 414, 413, 414,
 &end
#
#   25 LYS  HN           25 LYS  HA          4.50    (#    643:25  Unique         2.75, 2.81 A)
 &rst
  ixpk= 643, nxpk= 25, iat= 422, 424, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   25 LYS  HG-           0 AMB  25-1:644    4.50    (#    644:25  Single Ambig)
 &rst
  ixpk= 644, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 429, 430,
 igr2= 426, 427, 426, 427,
 &end
#
#    0 AMB  25-3:645      0 AMB  25-1:645    5.50    (#    645:25  Double Ambig)
 &rst
  ixpk= 645, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 381, 400, 524,
 igr2= 311, 312, 426, 427, 426, 427,1140,1141, 426, 427,
       311, 312,
 &end
#
#    0 AMB  25-3:646      0 AMB  25-1:646    3.50    (#    646:25  Double Ambig)
 &rst
  ixpk= 646, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 422, 532, 540,
 igr2= 426, 427, 426, 427,1140,1141,
 &end
#
#    0 AMB  25-3:647      0 AMB  25-1:647    3.50    (#    647:25  Double Ambig)
 &rst
  ixpk= 647, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 424, 309, 368,
 igr2= 426, 427, 426, 427, 311, 312, 426, 427,
 &end
#
#    0 AMB  25-3:648      0 AMB  25-1:648    2.80    (#    648:25  Double Ambig)
 &rst
  ixpk= 648, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 426, 427, 426, 427, 311, 312, 355, 356, 355, 356,
      
 igr2= 429, 430, 429, 430, 314, 315, 314, 315, 314, 315,
      
 &end
#
#    0 AMB  25-3:649     25 LYS  HG-         2.80    (#    649:25  Single Ambig)
 &rst
  ixpk= 649, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 426, 427, 426, 427,
 igr2= 429, 430,
 &end
#
#    0 AMB  25-3:650     25 LYS  HG-         4.50    (#    650:25  Single Ambig)
 &rst
  ixpk= 650, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 435, 436, 435, 436,
 igr2= 429, 430,
 &end
#
#    0 AMB  25-3:651      0 AMB  25-1:651    5.50    (#    651:25  Double Ambig)
 &rst
  ixpk= 651, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.00, r4=11.50,
 igr1= 435, 436, 435, 436, 743, 744, 743, 744,
 igr2= 429, 430, 429, 430, 314, 315, 314, 315,
 &end
#
#    0 AMB  25-3:652      0 AMB  25-1:652    4.50    (#    652:25  Double Ambig)
 &rst
  ixpk= 652, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 424, 309,
 igr2= 429, 430, 314, 315,
 &end
#
#    0 AMB  25-3:653     25 LYS  HG-         4.50    (#    653:25  Single Ambig)
 &rst
  ixpk= 653, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 424, 368,
 igr2= 429, 430,
 &end
#
#   25 LYS  HN           25 LYS  HG+         5.50    (#    654:25  Unique         2.45, 4.06 A)
 &rst
  ixpk= 654, nxpk= 25, iat= 422,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 429, 430,
 &end
#
#   25 LYS  HN           25 LYS  HG-         5.50    (#    655:25  Unique         2.45, 4.06 A)
 &rst
  ixpk= 655, nxpk= 25, iat= 422,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 429, 430,
 &end
#
#    0 AMB  25-3:659     25 LYS  HD-         2.80    (#    659:25  Single Ambig)
 &rst
  ixpk= 659, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 435, 436, 435, 436,
 igr2= 432, 433,
 &end
#
#    0 AMB  25-3:661      0 AMB  25-1:661    3.50    (#    661:25  Double Ambig)
 &rst
  ixpk= 661, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
 igr1= 961, 962, 961, 962, 603, 604, 426, 427,
 igr2= 967, 968, 967, 968, 967, 968, 432, 433,
 &end
#
#   25 LYS  HB+          25 LYS  HD-         2.80    (#    662:25  Unique         2.38, 3.17 A)
 &rst
  ixpk= 662, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 426, 427,
 igr2= 432, 433,
 &end
#
#    0 AMB  25-3:664      0 AMB  25-1:664    2.80    (#    664:25  Double Ambig)
 &rst
  ixpk= 664, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 737, 738, 429, 430,
 igr2= 740, 741, 740, 741, 432, 433,
 &end
#
#    0 AMB  25-3:665      0 AMB  25-1:665    4.50    (#    665:25  Double Ambig)
 &rst
  ixpk= 665, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 732, 446,
 igr2= 740, 741, 740, 741, 432, 433,
 &end
#
#    0 AMB  25-3:666      0 AMB  25-1:666    4.50    (#    666:25  Double Ambig)
 &rst
  ixpk= 666, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 424, 309,
 igr2= 432, 433, 740, 741, 740, 741,
 &end
#
#    0 AMB  25-3:669      0 AMB  25-1:669    4.50    (#    669:25  Double Ambig)
 &rst
  ixpk= 669, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.30, r4=10.80,
 igr1= 478, 479, 478, 479, 941, 942, 941, 942, 478, 479,
       478, 479,
 igr2= 435, 436, 435, 436, 970, 971, 970, 971, 413, 414,
       413, 414,
 &end
#
#   15 ASN  HB-           0 AMB  25-1:670    3.50    (#    670:25  Single Ambig)
 &rst
  ixpk= 670, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 241, 242,
 igr2= 279, 280, 279, 280,
 &end
#
#    0 AMB  25-3:673     26 SER  HA          4.50    (#    673:25  Single Ambig)
 &rst
  ixpk= 673, nxpk= 25, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 448, 449, 448, 449,
 &end
#
#   24 LYS  HA           26 SER  HA          7.00    (#    674:25  Unique         6.65, 6.74 A)
 &rst
  ixpk= 674, nxpk= 25, iat= 402, 446, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   75 TYR  QE           26 SER  HA          5.50    (#    675:25  Unique         4.84, 6.41 A)
 &rst
  ixpk= 675, nxpk= 25, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1238,1243,
 &end
#
#   26 SER  HN           26 SER  HA          5.50    (#    677:25  Unique         2.81, 2.84 A)
 &rst
  ixpk= 677, nxpk= 25, iat= 444, 446, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:679     26 SER  HA          5.50    (#    679:25  Single Ambig)
 &rst
  ixpk= 679, nxpk= 25, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 435, 436, 435, 436,
 &end
#
#   27 LEU  HB+          26 SER  HA          5.50    (#    680:25  Unique         5.67, 6.18 A)
 &rst
  ixpk= 680, nxpk= 25, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 459, 460,
 &end
#
#    0 AMB  25-3:681     26 SER  HA          4.50    (#    681:25  Single Ambig)
 &rst
  ixpk= 681, nxpk= 25, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 499, 500, 501, 432, 433, 429, 430,
 &end
#
#    0 AMB  25-3:682     26 SER  HA          5.50    (#    682:25  Single Ambig)
 &rst
  ixpk= 682, nxpk= 25, iat=  -1, 446, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 426, 427, 462, 370, 371,
 &end
#
#   26 SER  HA            0 AMB  25-1:684    3.50    (#    684:25  Single Ambig)
 &rst
  ixpk= 684, nxpk= 25, iat= 446,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 448, 449, 448, 449,
 &end
#
#   74 PHE  QE            0 AMB  25-1:688    4.50    (#    688:25  Single Ambig)
 &rst
  ixpk= 688, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1218,1222,
 igr2= 448, 449, 448, 449,
 &end
#
#   22 GLU  HN            0 AMB  25-1:689    7.00    (#    689:25  Single Ambig)
 &rst
  ixpk= 689, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2= 448, 449, 448, 449,
 &end
#
#   27 LEU  HN           27 LEU  HA          5.50    (#    693:25  Unique         2.84, 2.87 A)
 &rst
  ixpk= 693, nxpk= 25, iat= 455, 457, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   74 PHE  QE           27 LEU  HA          5.50    (#    694:25  Unique         2.41, 4.53 A)
 &rst
  ixpk= 694, nxpk= 25, iat=  -1, 457, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1218,1222,
 &end
#
#   27 LEU  HB+          27 LEU  HA          3.50    (#    695:25  Unique         2.56, 2.83 A)
 &rst
  ixpk= 695, nxpk= 25, iat=  -1, 457, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 459, 460,
 &end
#
#    0 AMB  25-3:696      0 AMB  25-1:696    3.50    (#    696:25  Double Ambig)
 &rst
  ixpk= 696, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
 igr1= 104, 105, 370, 371, 426, 427, 426, 427, 462,
 igr2= 102, 368, 457,
 &end
#
#   27 LEU  HB-          27 LEU  HA          5.50    (#    698:25  Unique         2.56, 2.83 A)
 &rst
  ixpk= 698, nxpk= 25, iat=  -1, 457, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 459, 460,
 &end
#
#   23 LEU  QD1          27 LEU  HA          7.00    (#    699:25  Unique         5.32, 6.95 A)
 &rst
  ixpk= 699, nxpk= 25, iat=  -1, 457, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 390, 391, 392,
 &end
#
#   27 LEU  QD2          27 LEU  HA          3.50    (#    700:25  Unique         1.98, 2.96 A)
 &rst
  ixpk= 700, nxpk= 25, iat=  -1, 457, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 468, 469, 470,
 &end
#
#    0 AMB  25-3:701      0 AMB  25-1:701    5.50    (#    701:25  Double Ambig)
 &rst
  ixpk= 701, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 994, 444,1013,
 igr2= 102, 457,
 &end
#
#    0 AMB  25-3:702      0 AMB  25-1:702    4.50    (#    702:25  Double Ambig)
 &rst
  ixpk= 702, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 468, 469, 470, 464, 465, 466,
 igr2= 459, 460, 459, 460,
 &end
#
#    0 AMB  25-3:703     27 LEU  HB-         4.50    (#    703:25  Single Ambig)
 &rst
  ixpk= 703, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 468, 469, 470, 464, 465, 466,
 igr2= 459, 460,
 &end
#
#    0 AMB  25-3:704      0 AMB  25-1:704    4.50    (#    704:25  Double Ambig)
 &rst
  ixpk= 704, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 402, 476,
 igr2= 459, 460, 459, 460,
 &end
#
#   27 LEU  HN           27 LEU  HB+         5.50    (#    705:25  Unique         2.22, 2.94 A)
 &rst
  ixpk= 705, nxpk= 25, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 459, 460,
 &end
#
#   27 LEU  HN           27 LEU  HB-         5.50    (#    706:25  Unique         2.22, 2.94 A)
 &rst
  ixpk= 706, nxpk= 25, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 459, 460,
 &end
#
#    0 AMB  25-3:707     27 LEU  HG          3.50    (#    707:25  Single Ambig)
 &rst
  ixpk= 707, nxpk= 25, iat=  -1, 462, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 468, 469, 470, 464, 465, 466,
 &end
#
#   74 PHE  QE           27 LEU  HG          5.50    (#    708:25  Unique         2.89, 4.12 A)
 &rst
  ixpk= 708, nxpk= 25, iat=  -1, 462, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1218,1222,
 &end
#
#   54 VAL  QG-          27 LEU  QD1         5.50    (#    709:25  Unique         2.19, 4.36 A)
 &rst
  ixpk= 709, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 464, 465, 466,
 &end
#
#    0 AMB  25-3:710     27 LEU  QD1         3.50    (#    710:25  Single Ambig)
 &rst
  ixpk= 710, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 672, 673, 674, 679, 680, 681,
 igr2= 464, 465, 466,
 &end
#
#   23 LEU  QD1          27 LEU  QD1         4.50    (#    711:25  Unique         2.10, 3.67 A)
 &rst
  ixpk= 711, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 390, 391, 392,
 igr2= 464, 465, 466,
 &end
#
#   52 ALA  QB           27 LEU  QD1         3.50    (#    712:25  Unique         3.09, 4.73 A)
 &rst
  ixpk= 712, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 876, 877, 878,
 igr2= 464, 465, 466,
 &end
#
#    0 AMB  25-3:713     27 LEU  QD1         5.50    (#    713:25  Single Ambig)
 &rst
  ixpk= 713, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 676, 677, 676, 677,
 igr2= 464, 465, 466,
 &end
#
#   27 LEU  HG           27 LEU  QD1         4.50    (#    714:25  Unique         2.38, 2.66 A)
 &rst
  ixpk= 714, nxpk= 25, iat= 462,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 464, 465, 466,
 &end
#
#   27 LEU  HB+          27 LEU  QD1         5.50    (#    715:25  Unique         2.28, 3.07 A)
 &rst
  ixpk= 715, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 459, 460,
 igr2= 464, 465, 466,
 &end
#
#   24 LYS  HA           27 LEU  QD1         5.50    (#    716:25  Unique         2.91, 4.22 A)
 &rst
  ixpk= 716, nxpk= 25, iat= 402,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 464, 465, 466,
 &end
#
#    0 AMB  25-3:717     27 LEU  QD1         5.50    (#    717:25  Single Ambig)
 &rst
  ixpk= 717, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 457, 687,
 igr2= 464, 465, 466,
 &end
#
#   74 PHE  QE           27 LEU  QD1         5.50    (#    718:25  Unique         4.08, 6.25 A)
 &rst
  ixpk= 718, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1218,1222,
 igr2= 464, 465, 466,
 &end
#
#    0 AMB  25-3:719     27 LEU  QD1         5.50    (#    719:25  Single Ambig)
 &rst
  ixpk= 719, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 455, 171,
 igr2= 464, 465, 466,
 &end
#
#    0 AMB  25-3:720     27 LEU  QD1         5.50    (#    720:25  Single Ambig)
 &rst
  ixpk= 720, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 532, 540, 422,
 igr2= 464, 465, 466,
 &end
#
#   54 VAL  QG-          27 LEU  QD2         4.50    (#    722:25  Unique         2.37, 4.62 A)
 &rst
  ixpk= 722, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 468, 469, 470,
 &end
#
#    0 AMB  25-3:723     27 LEU  QD2         4.50    (#    723:25  Single Ambig)
 &rst
  ixpk= 723, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 177, 178, 179, 390, 391, 392,
 igr2= 468, 469, 470,
 &end
#
#    0 AMB  25-3:724     27 LEU  QD2         4.50    (#    724:25  Single Ambig)
 &rst
  ixpk= 724, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 876, 877, 878, 225,
 igr2= 468, 469, 470,
 &end
#
#   27 LEU  HB-          27 LEU  QD2         3.50    (#    725:25  Unique         2.23, 3.55 A)
 &rst
  ixpk= 725, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 459, 460,
 igr2= 468, 469, 470,
 &end
#
#    0 AMB  25-3:726     27 LEU  QD2         5.50    (#    726:25  Single Ambig)
 &rst
  ixpk= 726, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1=1144,1145,1146, 626, 627,
 igr2= 468, 469, 470,
 &end
#
#    0 AMB  25-3:727     27 LEU  QD2         4.50    (#    727:25  Single Ambig)
 &rst
  ixpk= 727, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 462,1308,1309,1310,
 igr2= 468, 469, 470,
 &end
#
#   27 LEU  HB+          27 LEU  QD2         5.50    (#    728:25  Unique         2.23, 3.55 A)
 &rst
  ixpk= 728, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 459, 460,
 igr2= 468, 469, 470,
 &end
#
#   27 LEU  HA           27 LEU  QD2         3.50    (#    729:25  Unique         1.98, 2.96 A)
 &rst
  ixpk= 729, nxpk= 25, iat= 457,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 468, 469, 470,
 &end
#
#   31 PHE  QE           27 LEU  QD2         3.50    (#    730:25  Unique         2.45, 4.46 A)
 &rst
  ixpk= 730, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 534, 538,
 igr2= 468, 469, 470,
 &end
#
#   74 PHE  QE           27 LEU  QD2         3.50    (#    731:25  Unique         2.53, 4.87 A)
 &rst
  ixpk= 731, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1218,1222,
 igr2= 468, 469, 470,
 &end
#
#   31 PHE  QD           27 LEU  QD2         4.50    (#    732:25  Unique         2.46, 4.01 A)
 &rst
  ixpk= 732, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 532, 540,
 igr2= 468, 469, 470,
 &end
#
#   27 LEU  HN           27 LEU  QD2         5.50    (#    733:25  Unique         3.84, 4.64 A)
 &rst
  ixpk= 733, nxpk= 25, iat= 455,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 468, 469, 470,
 &end
#
#    0 AMB  25-3:734     27 LEU  QD2         3.50    (#    734:25  Single Ambig)
 &rst
  ixpk= 734, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 672, 673, 674, 679, 680, 681,
 igr2= 468, 469, 470,
 &end
#
#   37 ILE  QD1          28 TYR  HA          5.50    (#    736:25  Unique         2.19, 3.97 A)
 &rst
  ixpk= 736, nxpk= 25, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 629, 630, 631,
 &end
#
#   28 TYR  HB-          28 TYR  HA          3.50    (#    739:25  Unique         2.43, 2.79 A)
 &rst
  ixpk= 739, nxpk= 25, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 478, 479,
 &end
#
#   28 TYR  QD           28 TYR  HA          5.50    (#    741:25  Unique         2.15, 3.46 A)
 &rst
  ixpk= 741, nxpk= 25, iat=  -1, 476, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 482, 491,
 &end
#
#   28 TYR  HN           28 TYR  HA          5.50    (#    742:25  Unique         2.76, 2.83 A)
 &rst
  ixpk= 742, nxpk= 25, iat= 474, 476, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   29 ALA  HN           28 TYR  HA          5.50    (#    744:25  Unique         3.38, 3.56 A)
 &rst
  ixpk= 744, nxpk= 25, iat= 495, 476, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 ILE  QD1          28 TYR  HB-         4.50    (#    745:25  Unique         2.46, 5.07 A)
 &rst
  ixpk= 745, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 679, 680, 681,
 igr2= 478, 479,
 &end
#
#   40 ILE  QD1          28 TYR  HB+         5.50    (#    746:25  Unique         2.46, 5.07 A)
 &rst
  ixpk= 746, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 679, 680, 681,
 igr2= 478, 479,
 &end
#
#    0 AMB  25-3:747     28 TYR  HB-         4.50    (#    747:25  Single Ambig)
 &rst
  ixpk= 747, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 476, 548, 549,
 igr2= 478, 479,
 &end
#
#    0 AMB  25-3:748      0 AMB  25-1:748    4.50    (#    748:25  Double Ambig)
 &rst
  ixpk= 748, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 476, 548, 549,
 igr2= 478, 479, 478, 479,
 &end
#
#   25 LYS  HA           28 TYR  HB-         4.50    (#    749:25  Unique         2.68, 3.58 A)
 &rst
  ixpk= 749, nxpk= 25, iat= 424,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 478, 479,
 &end
#
#   25 LYS  HA           28 TYR  HB+         4.50    (#    750:25  Unique         2.68, 3.58 A)
 &rst
  ixpk= 750, nxpk= 25, iat= 424,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 478, 479,
 &end
#
#   28 TYR  QD           28 TYR  HB-         4.50    (#    751:25  Unique         2.28, 3.08 A)
 &rst
  ixpk= 751, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 482, 491,
 igr2= 478, 479,
 &end
#
#   28 TYR  QD           28 TYR  HB+         4.50    (#    752:25  Unique         2.28, 3.08 A)
 &rst
  ixpk= 752, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 482, 491,
 igr2= 478, 479,
 &end
#
#   29 ALA  HN           28 TYR  HB-         5.50    (#    753:25  Unique         2.66, 3.37 A)
 &rst
  ixpk= 753, nxpk= 25, iat= 495,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 478, 479,
 &end
#
#   29 ALA  HN           28 TYR  HB+         5.50    (#    754:25  Unique         2.66, 3.37 A)
 &rst
  ixpk= 754, nxpk= 25, iat= 495,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 478, 479,
 &end
#
#   28 TYR  HN           28 TYR  HB+         5.50    (#    755:25  Unique         1.94, 2.73 A)
 &rst
  ixpk= 755, nxpk= 25, iat= 474,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 478, 479,
 &end
#
#   28 TYR  HN           28 TYR  HB-         4.50    (#    756:25  Unique         1.94, 2.73 A)
 &rst
  ixpk= 756, nxpk= 25, iat= 474,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 478, 479,
 &end
#
#    0 AMB  25-3:757      0 AMB  25-1:757    4.50    (#    757:25  Double Ambig)
 &rst
  ixpk= 757, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 499, 500, 501,1035,1036,1037,
 igr2= 497,1033,
 &end
#
#   65 ALA  QB           62 ALA  HA          4.50    (#    758:25  Unique         2.55, 3.73 A)
 &rst
  ixpk= 758, nxpk= 25, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1070,1071,1072,
 &end
#
#    0 AMB  25-3:759      0 AMB  25-1:759    5.50    (#    759:25  Double Ambig)
 &rst
  ixpk= 759, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 144, 145, 146, 511, 512, 513,
 igr2=1033, 497,
 &end
#
#    0 AMB  25-3:760      0 AMB  25-1:760    4.50    (#    760:25  Double Ambig)
 &rst
  ixpk= 760, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 567, 568, 947, 951, 482, 491,
 igr2= 497,1033,
 &end
#
#   31 PHE  HA           31 PHE  HB-         5.50    (#    761:25  Unique         2.35, 2.82 A)
 &rst
  ixpk= 761, nxpk= 25, iat= 526,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 528, 529,
 &end
#
#   37 ILE  QD1          31 PHE  HB-         5.50    (#    762:25  Unique         2.15, 3.41 A)
 &rst
  ixpk= 762, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 629, 630, 631,
 igr2= 528, 529,
 &end
#
#   37 ILE  QD1          31 PHE  HB+         5.50    (#    763:25  Unique         2.15, 3.41 A)
 &rst
  ixpk= 763, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 629, 630, 631,
 igr2= 528, 529,
 &end
#
#   56 PHE  QE           31 PHE  HB-         5.50    (#    764:25  Unique         2.24, 4.96 A)
 &rst
  ixpk= 764, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 947, 951,
 igr2= 528, 529,
 &end
#
#   56 PHE  QE           31 PHE  HB+         5.50    (#    765:25  Unique         2.24, 4.96 A)
 &rst
  ixpk= 765, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 947, 951,
 igr2= 528, 529,
 &end
#
#   31 PHE  QD           31 PHE  HB-         5.50    (#    766:25  Unique         2.29, 3.09 A)
 &rst
  ixpk= 766, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 532, 540,
 igr2= 528, 529,
 &end
#
#   31 PHE  QD           31 PHE  HB+         5.50    (#    767:25  Unique         2.29, 3.09 A)
 &rst
  ixpk= 767, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 532, 540,
 igr2= 528, 529,
 &end
#
#   81 ILE  QD1          70 GLN  HA          3.50    (#    768:25  Unique         2.31, 3.51 A)
 &rst
  ixpk= 768, nxpk= 25, iat=  -1,1152, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1344,1345,1346,
 &end
#
#    0 AMB  25-3:769     33 GLN  HA          2.80    (#    769:25  Single Ambig)
 &rst
  ixpk= 769, nxpk= 25, iat=  -1, 557, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 559, 560, 559, 560,
 &end
#
#   70 GLN  HB-          70 GLN  HA          4.50    (#    770:25  Unique         2.13, 2.68 A)
 &rst
  ixpk= 770, nxpk= 25, iat=  -1,1152, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1154,1155,
 &end
#
#   33 GLN  HN           33 GLN  HA          4.50    (#    771:25  Unique         2.77, 2.89 A)
 &rst
  ixpk= 771, nxpk= 25, iat= 555, 557, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   33 GLN  HG+          33 GLN  HA          7.00    (#    772:25  Unique         2.32, 3.09 A)
 &rst
  ixpk= 772, nxpk= 25, iat=  -1, 557, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 562, 563,
 &end
#
#    0 AMB  25-3:777      0 AMB  25-1:777    3.50    (#    777:25  Double Ambig)
 &rst
  ixpk= 777, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 557,1152, 507,
 igr2= 559, 560,1341,1342,1341,1342,
 &end
#
#    0 AMB  25-3:779      0 AMB  25-1:779    3.50    (#    779:25  Double Ambig)
 &rst
  ixpk= 779, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 792, 793, 407, 408, 273, 274,
 igr2= 789, 790, 404, 405, 270, 271,
 &end
#
#    0 AMB  25-3:781      0 AMB  25-1:781    4.50    (#    781:25  Double Ambig)
 &rst
  ixpk= 781, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 290, 331,
 igr2= 311, 312, 270, 271,
 &end
#
#    0 AMB  25-3:782      0 AMB  25-1:782    3.50    (#    782:25  Double Ambig)
 &rst
  ixpk= 782, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 787, 268,
 igr2= 789, 790, 270, 271,
 &end
#
#   34 PHE  HB-          34 PHE  HA          4.50    (#    788:25  Unique         2.42, 2.74 A)
 &rst
  ixpk= 788, nxpk= 25, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 576, 577,
 &end
#
#   34 PHE  HB+          34 PHE  HA          4.50    (#    789:25  Unique         2.42, 2.74 A)
 &rst
  ixpk= 789, nxpk= 25, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 576, 577,
 &end
#
#    0 AMB  25-3:791     34 PHE  HA          2.80    (#    791:25  Single Ambig)
 &rst
  ixpk= 791, nxpk= 25, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 580, 588, 572, 592,
 &end
#
#   36 GLN  HN           34 PHE  HA          5.50    (#    792:25  Unique         4.90, 5.40 A)
 &rst
  ixpk= 792, nxpk= 25, iat= 599, 574, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   64 ASN  HD2-         34 PHE  HA          5.50    (#    794:25  Unique         2.61, 3.47 A)
 &rst
  ixpk= 794, nxpk= 25, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1061,1062,
 &end
#
#    0 AMB  25-3:795     34 PHE  HA          5.50    (#    795:25  Single Ambig)
 &rst
  ixpk= 795, nxpk= 25, iat=  -1, 574, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 567, 568, 582, 586,
 &end
#
#   83 TYR  QD           83 TYR  HB-         3.50    (#    796:25  Unique         2.34, 3.08 A)
 &rst
  ixpk= 796, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1368,1377,
 igr2=1364,1365,
 &end
#
#   83 TYR  QD           83 TYR  HB+         4.50    (#    797:25  Unique         2.34, 3.08 A)
 &rst
  ixpk= 797, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1368,1377,
 igr2=1364,1365,
 &end
#
#    0 AMB  25-3:798     83 TYR  HB-         4.50    (#    798:25  Single Ambig)
 &rst
  ixpk= 798, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1381,1360,
 igr2=1364,1365,
 &end
#
#    0 AMB  25-3:799      0 AMB  25-1:799    4.50    (#    799:25  Double Ambig)
 &rst
  ixpk= 799, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1381,1360,
 igr2=1364,1365,1364,1365,
 &end
#
#   83 TYR  HA           83 TYR  HB-         5.50    (#    800:25  Unique         2.33, 2.44 A)
 &rst
  ixpk= 800, nxpk= 25, iat=1362,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1364,1365,
 &end
#
#   83 TYR  HA           83 TYR  HB+         5.50    (#    801:25  Unique         2.33, 2.44 A)
 &rst
  ixpk= 801, nxpk= 25, iat=1362,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1364,1365,
 &end
#
#    0 AMB  25-3:803     35 GLY  HA-         4.50    (#    803:25  Single Ambig)
 &rst
  ixpk= 803, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 592, 572,
 igr2= 594, 595,
 &end
#
#   62 ALA  HN           35 GLY  HA-         5.50    (#    804:25  Unique         4.77, 5.39 A)
 &rst
  ixpk= 804, nxpk= 25, iat=1031,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 594, 595,
 &end
#
#   35 GLY  HN           35 GLY  HA+         4.50    (#    806:25  Unique         2.59, 2.82 A)
 &rst
  ixpk= 806, nxpk= 25, iat= 592,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 594, 595,
 &end
#
#   36 GLN  HG+          36 GLN  HA          4.50    (#    807:25  Unique         2.31, 3.43 A)
 &rst
  ixpk= 807, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 606, 607,
 &end
#
#    0 AMB  25-3:808     36 GLN  HA          5.50    (#    808:25  Single Ambig)
 &rst
  ixpk= 808, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 620, 967, 968, 967, 968,
 &end
#
#    0 AMB  25-3:809     36 GLN  HA          5.50    (#    809:25  Single Ambig)
 &rst
  ixpk= 809, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 618, 557,
 &end
#
#    0 AMB  25-3:812     36 GLN  HA          5.50    (#    812:25  Single Ambig)
 &rst
  ixpk= 812, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 599, 544,
 &end
#
#   37 ILE  HN           36 GLN  HA          4.50    (#    813:25  Unique         2.01, 2.08 A)
 &rst
  ixpk= 813, nxpk= 25, iat= 616, 601, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   37 ILE  HG1+         36 GLN  HG-         5.50    (#    814:25  Unique         5.26, 6.82 A)
 &rst
  ixpk= 814, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 626, 627,
 igr2= 606, 607,
 &end
#
#    0 AMB  25-3:815      0 AMB  25-1:815    5.50    (#    815:25  Double Ambig)
 &rst
  ixpk= 815, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 967, 968, 967, 968,
 igr2= 606, 607, 606, 607,
 &end
#
#   36 GLN  HA           36 GLN  HG+         5.50    (#    816:25  Unique         2.31, 3.43 A)
 &rst
  ixpk= 816, nxpk= 25, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 606, 607,
 &end
#
#   36 GLN  HA           36 GLN  HG-         4.50    (#    817:25  Unique         2.31, 3.43 A)
 &rst
  ixpk= 817, nxpk= 25, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 606, 607,
 &end
#
#   36 GLN  HE2+         36 GLN  HG+         5.50    (#    819:25  Unique         2.15, 3.33 A)
 &rst
  ixpk= 819, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 611, 612,
 igr2= 606, 607,
 &end
#
#   36 GLN  HB+          36 GLN  HG+         3.50    (#    822:25  Unique         2.32, 2.60 A)
 &rst
  ixpk= 822, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 603, 604,
 igr2= 606, 607,
 &end
#
#    0 AMB  25-3:823      0 AMB  25-1:823    2.80    (#    823:25  Double Ambig)
 &rst
  ixpk= 823, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 603, 604, 961, 962,
 igr2= 606, 607, 606, 607,
 &end
#
#   36 GLN  HB+          36 GLN  HG-         4.50    (#    824:25  Unique         2.32, 2.60 A)
 &rst
  ixpk= 824, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 603, 604,
 igr2= 606, 607,
 &end
#
#    0 AMB  25-3:825     36 GLN  HG-         3.50    (#    825:25  Single Ambig)
 &rst
  ixpk= 825, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 603, 604, 961, 962,
 igr2= 606, 607,
 &end
#
#   37 ILE  HG1-         37 ILE  HA          5.50    (#    827:25  Unique         2.31, 2.96 A)
 &rst
  ixpk= 827, nxpk= 25, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 627,
 &end
#
#    0 AMB  25-3:829     37 ILE  HA          5.50    (#    829:25  Single Ambig)
 &rst
  ixpk= 829, nxpk= 25, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 639, 640, 964, 965, 964, 965,
 &end
#
#   37 ILE  HG1+         37 ILE  HA          5.50    (#    830:25  Unique         2.31, 2.96 A)
 &rst
  ixpk= 830, nxpk= 25, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 627,
 &end
#
#   37 ILE  HB           37 ILE  HA          5.50    (#    831:25  Unique         2.85, 3.03 A)
 &rst
  ixpk= 831, nxpk= 25, iat= 620, 618, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   56 PHE  HA           37 ILE  HA          4.50    (#    832:25  Unique         2.06, 2.39 A)
 &rst
  ixpk= 832, nxpk= 25, iat= 939, 618, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   38 LEU  HN           37 ILE  HA          3.50    (#    833:25  Unique         2.04, 2.23 A)
 &rst
  ixpk= 833, nxpk= 25, iat= 635, 618, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   56 PHE  QE           37 ILE  HA          5.50    (#    834:25  Unique         3.76, 4.88 A)
 &rst
  ixpk= 834, nxpk= 25, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 947, 951,
 &end
#
#   37 ILE  QG2          37 ILE  HB          3.50    (#    836:25  Unique         2.34, 2.65 A)
 &rst
  ixpk= 836, nxpk= 25, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 622, 623, 624,
 &end
#
#   37 ILE  QD1          37 ILE  HB          5.50    (#    837:25  Unique         2.51, 3.46 A)
 &rst
  ixpk= 837, nxpk= 25, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 629, 630, 631,
 &end
#
#   37 ILE  HN           37 ILE  HB          4.50    (#    838:25  Unique         2.17, 2.35 A)
 &rst
  ixpk= 838, nxpk= 25, iat= 616, 620, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   32 SER  HA           37 ILE  HG1+        5.50    (#    842:25  Unique         2.35, 3.51 A)
 &rst
  ixpk= 842, nxpk= 25, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 626, 627,
 &end
#
#   37 ILE  HA           37 ILE  HG1+        5.50    (#    843:25  Unique         2.31, 2.96 A)
 &rst
  ixpk= 843, nxpk= 25, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 626, 627,
 &end
#
#   37 ILE  QD1          37 ILE  HG1+        4.50    (#    844:25  Unique         1.99, 2.63 A)
 &rst
  ixpk= 844, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 629, 630, 631,
 igr2= 626, 627,
 &end
#
#    0 AMB  25-3:846     37 ILE  QD1         2.80    (#    846:25  Single Ambig)
 &rst
  ixpk= 846, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 622, 623, 624, 464, 465, 466,
 igr2= 629, 630, 631,
 &end
#
#   40 ILE  QD1          37 ILE  QD1         3.50    (#    847:25  Unique         2.22, 4.36 A)
 &rst
  ixpk= 847, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 679, 680, 681,
 igr2= 629, 630, 631,
 &end
#
#   37 ILE  HB           37 ILE  QD1         3.50    (#    848:25  Unique         2.51, 3.46 A)
 &rst
  ixpk= 848, nxpk= 25, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 629, 630, 631,
 &end
#
#   31 PHE  HB-          37 ILE  QD1         5.50    (#    849:25  Unique         2.15, 3.41 A)
 &rst
  ixpk= 849, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 528, 529,
 igr2= 629, 630, 631,
 &end
#
#   54 VAL  QG+          37 ILE  QD1         3.50    (#    850:25  Unique         2.22, 4.67 A)
 &rst
  ixpk= 850, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 629, 630, 631,
 &end
#
#   37 ILE  HG1-         37 ILE  QD1         3.50    (#    851:25  Unique         1.99, 2.63 A)
 &rst
  ixpk= 851, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 626, 627,
 igr2= 629, 630, 631,
 &end
#
#   28 TYR  HA           37 ILE  QD1         4.50    (#    852:25  Unique         2.19, 3.97 A)
 &rst
  ixpk= 852, nxpk= 25, iat= 476,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 629, 630, 631,
 &end
#
#   37 ILE  HA           37 ILE  QD1         5.50    (#    853:25  Unique         2.25, 4.16 A)
 &rst
  ixpk= 853, nxpk= 25, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 629, 630, 631,
 &end
#
#   32 SER  HA           37 ILE  QD1         5.50    (#    854:25  Unique         2.82, 4.48 A)
 &rst
  ixpk= 854, nxpk= 25, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 629, 630, 631,
 &end
#
#    0 AMB  25-3:855     37 ILE  QD1         4.50    (#    855:25  Single Ambig)
 &rst
  ixpk= 855, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 947, 951, 482, 491,
 igr2= 629, 630, 631,
 &end
#
#    0 AMB  25-3:856     37 ILE  QD1         5.50    (#    856:25  Single Ambig)
 &rst
  ixpk= 856, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 947, 951, 482, 491,
 igr2= 629, 630, 631,
 &end
#
#   56 PHE  QD           37 ILE  QD1         4.50    (#    857:25  Unique         3.22, 6.22 A)
 &rst
  ixpk= 857, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 945, 953,
 igr2= 629, 630, 631,
 &end
#
#    0 AMB  25-3:858     37 ILE  QD1         5.50    (#    858:25  Single Ambig)
 &rst
  ixpk= 858, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 947, 951, 482, 491,
 igr2= 629, 630, 631,
 &end
#
#   32 SER  HN           37 ILE  QD1         4.50    (#    859:25  Unique         2.51, 3.97 A)
 &rst
  ixpk= 859, nxpk= 25, iat= 544,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 629, 630, 631,
 &end
#
#   31 PHE  QD           37 ILE  QD1         5.50    (#    860:25  Unique         2.66, 5.48 A)
 &rst
  ixpk= 860, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 532, 540,
 igr2= 629, 630, 631,
 &end
#
#   54 VAL  QG+          37 ILE  QG2         3.50    (#    861:25  Unique         2.18, 5.34 A)
 &rst
  ixpk= 861, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 622, 623, 624,
 &end
#
#   37 ILE  QD1          37 ILE  QG2         2.80    (#    862:25  Unique         2.11, 3.69 A)
 &rst
  ixpk= 862, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 629, 630, 631,
 igr2= 622, 623, 624,
 &end
#
#   40 ILE  QD1          37 ILE  QG2         2.80    (#    863:25  Unique         2.15, 4.01 A)
 &rst
  ixpk= 863, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 679, 680, 681,
 igr2= 622, 623, 624,
 &end
#
#   37 ILE  HB           37 ILE  QG2         2.80    (#    865:25  Unique         2.34, 2.65 A)
 &rst
  ixpk= 865, nxpk= 25, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 622, 623, 624,
 &end
#
#   37 ILE  HA           37 ILE  QG2         3.50    (#    866:25  Unique         2.26, 3.25 A)
 &rst
  ixpk= 866, nxpk= 25, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 622, 623, 624,
 &end
#
#   40 ILE  HA           37 ILE  QG2         5.50    (#    867:25  Unique         4.38, 5.01 A)
 &rst
  ixpk= 867, nxpk= 25, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 622, 623, 624,
 &end
#
#   28 TYR  QE           37 ILE  QG2         5.50    (#    868:25  Unique         2.55, 6.54 A)
 &rst
  ixpk= 868, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 484, 489,
 igr2= 622, 623, 624,
 &end
#
#    0 AMB  25-3:869     37 ILE  QG2         4.50    (#    869:25  Single Ambig)
 &rst
  ixpk= 869, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 482, 491, 947, 951,
 igr2= 622, 623, 624,
 &end
#
#   39 ASP  HN           37 ILE  QG2         3.50    (#    870:25  Unique         2.51, 3.35 A)
 &rst
  ixpk= 870, nxpk= 25, iat= 654,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 622, 623, 624,
 &end
#
#   55 ILE  HN           37 ILE  QG2         5.50    (#    871:25  Unique         3.23, 4.44 A)
 &rst
  ixpk= 871, nxpk= 25, iat= 918,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 622, 623, 624,
 &end
#
#    0 AMB  25-3:872     37 ILE  QG2         5.50    (#    872:25  Single Ambig)
 &rst
  ixpk= 872, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 666, 474,
 igr2= 622, 623, 624,
 &end
#
#   38 LEU  HN           37 ILE  QG2         4.50    (#    873:25  Unique         2.42, 3.19 A)
 &rst
  ixpk= 873, nxpk= 25, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 622, 623, 624,
 &end
#
#   38 LEU  QD-          38 LEU  HA          2.80    (#    874:25  Unique         2.24, 3.86 A)
 &rst
  ixpk= 874, nxpk= 25, iat=  -1, 637, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 644, 645, 646, 648, 649, 650,
 &end
#
#    0 AMB  25-3:876     38 LEU  HA          4.50    (#    876:25  Single Ambig)
 &rst
  ixpk= 876, nxpk= 25, iat=  -1, 637, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 639, 640, 642,
 &end
#
#   37 ILE  HA           38 LEU  HA          4.50    (#    878:25  Unique         4.38, 4.50 A)
 &rst
  ixpk= 878, nxpk= 25, iat= 618, 637, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   38 LEU  HN           38 LEU  HA          4.50    (#    881:25  Unique         2.79, 2.95 A)
 &rst
  ixpk= 881, nxpk= 25, iat= 635, 637, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:882     85 LYS  HA          4.50    (#    882:25  Single Ambig)
 &rst
  ixpk= 882, nxpk= 25, iat=  -1,1394, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1396,1397,1396,1397,
 &end
#
#    0 AMB  25-3:883      0 AMB  25-1:883    3.50    (#    883:25  Double Ambig)
 &rst
  ixpk= 883, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 644, 645, 646, 648, 649, 650, 924, 925, 926,
 igr2= 639, 640, 639, 640,
 &end
#
#    0 AMB  25-3:884     38 LEU  HB-         3.50    (#    884:25  Single Ambig)
 &rst
  ixpk= 884, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 644, 645, 646, 648, 649, 650, 924, 925, 926,
 igr2= 639, 640,
 &end
#
#   38 LEU  HN            0 AMB  25-1:885    5.50    (#    885:25  Single Ambig)
 &rst
  ixpk= 885, nxpk= 25, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 642, 928, 929,
 &end
#
#    0 AMB  25-3:887     24 LYS  HG-         5.50    (#    887:25  Single Ambig)
 &rst
  ixpk= 887, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 413, 414, 413, 414,
 igr2= 407, 408,
 &end
#
#    0 AMB  25-3:888     24 LYS  HG-         5.50    (#    888:25  Single Ambig)
 &rst
  ixpk= 888, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 333, 334, 426, 427, 355, 356,
 igr2= 407, 408,
 &end
#
#    0 AMB  25-3:889      0 AMB  25-1:889    2.80    (#    889:25  Double Ambig)
 &rst
  ixpk= 889, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
 igr1= 644, 645, 646, 648, 649, 650, 644, 645, 646, 648,
       649, 650, 931, 932, 933,
 igr2= 642, 928, 929,
 &end
#
#   67 ARG  HA           69 MET  HA          7.00    (#    898:25  Unique         6.65, 6.80 A)
 &rst
  ixpk= 898, nxpk= 25, iat=1097,1135, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   39 ASP  HB+          39 ASP  HA          4.50    (#    899:25  Unique         2.49, 2.78 A)
 &rst
  ixpk= 899, nxpk= 25, iat=  -1, 656, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 658, 659,
 &end
#
#   72 PHE  HB-          69 MET  HA          4.50    (#    900:25  Unique         2.33, 2.94 A)
 &rst
  ixpk= 900, nxpk= 25, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1178,1179,
 &end
#
#   40 ILE  HN           39 ASP  HA          4.50    (#    903:25  Unique         2.46, 2.50 A)
 &rst
  ixpk= 903, nxpk= 25, iat= 666, 656, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:906     69 MET  HA          5.50    (#    906:25  Single Ambig)
 &rst
  ixpk= 906, nxpk= 25, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1157,1158,1195,1196,
 &end
#
#   37 ILE  QG2          39 ASP  HA          5.50    (#    907:25  Unique         3.40, 4.10 A)
 &rst
  ixpk= 907, nxpk= 25, iat=  -1, 656, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 622, 623, 624,
 &end
#
#    0 AMB  25-3:908      0 AMB  25-1:908    4.50    (#    908:25  Double Ambig)
 &rst
  ixpk= 908, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1344,1345,1346, 924, 925, 926, 691, 692, 693, 695,
       696, 697,
 igr2=1135, 656,
 &end
#
#   69 MET  HG+          69 MET  HA          4.50    (#    909:25  Unique         2.71, 3.45 A)
 &rst
  ixpk= 909, nxpk= 25, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1140,1141,
 &end
#
#    0 AMB  25-3:911      0 AMB  25-1:911    3.50    (#    911:25  Double Ambig)
 &rst
  ixpk= 911, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 931, 932, 933, 644, 645, 646, 648, 649, 650, 924,
       925, 926,
 igr2= 658, 659, 658, 659, 658, 659,
 &end
#
#    0 AMB  25-3:912     39 ASP  HB-         3.50    (#    912:25  Single Ambig)
 &rst
  ixpk= 912, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 931, 932, 933, 644, 645, 646, 648, 649, 650, 924,
       925, 926,
 igr2= 658, 659,
 &end
#
#   39 ASP  HA           39 ASP  HB+         4.50    (#    913:25  Unique         2.49, 2.78 A)
 &rst
  ixpk= 913, nxpk= 25, iat= 656,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 658, 659,
 &end
#
#   39 ASP  HA           39 ASP  HB-         4.50    (#    914:25  Unique         2.49, 2.78 A)
 &rst
  ixpk= 914, nxpk= 25, iat= 656,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 658, 659,
 &end
#
#   40 ILE  HN           39 ASP  HB-         5.50    (#    915:25  Unique         3.08, 3.71 A)
 &rst
  ixpk= 915, nxpk= 25, iat= 666,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 658, 659,
 &end
#
#    0 AMB  25-3:916     40 ILE  HB          2.80    (#    916:25  Single Ambig)
 &rst
  ixpk= 916, nxpk= 25, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 672, 673, 674, 679, 680, 681,
 &end
#
#   23 LEU  QD2          40 ILE  HB          7.00    (#    917:25  Unique         6.47, 7.52 A)
 &rst
  ixpk= 917, nxpk= 25, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 394, 395, 396,
 &end
#
#    0 AMB  25-3:918     40 ILE  HB          5.50    (#    918:25  Single Ambig)
 &rst
  ixpk= 918, nxpk= 25, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 404, 405, 404, 405,
 &end
#
#    0 AMB  25-3:920     40 ILE  HB          5.50    (#    920:25  Single Ambig)
 &rst
  ixpk= 920, nxpk= 25, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 668, 656,
 &end
#
#   40 ILE  HN           40 ILE  HB          5.50    (#    921:25  Unique         2.67, 2.77 A)
 &rst
  ixpk= 921, nxpk= 25, iat= 666, 670, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   53 PHE  HN           40 ILE  HB          7.00    (#    922:25  Unique         6.90, 7.06 A)
 &rst
  ixpk= 922, nxpk= 25, iat= 882, 670, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   15 ASN  HA           77 LYS  HD-         5.50    (#    929:25  Unique         2.03, 3.08 A)
 &rst
  ixpk= 929, nxpk= 25, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1271,1272,
 &end
#
#   54 VAL  QG+          40 ILE  QD1         5.50    (#    930:25  Unique         3.15, 6.10 A)
 &rst
  ixpk= 930, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 679, 680, 681,
 &end
#
#   27 LEU  HB+          40 ILE  QD1         5.50    (#    931:25  Unique         2.16, 3.23 A)
 &rst
  ixpk= 931, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 459, 460,
 igr2= 679, 680, 681,
 &end
#
#   28 TYR  HB+          40 ILE  QD1         4.50    (#    932:25  Unique         2.46, 5.07 A)
 &rst
  ixpk= 932, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 478, 479,
 igr2= 679, 680, 681,
 &end
#
#    0 AMB  25-3:934     40 ILE  QD1         5.50    (#    934:25  Single Ambig)
 &rst
  ixpk= 934, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 668, 656,
 igr2= 679, 680, 681,
 &end
#
#   28 TYR  QD           40 ILE  QD1         5.50    (#    936:25  Unique         2.61, 5.37 A)
 &rst
  ixpk= 936, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 482, 491,
 igr2= 679, 680, 681,
 &end
#
#   36 GLN  HE2+         40 ILE  QD1         5.50    (#    938:25  Unique         6.58, 7.74 A)
 &rst
  ixpk= 938, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 611, 612,
 igr2= 679, 680, 681,
 &end
#
#    0 AMB  25-3:939     40 ILE  QD1         5.50    (#    939:25  Single Ambig)
 &rst
  ixpk= 939, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 544, 918,
 igr2= 679, 680, 681,
 &end
#
#    0 AMB  25-3:940     40 ILE  QD1         4.50    (#    940:25  Single Ambig)
 &rst
  ixpk= 940, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 474, 666,
 igr2= 679, 680, 681,
 &end
#
#    0 AMB  25-3:941     40 ILE  QG2         4.50    (#    941:25  Single Ambig)
 &rst
  ixpk= 941, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 622, 623, 624, 184, 185, 186,
 igr2= 672, 673, 674,
 &end
#
#   55 ILE  HN           40 ILE  QG2         5.50    (#    945:25  Unique         4.89, 6.23 A)
 &rst
  ixpk= 945, nxpk= 25, iat= 918,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 672, 673, 674,
 &end
#
#   42 ALA  HN           40 ILE  QG2         5.50    (#    946:25  Unique         3.69, 4.90 A)
 &rst
  ixpk= 946, nxpk= 25, iat= 701,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 672, 673, 674,
 &end
#
#   41 VAL  HN           40 ILE  QG2         4.50    (#    947:25  Unique         2.62, 3.34 A)
 &rst
  ixpk= 947, nxpk= 25, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 672, 673, 674,
 &end
#
#    0 AMB  25-3:949     40 ILE  QG2         5.50    (#    949:25  Single Ambig)
 &rst
  ixpk= 949, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 404, 405, 404, 405,
 igr2= 672, 673, 674,
 &end
#
#   54 VAL  QG-          40 ILE  QG2         4.50    (#    950:25  Unique         3.10, 5.87 A)
 &rst
  ixpk= 950, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 672, 673, 674,
 &end
#
#   42 ALA  HN           41 VAL  HA          3.50    (#    951:25  Unique         2.00, 2.13 A)
 &rst
  ixpk= 951, nxpk= 25, iat= 701, 687, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 VAL  QG-          41 VAL  HA          4.50    (#    955:25  Unique         2.17, 3.19 A)
 &rst
  ixpk= 955, nxpk= 25, iat=  -1, 687, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 691, 692, 693, 695, 696, 697,
 &end
#
#   57 LYS  HN           57 LYS  HB-         5.50    (#    957:25  Unique         2.41, 3.08 A)
 &rst
  ixpk= 957, nxpk= 25, iat= 957,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 961, 962,
 &end
#
#   41 VAL  QG-          41 VAL  HB          4.50    (#    959:25  Unique         2.34, 2.66 A)
 &rst
  ixpk= 959, nxpk= 25, iat=  -1, 689, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 691, 692, 693, 695, 696, 697,
 &end
#
#   55 ILE  HG1-         41 VAL  QG+         5.50    (#    961:25  Unique         4.10, 6.79 A)
 &rst
  ixpk= 961, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 928, 929,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#    0 AMB  25-3:962      0 AMB  25-1:962    3.50    (#    962:25  Double Ambig)
 &rst
  ixpk= 962, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 718, 689, 715, 716,
 igr2= 691, 692, 693, 695, 696, 697, 691, 692, 693, 695,
       696, 697, 691, 692, 693, 695, 696, 697,
 &end
#
#    0 AMB  25-3:963      0 AMB  25-1:963    4.50    (#    963:25  Double Ambig)
 &rst
  ixpk= 963, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 886, 887, 886, 887,
 igr2= 691, 692, 693, 695, 696, 697, 691, 692, 693, 695,
       696, 697,
 &end
#
#   41 VAL  HA           41 VAL  QG+         3.50    (#    964:25  Unique         2.17, 3.19 A)
 &rst
  ixpk= 964, nxpk= 25, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   41 VAL  HN           41 VAL  QG+         4.50    (#    966:25  Unique         2.26, 4.27 A)
 &rst
  ixpk= 966, nxpk= 25, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   42 ALA  HN           41 VAL  QG+         5.50    (#    969:25  Unique         2.67, 4.58 A)
 &rst
  ixpk= 969, nxpk= 25, iat= 701,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   42 ALA  QB           41 VAL  QG-         4.50    (#    973:25  Unique         5.17, 7.27 A)
 &rst
  ixpk= 973, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 705, 706, 707,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#    0 AMB  25-3:976     41 VAL  QG-         5.50    (#    976:25  Single Ambig)
 &rst
  ixpk= 976, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 886, 887, 886, 887,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   53 PHE  QD           41 VAL  QG-         5.50    (#    978:25  Unique         2.87, 6.08 A)
 &rst
  ixpk= 978, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 890, 898,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   42 ALA  HN           41 VAL  QG-         4.50    (#    979:25  Unique         2.67, 4.58 A)
 &rst
  ixpk= 979, nxpk= 25, iat= 701,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   41 VAL  HA           41 VAL  QG-         4.50    (#    980:25  Unique         2.17, 3.19 A)
 &rst
  ixpk= 980, nxpk= 25, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#    0 AMB  25-3:981     42 ALA  QB          3.50    (#    981:25  Single Ambig)
 &rst
  ixpk= 981, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 333, 334, 385, 386, 410, 411,
 igr2= 705, 706, 707,
 &end
#
#   23 LEU  HG           42 ALA  QB          2.80    (#    982:25  Unique         2.19, 2.85 A)
 &rst
  ixpk= 982, nxpk= 25, iat= 388,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 705, 706, 707,
 &end
#
#   27 LEU  QD1          42 ALA  QB          5.50    (#    983:25  Unique         4.95, 6.45 A)
 &rst
  ixpk= 983, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 464, 465, 466,
 igr2= 705, 706, 707,
 &end
#
#   23 LEU  QD1          42 ALA  QB          3.50    (#    984:25  Unique         2.31, 3.58 A)
 &rst
  ixpk= 984, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 390, 391, 392,
 igr2= 705, 706, 707,
 &end
#
#    0 AMB  25-3:985     42 ALA  QB          4.50    (#    985:25  Single Ambig)
 &rst
  ixpk= 985, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
 igr1= 672, 673, 674, 691, 692, 693, 695, 696, 697,
 igr2= 705, 706, 707,
 &end
#
#   20 LYS  HG-          42 ALA  QB          3.50    (#    986:25  Unique         2.20, 4.16 A)
 &rst
  ixpk= 986, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 336, 337,
 igr2= 705, 706, 707,
 &end
#
#   52 ALA  QB           42 ALA  QB          3.50    (#    987:25  Unique         2.50, 4.36 A)
 &rst
  ixpk= 987, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 876, 877, 878,
 igr2= 705, 706, 707,
 &end
#
#   42 ALA  HN           42 ALA  QB          4.50    (#    990:25  Unique         2.65, 3.39 A)
 &rst
  ixpk= 990, nxpk= 25, iat= 701,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 705, 706, 707,
 &end
#
#   20 LYS  QE           42 ALA  QB          5.50    (#    991:25  Unique         2.18, 5.94 A)
 &rst
  ixpk= 991, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 342, 343,
 igr2= 705, 706, 707,
 &end
#
#    0 AMB  25-3:992      0 AMB  25-1:992    5.50    (#    992:25  Double Ambig)
 &rst
  ixpk= 992, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 867, 868, 824, 807,
 igr2= 787, 768,
 &end
#
#    0 AMB  25-3:997      0 AMB  25-1:997    3.50    (#    997:25  Double Ambig)
 &rst
  ixpk= 997, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 770, 771, 795, 796, 795, 796,
 igr2= 768, 787,
 &end
#
#   22 GLU  HG-          19 LYS  HB-         5.50    (#   1002:25  Unique         2.01, 3.74 A)
 &rst
  ixpk= 1002, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 373, 374,
 igr2= 311, 312,
 &end
#
#   53 PHE  HN           48 MET  HA          7.00    (#   1007:25  Unique         5.47, 5.69 A)
 &rst
  ixpk= 1007, nxpk= 25, iat= 882, 809, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  25-3:1012     0 AMB  25-1:1012   5.50    (#   1012:25  Double Ambig)
 &rst
  ixpk= 1012, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 705, 706, 707, 758, 759, 760,
 igr2= 811, 812, 811, 812, 811, 812,
 &end
#
#    0 AMB  25-3:1013     0 AMB  25-1:1013   4.50    (#   1013:25  Double Ambig)
 &rst
  ixpk= 1013, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 737, 738, 737, 738,
 igr2= 734, 735, 734, 735,
 &end
#
#    0 AMB  25-3:1014     0 AMB  25-1:1014   3.50    (#   1014:25  Double Ambig)
 &rst
  ixpk= 1014, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
 igr1= 859, 860, 859, 860, 859, 860, 862, 863,
 igr2= 811, 812, 811, 812, 811, 812, 811, 812,
 &end
#
#    0 AMB  25-3:1015     0 AMB  25-1:1015   4.50    (#   1015:25  Double Ambig)
 &rst
  ixpk= 1015, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 814, 815, 814, 815,
 igr2= 811, 812, 811, 812,
 &end
#
#   24 LYS  HA           24 LYS  HB+         4.50    (#   1016:25  Unique         2.45, 2.81 A)
 &rst
  ixpk= 1016, nxpk= 25, iat= 402,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 404, 405,
 &end
#
#    0 AMB  25-3:1017     0 AMB  25-1:1017   4.50    (#   1017:25  Double Ambig)
 &rst
  ixpk= 1017, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 732, 809,
 igr2= 734, 735, 811, 812, 811, 812, 811, 812,
 &end
#
#    0 AMB  25-3:1021     0 AMB  25-1:1021   4.50    (#   1021:25  Double Ambig)
 &rst
  ixpk= 1021, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 807, 824,
 igr2= 811, 812, 811, 812,
 &end
#
#   24 LYS  HN           24 LYS  HB+         4.50    (#   1023:25  Unique         2.32, 2.71 A)
 &rst
  ixpk= 1023, nxpk= 25, iat= 400,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 404, 405,
 &end
#
#    0 AMB  25-3:1025    48 MET  HG-         4.50    (#   1025:25  Single Ambig)
 &rst
  ixpk= 1025, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 811, 812, 811, 812,
 igr2= 814, 815,
 &end
#
#    0 AMB  25-3:1026    48 MET  HG-         3.50    (#   1026:25  Single Ambig)
 &rst
  ixpk= 1026, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 859, 860, 859, 860, 862, 863,
 igr2= 814, 815,
 &end
#
#    0 AMB  25-3:1027     0 AMB  25-1:1027   3.50    (#   1027:25  Double Ambig)
 &rst
  ixpk= 1027, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 859, 860, 859, 860, 862, 863,
 igr2= 814, 815, 814, 815, 814, 815,
 &end
#
#    0 AMB  25-3:1028     0 AMB  25-1:1028   4.50    (#   1028:25  Double Ambig)
 &rst
  ixpk= 1028, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 811, 812, 811, 812,
 igr2= 814, 815, 814, 815,
 &end
#
#    0 AMB  25-3:1029    48 MET  HG-         5.50    (#   1029:25  Single Ambig)
 &rst
  ixpk= 1029, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,
 igr2= 814, 815,
 &end
#
#   48 MET  HA           48 MET  HG-         4.50    (#   1030:25  Unique         2.41, 3.24 A)
 &rst
  ixpk= 1030, nxpk= 25, iat= 809,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 814, 815,
 &end
#
#   48 MET  HA           48 MET  HG+         5.50    (#   1031:25  Unique         2.41, 3.24 A)
 &rst
  ixpk= 1031, nxpk= 25, iat= 809,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 814, 815,
 &end
#
#   43 LEU  HB+          48 MET  HG+         5.50    (#   1035:25  Unique         2.12, 4.24 A)
 &rst
  ixpk= 1035, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 715, 716,
 igr2= 814, 815,
 &end
#
#    0 AMB  25-3:1036    49 ARG  HA          5.50    (#   1036:25  Single Ambig)
 &rst
  ixpk= 1036, nxpk= 25, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 253, 850, 851, 268, 768,
 &end
#
#    0 AMB  25-3:1037    49 ARG  HA          4.50    (#   1037:25  Single Ambig)
 &rst
  ixpk= 1037, nxpk= 25, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 732, 809,
 &end
#
#    0 AMB  25-3:1039    49 ARG  HA          4.50    (#   1039:25  Single Ambig)
 &rst
  ixpk= 1039, nxpk= 25, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 834, 835, 834, 835,
 &end
#
#    0 AMB  25-3:1040    49 ARG  HA          3.50    (#   1040:25  Single Ambig)
 &rst
  ixpk= 1040, nxpk= 25, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 828, 829, 828, 829,
 &end
#
#   49 ARG  HG-          49 ARG  HA          5.50    (#   1041:25  Unique         2.26, 2.69 A)
 &rst
  ixpk= 1041, nxpk= 25, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 831, 832,
 &end
#
#   51 GLN  HN           49 ARG  HA          5.50    (#   1043:25  Unique         3.86, 4.19 A)
 &rst
  ixpk= 1043, nxpk= 25, iat= 855, 826, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 GLY  HN           49 ARG  HA          4.50    (#   1044:25  Unique         3.47, 3.57 A)
 &rst
  ixpk= 1044, nxpk= 25, iat= 848, 826, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   49 ARG  HN           49 ARG  HA          5.50    (#   1046:25  Unique         2.30, 2.88 A)
 &rst
  ixpk= 1046, nxpk= 25, iat= 824, 826, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   49 ARG  HG+          49 ARG  HA          5.50    (#   1047:25  Unique         2.26, 2.69 A)
 &rst
  ixpk= 1047, nxpk= 25, iat=  -1, 826, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 831, 832,
 &end
#
#    0 AMB  25-3:1048     0 AMB  25-1:1048   5.50    (#   1048:25  Double Ambig)
 &rst
  ixpk= 1048, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 775, 776, 777, 779, 780, 781,
 igr2= 828, 829, 828, 829, 828, 829,
 &end
#
#    0 AMB  25-3:1049     0 AMB  25-1:1049   3.50    (#   1049:25  Double Ambig)
 &rst
  ixpk= 1049, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.01, r4= 8.51,
 igr1= 834, 835, 834, 835, 834, 835,1105,1106,1105,1106,
      1105,1106,
 igr2= 828, 829, 828, 829, 828, 829,1099,1100,1099,1100,
        25,  26,
 &end
#
#   49 ARG  HA            0 AMB  25-1:1052   4.50    (#   1052:25  Single Ambig)
 &rst
  ixpk= 1052, nxpk= 25, iat= 826,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 828, 829, 828, 829,
 &end
#
#    0 AMB  25-3:1053     0 AMB  25-1:1053   4.50    (#   1053:25  Double Ambig)
 &rst
  ixpk= 1053, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 824,1095,
 igr2= 828, 829, 828, 829,1099,1100,
 &end
#
#    0 AMB  25-3:1055     0 AMB  25-1:1055   5.50    (#   1055:25  Double Ambig)
 &rst
  ixpk= 1055, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 814, 815, 814, 815,
 igr2= 828, 829, 828, 829,
 &end
#
#   99 LYS  HE-         100 GLU  HB-         5.50    (#   1056:25  Unique         2.25, 5.67 A)
 &rst
  ixpk= 1056, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1622,1623,
 igr2=1635,1636,
 &end
#
#    0 AMB  25-3:1057     0 AMB  25-1:1057   5.50    (#   1057:25  Double Ambig)
 &rst
  ixpk= 1057, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.17, r4=10.67,
 igr1=1097, 850, 851,1045,1046,
 igr2=1099,1100, 828, 829, 828, 829,1099,1100,
 &end
#
#    0 AMB  25-3:1058     0 AMB  25-1:1058   4.50    (#   1058:25  Double Ambig)
 &rst
  ixpk= 1058, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1097, 850, 851,1045,1046,
 igr2=1099,1100, 828, 829, 828, 829,1099,1100,
 &end
#
#   96 GLY  HN          100 GLU  HB-         5.50    (#   1059:25  Unique         4.95, 6.25 A)
 &rst
  ixpk= 1059, nxpk= 25, iat=1568,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1635,1636,
 &end
#
#  100 GLU  HN          100 GLU  HB-         5.50    (#   1060:25  Unique         2.05, 3.01 A)
 &rst
  ixpk= 1060, nxpk= 25, iat=1631,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1635,1636,
 &end
#
#    0 AMB  25-3:1062     0 AMB  25-1:1062   3.50    (#   1062:25  Double Ambig)
 &rst
  ixpk= 1062, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 834, 835, 834, 835,
 igr2= 831, 832, 831, 832,
 &end
#
#   49 ARG  HA           49 ARG  HG+         5.50    (#   1063:25  Unique         2.26, 2.69 A)
 &rst
  ixpk= 1063, nxpk= 25, iat= 826,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 831, 832,
 &end
#
#    0 AMB  25-3:1064     0 AMB  25-1:1064   4.50    (#   1064:25  Double Ambig)
 &rst
  ixpk= 1064, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 824, 807,
 igr2= 831, 832, 831, 832,
 &end
#
#    0 AMB  25-3:1068     0 AMB  25-1:1068   2.80    (#   1068:25  Double Ambig)
 &rst
  ixpk= 1068, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
 igr1= 828, 829, 828, 829, 828, 829,1099,1100,1099,1100,
        25,  26,
 igr2= 834, 835, 834, 835, 834, 835,1105,1106,1105,1106,
      1105,1106,
 &end
#
#    0 AMB  25-3:1070     0 AMB  25-1:1070   5.50    (#   1070:25  Double Ambig)
 &rst
  ixpk= 1070, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.64, r4=12.14,
 igr1= 775, 776, 777,  47,  48,  49, 779, 780, 781,
 igr2= 834, 835, 834, 835,1105,1106,1105,1106, 834, 835,
      
 &end
#
#   64 ASN  HA            0 AMB  25-1:1072   4.50    (#   1072:25  Single Ambig)
 &rst
  ixpk= 1072, nxpk= 25, iat=1054,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1105,1106,1105,1106,
 &end
#
#    0 AMB  25-3:1073     0 AMB  25-1:1073   4.50    (#   1073:25  Double Ambig)
 &rst
  ixpk= 1073, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.80, r4= 9.30,
 igr1=1045,1046,1045,1046,1045,1046,1097,
 igr2=1105,1106,1105,1106,1105,1106,1105,1106,
 &end
#
#    0 AMB  25-3:1078     0 AMB  25-1:1078   4.50    (#   1078:25  Double Ambig)
 &rst
  ixpk= 1078, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1290,1291,1301,1302,
 igr2=1169,1170,1169,1170,
 &end
#
#    0 AMB  25-3:1079     0 AMB  25-1:1079   5.50    (#   1079:25  Double Ambig)
 &rst
  ixpk= 1079, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1290,1291,1154,1155,
 igr2=1169,1170,1169,1170,
 &end
#
#    0 AMB  25-3:1080    71 GLY  HA-         5.50    (#   1080:25  Single Ambig)
 &rst
  ixpk= 1080, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1290,1291,1154,1155,
 igr2=1169,1170,
 &end
#
#    0 AMB  25-3:1081    71 GLY  HA-         5.50    (#   1081:25  Single Ambig)
 &rst
  ixpk= 1081, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1290,1291,1301,1302,
 igr2=1169,1170,
 &end
#
#   72 PHE  HN           71 GLY  HA+         5.50    (#   1082:25  Unique         3.05, 3.40 A)
 &rst
  ixpk= 1082, nxpk= 25, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1169,1170,
 &end
#
#   72 PHE  HN           71 GLY  HA-         5.50    (#   1083:25  Unique         3.05, 3.40 A)
 &rst
  ixpk= 1083, nxpk= 25, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1169,1170,
 &end
#
#    0 AMB  25-3:1084    71 GLY  HA-         4.50    (#   1084:25  Single Ambig)
 &rst
  ixpk= 1084, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1167,1297,
 igr2=1169,1170,
 &end
#
#    0 AMB  25-3:1085     0 AMB  25-1:1085   4.50    (#   1085:25  Double Ambig)
 &rst
  ixpk= 1085, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1167,1297,
 igr2=1169,1170,1169,1170,
 &end
#
#   12 ASN  HA           51 GLN  HA          4.50    (#   1086:25  Unique         2.05, 2.55 A)
 &rst
  ixpk= 1086, nxpk= 25, iat= 192, 857, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:1087    51 GLN  HA          4.50    (#   1087:25  Single Ambig)
 &rst
  ixpk= 1087, nxpk= 25, iat=  -1, 857, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 859, 860, 859, 860, 862, 863,
 &end
#
#    0 AMB  25-3:1089    51 GLN  HA          5.50    (#   1089:25  Single Ambig)
 &rst
  ixpk= 1089, nxpk= 25, iat=  -1, 857, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 160, 165, 158, 167,
 &end
#
#   52 ALA  HN           51 GLN  HA          3.50    (#   1090:25  Unique         2.31, 2.48 A)
 &rst
  ixpk= 1090, nxpk= 25, iat= 872, 857, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   51 GLN  HN           51 GLN  HA          5.50    (#   1091:25  Unique         2.80, 2.93 A)
 &rst
  ixpk= 1091, nxpk= 25, iat= 855, 857, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   48 MET  QE            0 AMB  25-1:1093   3.50    (#   1093:25  Single Ambig)
 &rst
  ixpk= 1093, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 818, 819, 820,
 igr2= 859, 860, 859, 860, 862, 863,
 &end
#
#    0 AMB  25-3:1094     0 AMB  25-1:1094   3.50    (#   1094:25  Double Ambig)
 &rst
  ixpk= 1094, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr1= 789, 790, 811, 812, 811, 812, 811, 812,
 igr2= 859, 860, 859, 860, 862, 863, 859, 860, 859, 860,
      
 &end
#
#   12 ASN  HA            0 AMB  25-1:1096   4.50    (#   1096:25  Single Ambig)
 &rst
  ixpk= 1096, nxpk= 25, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 862, 863, 859, 860, 859, 860,
 &end
#
#   51 GLN  HE2-          0 AMB  25-1:1097   5.50    (#   1097:25  Single Ambig)
 &rst
  ixpk= 1097, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 867, 868,
 igr2= 859, 860, 859, 860, 862, 863,
 &end
#
#   51 GLN  HN            0 AMB  25-1:1098   5.50    (#   1098:25  Single Ambig)
 &rst
  ixpk= 1098, nxpk= 25, iat= 855,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 859, 860, 859, 860, 862, 863,
 &end
#
#   51 GLN  HA            0 AMB  25-1:1100   5.50    (#   1100:25  Single Ambig)
 &rst
  ixpk= 1100, nxpk= 25, iat= 857,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 859, 860, 859, 860, 862, 863,
 &end
#
#    0 AMB  25-3:1101     0 AMB  25-1:1101   5.50    (#   1101:25  Double Ambig)
 &rst
  ixpk= 1101, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.88, r4=11.38,
 igr1= 194, 195, 154, 155, 154, 155, 194, 195, 194, 195,
      
 igr2= 862, 863, 859, 860, 859, 860,
 &end
#
#   11 ILE  HB            0 AMB  25-1:1102   5.50    (#   1102:25  Single Ambig)
 &rst
  ixpk= 1102, nxpk= 25, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 862, 863, 859, 860, 859, 860,
 &end
#
#    0 AMB  25-3:1103     0 AMB  25-1:1103   5.50    (#   1103:25  Double Ambig)
 &rst
  ixpk= 1103, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.77, r4=12.27,
 igr1= 792, 793, 792, 793, 792, 793, 222, 223, 222, 223,
       222, 223,
 igr2= 859, 860, 859, 860, 862, 863, 859, 860,
 &end
#
#   42 ALA  QB           52 ALA  HA          5.50    (#   1107:25  Unique         3.14, 4.30 A)
 &rst
  ixpk= 1107, nxpk= 25, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 705, 706, 707,
 &end
#
#   53 PHE  HN           52 ALA  HA          3.50    (#   1108:25  Unique         2.01, 2.31 A)
 &rst
  ixpk= 1108, nxpk= 25, iat= 882, 874, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   10 TYR  QD           52 ALA  HA          7.00    (#   1110:25  Unique         4.86, 7.57 A)
 &rst
  ixpk= 1110, nxpk= 25, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 158, 167,
 &end
#
#    0 AMB  25-3:1112    52 ALA  QB          3.50    (#   1112:25  Single Ambig)
 &rst
  ixpk= 1112, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233, 464, 465, 466,
 igr2= 876, 877, 878,
 &end
#
#    0 AMB  25-3:1113    52 ALA  QB          3.50    (#   1113:25  Single Ambig)
 &rst
  ixpk= 1113, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233, 464, 465, 466,
 igr2= 876, 877, 878,
 &end
#
#    0 AMB  25-3:1114    52 ALA  QB          2.80    (#   1114:25  Single Ambig)
 &rst
  ixpk= 1114, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 igr2= 876, 877, 878,
 &end
#
#    0 AMB  25-3:1115    52 ALA  QB          2.80    (#   1115:25  Single Ambig)
 &rst
  ixpk= 1115, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 390, 391, 392, 177, 178, 179,
 igr2= 876, 877, 878,
 &end
#
#    0 AMB  25-3:1116     0 AMB  25-1:1116   3.50    (#   1116:25  Double Ambig)
 &rst
  ixpk= 1116, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 928, 929, 175,
 igr2= 123, 124, 125, 876, 877, 878,
 &end
#
#    0 AMB  25-3:1117     8 THR  QG2         4.50    (#   1117:25  Single Ambig)
 &rst
  ixpk= 1117, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 886, 887, 886, 887,
 igr2= 123, 124, 125,
 &end
#
#    8 THR  HB            8 THR  QG2         5.50    (#   1118:25  Unique         2.32, 2.67 A)
 &rst
  ixpk= 1118, nxpk= 25, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 123, 124, 125,
 &end
#
#   52 ALA  HA           52 ALA  QB          3.50    (#   1120:25  Unique         2.35, 2.66 A)
 &rst
  ixpk= 1120, nxpk= 25, iat= 874,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 876, 877, 878,
 &end
#
#    0 AMB  25-3:1121     0 AMB  25-1:1121   2.80    (#   1121:25  Double Ambig)
 &rst
  ixpk= 1121, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 131, 882,
 igr2= 123, 124, 125, 876, 877, 878,
 &end
#
#   54 VAL  QG-          52 ALA  QB          5.50    (#   1123:25  Unique         3.17, 6.58 A)
 &rst
  ixpk= 1123, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 876, 877, 878,
 &end
#
#    0 AMB  25-3:1124    52 ALA  QB          3.50    (#   1124:25  Single Ambig)
 &rst
  ixpk= 1124, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 705, 706, 707, 181, 182,
 igr2= 876, 877, 878,
 &end
#
#    0 AMB  25-3:1125    52 ALA  QB          5.50    (#   1125:25  Single Ambig)
 &rst
  ixpk= 1125, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.14, r4= 9.64,
 igr1= 818, 819, 820,1308,1309,1310, 462,
 igr2= 876, 877, 878,
 &end
#
#   23 LEU  HG           52 ALA  QB          5.50    (#   1126:25  Unique         2.54, 3.70 A)
 &rst
  ixpk= 1126, nxpk= 25, iat= 388,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 876, 877, 878,
 &end
#
#   53 PHE  QE            8 THR  QG2         5.50    (#   1128:25  Unique         4.32, 6.75 A)
 &rst
  ixpk= 1128, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 892, 896,
 igr2= 123, 124, 125,
 &end
#
#   10 TYR  HA           53 PHE  HA          5.50    (#   1129:25  Unique         2.51, 2.91 A)
 &rst
  ixpk= 1129, nxpk= 25, iat= 152, 884, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1130    53 PHE  HA          3.50    (#   1130:25  Single Ambig)
 &rst
  ixpk= 1130, nxpk= 25, iat=  -1, 884, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 886, 887, 886, 887,
 &end
#
#    0 AMB  25-3:1131    53 PHE  HA          5.50    (#   1131:25  Single Ambig)
 &rst
  ixpk= 1131, nxpk= 25, iat=  -1, 884, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 906, 676, 677, 676, 677,
 &end
#
#    0 AMB  25-3:1132    53 PHE  HA          5.50    (#   1132:25  Single Ambig)
 &rst
  ixpk= 1132, nxpk= 25, iat=  -1, 884, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 908, 909, 910, 912, 913, 914, 144, 145, 146,
 &end
#
#   54 VAL  HN           53 PHE  HA          3.50    (#   1134:25  Unique         2.09, 2.24 A)
 &rst
  ixpk= 1134, nxpk= 25, iat= 902, 884, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   11 ILE  HN           53 PHE  HA          5.50    (#   1135:25  Unique         3.13, 3.38 A)
 &rst
  ixpk= 1135, nxpk= 25, iat= 171, 884, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    9 ILE  HG1+         53 PHE  HA          5.50    (#   1136:25  Unique         3.89, 4.73 A)
 &rst
  ixpk= 1136, nxpk= 25, iat=  -1, 884, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 141, 142,
 &end
#
#    0 AMB  25-3:1137     0 AMB  25-1:1137   5.50    (#   1137:25  Double Ambig)
 &rst
  ixpk= 1137, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 882, 190, 685,
 igr2= 886, 887, 886, 887, 194, 195, 886, 887,
 &end
#
#    0 AMB  25-3:1138     0 AMB  25-1:1138   4.50    (#   1138:25  Double Ambig)
 &rst
  ixpk= 1138, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 204, 902,
 igr2= 194, 195, 886, 887, 886, 887,
 &end
#
#    8 THR  HA            0 AMB  25-1:1141   5.50    (#   1141:25  Single Ambig)
 &rst
  ixpk= 1141, nxpk= 25, iat= 119,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 886, 887, 886, 887,
 &end
#
#   53 PHE  HA            0 AMB  25-1:1142   5.50    (#   1142:25  Single Ambig)
 &rst
  ixpk= 1142, nxpk= 25, iat= 884,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 886, 887, 886, 887,
 &end
#
#   41 VAL  HB            0 AMB  25-1:1145   5.50    (#   1145:25  Single Ambig)
 &rst
  ixpk= 1145, nxpk= 25, iat= 689,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 886, 887, 886, 887,
 &end
#
#   61 SER  HB-          61 SER  HA          4.50    (#   1147:25  Unique         2.35, 2.74 A)
 &rst
  ixpk= 1147, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1024,1025,
 &end
#
#   64 ASN  HB-          61 SER  HA          4.50    (#   1148:25  Unique         2.25, 3.17 A)
 &rst
  ixpk= 1148, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1056,1057,
 &end
#
#    0 AMB  25-3:1150    61 SER  HA          4.50    (#   1150:25  Single Ambig)
 &rst
  ixpk= 1150, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1020,1061,1062,
 &end
#
#   55 ILE  HN           54 VAL  HA          4.50    (#   1151:25  Unique         1.84, 2.07 A)
 &rst
  ixpk= 1151, nxpk= 25, iat= 918, 904, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   62 ALA  HN           61 SER  HA          5.50    (#   1152:25  Unique         3.59, 3.61 A)
 &rst
  ixpk= 1152, nxpk= 25, iat=1031,1022, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1153    54 VAL  HB          5.50    (#   1153:25  Single Ambig)
 &rst
  ixpk= 1153, nxpk= 25, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 666, 474,
 &end
#
#    0 AMB  25-3:1155    54 VAL  HB          5.50    (#   1155:25  Single Ambig)
 &rst
  ixpk= 1155, nxpk= 25, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1= 141, 142, 181, 182, 705, 706, 707,
 &end
#
#    0 AMB  25-3:1156    54 VAL  HB          5.50    (#   1156:25  Single Ambig)
 &rst
  ixpk= 1156, nxpk= 25, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 876, 877, 878, 123, 124, 125,
 &end
#
#   54 VAL  QG+          54 VAL  HB          4.50    (#   1158:25  Unique         2.18, 2.64 A)
 &rst
  ixpk= 1158, nxpk= 25, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 908, 909, 910, 912, 913, 914,
 &end
#
#   37 ILE  QD1          54 VAL  QG+         3.50    (#   1160:25  Unique         2.22, 4.67 A)
 &rst
  ixpk= 1160, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 629, 630, 631,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1161     0 AMB  25-1:1161   3.50    (#   1161:25  Double Ambig)
 &rst
  ixpk= 1161, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.17, r4= 8.67,
 igr1= 622, 623, 624, 464, 465, 466, 468, 469, 470,
 igr2= 908, 909, 910, 912, 913, 914, 908, 909, 910, 912,
       913, 914, 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1162     0 AMB  25-1:1162   3.50    (#   1162:25  Double Ambig)
 &rst
  ixpk= 1162, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 672, 673, 674, 679, 680, 681,
 igr2= 908, 909, 910, 912, 913, 914, 908, 909, 910, 912,
       913, 914,
 &end
#
#    0 AMB  25-3:1163     0 AMB  25-1:1163   4.50    (#   1163:25  Double Ambig)
 &rst
  ixpk= 1163, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.30, r4=10.80,
 igr1= 181, 182, 137, 138, 139, 390, 391, 392,
 igr2= 908, 909, 910, 912, 913, 914, 908, 909, 910, 912,
       913, 914, 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1164     0 AMB  25-1:1164   5.50    (#   1164:25  Double Ambig)
 &rst
  ixpk= 1164, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.59, r4=13.09,
 igr1= 181, 182, 137, 138, 139, 390, 391, 392,
 igr2= 908, 909, 910, 912, 913, 914, 908, 909, 910, 912,
       913, 914, 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1165     0 AMB  25-1:1165   3.50    (#   1165:25  Double Ambig)
 &rst
  ixpk= 1165, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 676, 677, 676, 677, 906,
 igr2= 908, 909, 910, 912, 913, 914, 908, 909, 910, 912,
       913, 914, 908, 909, 910, 912, 913, 914,
 &end
#
#   37 ILE  HG1+         54 VAL  QG+         5.50    (#   1166:25  Unique         2.39, 5.33 A)
 &rst
  ixpk= 1166, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 626, 627,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   31 PHE  HB-          54 VAL  QG+         5.50    (#   1167:25  Unique         3.75, 5.57 A)
 &rst
  ixpk= 1167, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 528, 529,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   54 VAL  HA           54 VAL  QG+         4.50    (#   1168:25  Unique         2.29, 3.59 A)
 &rst
  ixpk= 1168, nxpk= 25, iat= 904,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   56 PHE  QE           54 VAL  QG+         4.50    (#   1169:25  Unique         2.26, 4.48 A)
 &rst
  ixpk= 1169, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 947, 951,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   55 ILE  HN           54 VAL  QG+         4.50    (#   1171:25  Unique         1.98, 4.15 A)
 &rst
  ixpk= 1171, nxpk= 25, iat= 918,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1172     0 AMB  25-1:1172   5.50    (#   1172:25  Double Ambig)
 &rst
  ixpk= 1172, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 902, 131,
 igr2= 908, 909, 910, 912, 913, 914, 908, 909, 910, 912,
       913, 914,
 &end
#
#   40 ILE  HA           54 VAL  QG+         5.50    (#   1173:25  Unique         2.33, 4.77 A)
 &rst
  ixpk= 1173, nxpk= 25, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   56 PHE  QD           54 VAL  QG+         4.50    (#   1174:25  Unique         2.58, 5.81 A)
 &rst
  ixpk= 1174, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 945, 953,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   39 ASP  HN           54 VAL  QG+         5.50    (#   1175:25  Unique         3.79, 6.11 A)
 &rst
  ixpk= 1175, nxpk= 25, iat= 654,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   27 LEU  HB-          54 VAL  QG+         5.50    (#   1176:25  Unique         3.01, 5.42 A)
 &rst
  ixpk= 1176, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 459, 460,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   37 ILE  HG1-         54 VAL  QG-         4.50    (#   1178:25  Unique         2.39, 5.33 A)
 &rst
  ixpk= 1178, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 626, 627,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1179    54 VAL  QG-         2.80    (#   1179:25  Single Ambig)
 &rst
  ixpk= 1179, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 622, 623, 624, 184, 185, 186,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1180    54 VAL  QG-         3.50    (#   1180:25  Single Ambig)
 &rst
  ixpk= 1180, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 672, 673, 674, 679, 680, 681,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   23 LEU  QD2          54 VAL  QG-         4.50    (#   1181:25  Unique         4.53, 7.38 A)
 &rst
  ixpk= 1181, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 394, 395, 396,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   27 LEU  HB-          54 VAL  QG-         4.50    (#   1182:25  Unique         3.01, 5.42 A)
 &rst
  ixpk= 1182, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 459, 460,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1183    54 VAL  QG-         3.50    (#   1183:25  Single Ambig)
 &rst
  ixpk= 1183, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 676, 677, 906,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   54 VAL  HA           54 VAL  QG-         3.50    (#   1184:25  Unique         2.29, 3.59 A)
 &rst
  ixpk= 1184, nxpk= 25, iat= 904,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1185    54 VAL  QG-         4.50    (#   1185:25  Single Ambig)
 &rst
  ixpk= 1185, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 902, 131, 882,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   40 ILE  HA           54 VAL  QG-         5.50    (#   1186:25  Unique         2.33, 4.77 A)
 &rst
  ixpk= 1186, nxpk= 25, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#   55 ILE  QG2          55 ILE  HA          4.50    (#   1188:25  Unique         2.42, 3.12 A)
 &rst
  ixpk= 1188, nxpk= 25, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 924, 925, 926,
 &end
#
#   55 ILE  HG1-         55 ILE  HA          4.50    (#   1189:25  Unique         2.15, 3.32 A)
 &rst
  ixpk= 1189, nxpk= 25, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 928, 929,
 &end
#
#   56 PHE  HA           55 ILE  HA          5.50    (#   1191:25  Unique         4.30, 4.51 A)
 &rst
  ixpk= 1191, nxpk= 25, iat= 939, 920, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    8 THR  HA           55 ILE  HA          4.50    (#   1193:25  Unique         2.12, 2.26 A)
 &rst
  ixpk= 1193, nxpk= 25, iat= 119, 920, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   66 LEU  HN           63 SER  HA          4.50    (#   1194:25  Unique         2.30, 3.52 A)
 &rst
  ixpk= 1194, nxpk= 25, iat=1076,1043, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   56 PHE  HN           55 ILE  HA          4.50    (#   1196:25  Unique         2.16, 2.28 A)
 &rst
  ixpk= 1196, nxpk= 25, iat= 937, 920, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:1197    55 ILE  HA          5.50    (#   1197:25  Single Ambig)
 &rst
  ixpk= 1197, nxpk= 25, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 131, 902,
 &end
#
#    0 AMB  25-3:1198    55 ILE  HA          5.50    (#   1198:25  Single Ambig)
 &rst
  ixpk= 1198, nxpk= 25, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 141, 142, 639, 640,
 &end
#
#   38 LEU  HB+          55 ILE  HB          4.50    (#   1199:25  Unique         2.98, 4.23 A)
 &rst
  ixpk= 1199, nxpk= 25, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 639, 640,
 &end
#
#    0 AMB  25-3:1200    55 ILE  HB          2.80    (#   1200:25  Single Ambig)
 &rst
  ixpk= 1200, nxpk= 25, iat=  -1, 922, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 924, 925, 926, 931, 932, 933, 644, 645, 646, 648,
       649, 650,
 &end
#
#   39 ASP  HN           55 ILE  HB          4.50    (#   1201:25  Unique         2.31, 2.48 A)
 &rst
  ixpk= 1201, nxpk= 25, iat= 654, 922, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   55 ILE  HN           55 ILE  HB          5.50    (#   1202:25  Unique         2.20, 2.47 A)
 &rst
  ixpk= 1202, nxpk= 25, iat= 918, 922, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1203     0 AMB  25-1:1203   2.80    (#   1203:25  Double Ambig)
 &rst
  ixpk= 1203, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 931, 932, 933, 924, 925, 926,
 igr2= 928, 929, 928, 929,
 &end
#
#    0 AMB  25-3:1204     0 AMB  25-1:1204   2.80    (#   1204:25  Double Ambig)
 &rst
  ixpk= 1204, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 644, 645, 646, 648, 649, 650, 931, 932, 933, 924,
       925, 926,
 igr2= 642, 928, 929,
 &end
#
#    8 THR  QG2          55 ILE  HG1+        5.50    (#   1205:25  Unique         1.90, 3.71 A)
 &rst
  ixpk= 1205, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 123, 124, 125,
 igr2= 928, 929,
 &end
#
#    8 THR  QG2          55 ILE  HG1-        4.50    (#   1206:25  Unique         1.90, 3.71 A)
 &rst
  ixpk= 1206, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 123, 124, 125,
 igr2= 928, 929,
 &end
#
#   39 ASP  HN            0 AMB  25-1:1209   5.50    (#   1209:25  Single Ambig)
 &rst
  ixpk= 1209, nxpk= 25, iat= 654,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 642, 928, 929,
 &end
#
#    8 THR  QG2          55 ILE  QD1         3.50    (#   1210:25  Unique         2.29, 3.98 A)
 &rst
  ixpk= 1210, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 123, 124, 125,
 igr2= 931, 932, 933,
 &end
#
#   55 ILE  HG1-         55 ILE  QD1         3.50    (#   1211:25  Unique         2.23, 2.66 A)
 &rst
  ixpk= 1211, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 928, 929,
 igr2= 931, 932, 933,
 &end
#
#   55 ILE  HG1+         55 ILE  QD1         3.50    (#   1212:25  Unique         2.23, 2.66 A)
 &rst
  ixpk= 1212, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 928, 929,
 igr2= 931, 932, 933,
 &end
#
#    0 AMB  25-3:1213    55 ILE  QD1         3.50    (#   1213:25  Single Ambig)
 &rst
  ixpk= 1213, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 689, 676, 677, 670,
 igr2= 931, 932, 933,
 &end
#
#   55 ILE  HB           55 ILE  QD1         3.50    (#   1214:25  Unique         2.35, 3.28 A)
 &rst
  ixpk= 1214, nxpk= 25, iat= 922,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 931, 932, 933,
 &end
#
#   39 ASP  HB-          55 ILE  QD1         4.50    (#   1215:25  Unique         2.48, 4.41 A)
 &rst
  ixpk= 1215, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 658, 659,
 igr2= 931, 932, 933,
 &end
#
#    0 AMB  25-3:1216    55 ILE  QD1         4.50    (#   1216:25  Single Ambig)
 &rst
  ixpk= 1216, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 886, 887, 886, 887,
 igr2= 931, 932, 933,
 &end
#
#   39 ASP  HB+          55 ILE  QD1         4.50    (#   1217:25  Unique         2.48, 4.41 A)
 &rst
  ixpk= 1217, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 658, 659,
 igr2= 931, 932, 933,
 &end
#
#   55 ILE  HN           55 ILE  QD1         5.50    (#   1218:25  Unique         2.41, 3.17 A)
 &rst
  ixpk= 1218, nxpk= 25, iat= 918,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 931, 932, 933,
 &end
#
#   56 PHE  HN           55 ILE  QD1         5.50    (#   1219:25  Unique         5.49, 6.23 A)
 &rst
  ixpk= 1219, nxpk= 25, iat= 937,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 931, 932, 933,
 &end
#
#    0 AMB  25-3:1220    55 ILE  QD1         5.50    (#   1220:25  Single Ambig)
 &rst
  ixpk= 1220, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 622, 623, 624, 464, 465, 466,
 igr2= 931, 932, 933,
 &end
#
#   56 PHE  HN           55 ILE  QG2         5.50    (#   1224:25  Unique         2.54, 3.45 A)
 &rst
  ixpk= 1224, nxpk= 25, iat= 937,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 924, 925, 926,
 &end
#
#    7 GLN  HE2-         55 ILE  QG2         5.50    (#   1226:25  Unique         2.76, 4.52 A)
 &rst
  ixpk= 1226, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 112, 113,
 igr2= 924, 925, 926,
 &end
#
#    0 AMB  25-3:1227    55 ILE  QG2         5.50    (#   1227:25  Single Ambig)
 &rst
  ixpk= 1227, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 107, 108, 658, 659,
 igr2= 924, 925, 926,
 &end
#
#   32 SER  HA           56 PHE  HB-         7.00    (#   1229:25  Unique         6.13, 7.41 A)
 &rst
  ixpk= 1229, nxpk= 25, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 941, 942,
 &end
#
#    0 AMB  25-3:1230     0 AMB  25-1:1230   4.50    (#   1230:25  Double Ambig)
 &rst
  ixpk= 1230, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1182,1190, 945, 953,
 igr2=1178,1179, 941, 942,
 &end
#
#   72 PHE  HN           72 PHE  HB-         5.50    (#   1231:25  Unique         2.14, 2.50 A)
 &rst
  ixpk= 1231, nxpk= 25, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1178,1179,
 &end
#
#   56 PHE  QD           56 PHE  HB-         5.50    (#   1232:25  Unique         2.24, 3.08 A)
 &rst
  ixpk= 1232, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 945, 953,
 igr2= 941, 942,
 &end
#
#   56 PHE  HN           56 PHE  HB+         5.50    (#   1233:25  Unique         2.22, 3.12 A)
 &rst
  ixpk= 1233, nxpk= 25, iat= 937,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 941, 942,
 &end
#
#   38 LEU  QD+          57 LYS  HA          3.50    (#   1234:25  Unique         2.27, 4.25 A)
 &rst
  ixpk= 1234, nxpk= 25, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 644, 645, 646, 648, 649, 650,
 &end
#
#    0 AMB  25-3:1235    57 LYS  HA          4.50    (#   1235:25  Single Ambig)
 &rst
  ixpk= 1235, nxpk= 25, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 639, 640, 642,
 &end
#
#    0 AMB  25-3:1236    57 LYS  HA          2.80    (#   1236:25  Single Ambig)
 &rst
  ixpk= 1236, nxpk= 25, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 964, 965, 964, 965, 961, 962,
 &end
#
#   57 LYS  HB+          57 LYS  HA          5.50    (#   1237:25  Unique         2.35, 2.49 A)
 &rst
  ixpk= 1237, nxpk= 25, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 961, 962,
 &end
#
#    7 GLN  HE2+         57 LYS  HA          5.50    (#   1238:25  Unique         2.64, 3.67 A)
 &rst
  ixpk= 1238, nxpk= 25, iat=  -1, 959, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 112, 113,
 &end
#
#   57 LYS  HA           57 LYS  HB-         5.50    (#   1242:25  Unique         2.35, 2.49 A)
 &rst
  ixpk= 1242, nxpk= 25, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 961, 962,
 &end
#
#   57 LYS  HA           57 LYS  HB+         3.50    (#   1243:25  Unique         2.35, 2.49 A)
 &rst
  ixpk= 1243, nxpk= 25, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 961, 962,
 &end
#
#   57 LYS  HN           57 LYS  HB+         4.50    (#   1244:25  Unique         2.41, 3.08 A)
 &rst
  ixpk= 1244, nxpk= 25, iat= 957,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 961, 962,
 &end
#
#   57 LYS  HN           57 LYS  HB-         5.50    (#   1245:25  Unique         2.41, 3.08 A)
 &rst
  ixpk= 1245, nxpk= 25, iat= 957,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 961, 962,
 &end
#
#   59 ILE  HN           57 LYS  HB+         7.00    (#   1246:25  Unique         6.93, 7.63 A)
 &rst
  ixpk= 1246, nxpk= 25, iat= 994,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 961, 962,
 &end
#
#    0 AMB  25-3:1248     0 AMB  25-1:1248   3.50    (#   1248:25  Double Ambig)
 &rst
  ixpk= 1248, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 967, 968, 967, 968,
 igr2= 961, 962, 961, 962,
 &end
#
#    0 AMB  25-3:1249    57 LYS  HB-         3.50    (#   1249:25  Single Ambig)
 &rst
  ixpk= 1249, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 967, 968, 967, 968,
 igr2= 961, 962,
 &end
#
#    0 AMB  25-3:1250     0 AMB  25-1:1250   2.80    (#   1250:25  Double Ambig)
 &rst
  ixpk= 1250, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 961, 962, 961, 962,
 igr2= 964, 965, 964, 965,
 &end
#
#    0 AMB  25-3:1251     0 AMB  25-1:1251   2.80    (#   1251:25  Double Ambig)
 &rst
  ixpk= 1251, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 276, 277, 276, 277, 967, 968, 967, 968, 967, 968,
      
 igr2= 273, 274, 273, 274, 964, 965, 964, 965, 964, 965,
      
 &end
#
#    0 AMB  25-3:1252     0 AMB  25-1:1252   3.50    (#   1252:25  Double Ambig)
 &rst
  ixpk= 1252, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
 igr1= 970, 971, 970, 971, 970, 971, 279, 280, 279, 280,
      
 igr2= 964, 965, 964, 965, 964, 965, 273, 274, 273, 274,
      
 &end
#
#    0 AMB  25-3:1253     0 AMB  25-1:1253   3.50    (#   1253:25  Double Ambig)
 &rst
  ixpk= 1253, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 309, 268,1022,
 igr2= 737, 738, 273, 274, 964, 965, 964, 965,
 &end
#
#   57 LYS  HA            0 AMB  25-1:1254   4.50    (#   1254:25  Single Ambig)
 &rst
  ixpk= 1254, nxpk= 25, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 964, 965, 964, 965,
 &end
#
#    0 AMB  25-3:1255     0 AMB  25-1:1255   5.50    (#   1255:25  Double Ambig)
 &rst
  ixpk= 1255, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 983, 984, 983, 984, 986, 987,
 igr2= 964, 965, 964, 965, 964, 965,
 &end
#
#   57 LYS  HN            0 AMB  25-1:1257   5.50    (#   1257:25  Single Ambig)
 &rst
  ixpk= 1257, nxpk= 25, iat= 957,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 964, 965, 964, 965,
 &end
#
#   56 PHE  QD            0 AMB  25-1:1260   5.50    (#   1260:25  Single Ambig)
 &rst
  ixpk= 1260, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 945, 953,
 igr2= 964, 965, 964, 965,
 &end
#
#    0 AMB  25-3:1261     0 AMB  25-1:1261   5.50    (#   1261:25  Double Ambig)
 &rst
  ixpk= 1261, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 986, 987, 986, 987,
 igr2= 964, 965, 964, 965,
 &end
#
#   36 GLN  HG-           0 AMB  25-1:1262   4.50    (#   1262:25  Single Ambig)
 &rst
  ixpk= 1262, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 606, 607,
 igr2= 967, 968, 967, 968,
 &end
#
#   57 LYS  HA            0 AMB  25-1:1263   5.50    (#   1263:25  Single Ambig)
 &rst
  ixpk= 1263, nxpk= 25, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 967, 968, 967, 968,
 &end
#
#    0 AMB  25-3:1268     0 AMB  25-1:1268   3.50    (#   1268:25  Double Ambig)
 &rst
  ixpk= 1268, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 298, 299, 691, 692, 693, 695, 696, 697,
 igr2= 279, 280, 279, 280, 342, 343,
 &end
#
#    0 AMB  25-3:1270     0 AMB  25-1:1270   3.50    (#   1270:25  Double Ambig)
 &rst
  ixpk= 1270, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 606, 607, 358, 359,
 igr2= 970, 971, 970, 971, 413, 414,
 &end
#
#   58 GLU  HA           58 GLU  HB+         4.50    (#   1281:25  Unique         2.50, 2.83 A)
 &rst
  ixpk= 1281, nxpk= 25, iat= 981,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 983, 984,
 &end
#
#   61 SER  HN           58 GLU  HB-         5.50    (#   1282:25  Unique         2.22, 3.24 A)
 &rst
  ixpk= 1282, nxpk= 25, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 983, 984,
 &end
#
#   58 GLU  HN           58 GLU  HB-         4.50    (#   1283:25  Unique         2.77, 3.22 A)
 &rst
  ixpk= 1283, nxpk= 25, iat= 979,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 983, 984,
 &end
#
#   58 GLU  HN           58 GLU  HB+         5.50    (#   1284:25  Unique         2.77, 3.22 A)
 &rst
  ixpk= 1284, nxpk= 25, iat= 979,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 983, 984,
 &end
#
#   58 GLU  HA            0 AMB  25-1:1285   3.50    (#   1285:25  Single Ambig)
 &rst
  ixpk= 1285, nxpk= 25, iat= 981,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 986, 987, 107, 108,
 &end
#
#   58 GLU  HA           58 GLU  HG-         3.50    (#   1286:25  Unique         2.27, 3.03 A)
 &rst
  ixpk= 1286, nxpk= 25, iat= 981,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 986, 987,
 &end
#
#   58 GLU  HN           58 GLU  HG-         5.50    (#   1287:25  Unique         3.42, 4.50 A)
 &rst
  ixpk= 1287, nxpk= 25, iat= 979,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 986, 987,
 &end
#
#    0 AMB  25-3:1289     0 AMB  25-1:1289   4.50    (#   1289:25  Double Ambig)
 &rst
  ixpk= 1289, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 961, 962, 429, 430,
 igr2= 986, 987, 373, 374,
 &end
#
#    0 AMB  25-3:1290    58 GLU  HG-         4.50    (#   1290:25  Single Ambig)
 &rst
  ixpk= 1290, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 964, 965, 964, 965, 961, 962,
 igr2= 986, 987,
 &end
#
#    0 AMB  25-3:1291    59 ILE  HA          3.50    (#   1291:25  Single Ambig)
 &rst
  ixpk= 1291, nxpk= 25, iat=  -1, 996, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1035,1036,1037, 998,
 &end
#
#    0 AMB  25-3:1292    59 ILE  HA          3.50    (#   1292:25  Single Ambig)
 &rst
  ixpk= 1292, nxpk= 25, iat=  -1, 996, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1004,1005,1007,1008,1009, 137, 138, 139,
 &end
#
#    7 GLN  HA           59 ILE  HA          4.50    (#   1293:25  Unique         2.27, 2.59 A)
 &rst
  ixpk= 1293, nxpk= 25, iat= 102, 996, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 PRO  HA           59 ILE  HA          5.50    (#   1294:25  Unique         4.05, 4.48 A)
 &rst
  ixpk= 1294, nxpk= 25, iat=  82, 996, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   59 ILE  HN           59 ILE  HA          5.50    (#   1296:25  Unique         2.81, 2.84 A)
 &rst
  ixpk= 1296, nxpk= 25, iat= 994, 996, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1297    59 ILE  HB          2.80    (#   1297:25  Single Ambig)
 &rst
  ixpk= 1297, nxpk= 25, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1=1004,1005,1007,1008,1009,
 &end
#
#   59 ILE  QG2          59 ILE  HB          3.50    (#   1298:25  Unique         2.36, 2.66 A)
 &rst
  ixpk= 1298, nxpk= 25, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1000,1001,1002,
 &end
#
#    0 AMB  25-3:1300    59 ILE  HB          4.50    (#   1300:25  Single Ambig)
 &rst
  ixpk= 1300, nxpk= 25, iat=  -1, 998, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 994,1013,
 &end
#
#    0 AMB  25-3:1303     0 AMB  25-1:1303   4.50    (#   1303:25  Double Ambig)
 &rst
  ixpk= 1303, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 994,1013,
 igr2=1004,1005,1004,1005,
 &end
#
#    0 AMB  25-3:1304    59 ILE  HG1-        5.50    (#   1304:25  Single Ambig)
 &rst
  ixpk= 1304, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 994,1013,
 igr2=1004,1005,
 &end
#
#    6 ASN  HA           59 ILE  HG1-        5.50    (#   1305:25  Unique         5.45, 6.02 A)
 &rst
  ixpk= 1305, nxpk= 25, iat=  88,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1004,1005,
 &end
#
#    6 ASN  HA           59 ILE  HG1+        5.50    (#   1306:25  Unique         5.45, 6.02 A)
 &rst
  ixpk= 1306, nxpk= 25, iat=  88,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1004,1005,
 &end
#
#    0 AMB  25-3:1308    59 ILE  QD1         2.80    (#   1308:25  Single Ambig)
 &rst
  ixpk= 1308, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1=1004,1005, 998,
 igr2=1007,1008,1009,
 &end
#
#    0 AMB  25-3:1310    59 ILE  QD1         4.50    (#   1310:25  Single Ambig)
 &rst
  ixpk= 1310, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=  73,  74, 996,
 igr2=1007,1008,1009,
 &end
#
#    6 ASN  HA           59 ILE  QD1         4.50    (#   1311:25  Unique         4.25, 5.48 A)
 &rst
  ixpk= 1311, nxpk= 25, iat=  88,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1007,1008,1009,
 &end
#
#    0 AMB  25-3:1313    59 ILE  QD1         5.50    (#   1313:25  Single Ambig)
 &rst
  ixpk= 1313, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 994,1013,
 igr2=1007,1008,1009,
 &end
#
#    5 PRO  HB+          59 ILE  QD1         4.50    (#   1314:25  Unique         2.22, 3.63 A)
 &rst
  ixpk= 1314, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  79,  80,
 igr2=1007,1008,1009,
 &end
#
#    5 PRO  HB+          59 ILE  QG2         3.50    (#   1318:25  Unique         4.05, 4.90 A)
 &rst
  ixpk= 1318, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=  79,  80,
 igr2=1000,1001,1002,
 &end
#
#   59 ILE  HB           59 ILE  QG2         2.80    (#   1319:25  Unique         2.36, 2.66 A)
 &rst
  ixpk= 1319, nxpk= 25, iat= 998,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1000,1001,1002,
 &end
#
#    5 PRO  HG-          59 ILE  QG2         5.50    (#   1320:25  Unique         6.15, 7.03 A)
 &rst
  ixpk= 1320, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  76,  77,
 igr2=1000,1001,1002,
 &end
#
#   59 ILE  HA           59 ILE  QG2         4.50    (#   1321:25  Unique         2.39, 3.12 A)
 &rst
  ixpk= 1321, nxpk= 25, iat= 996,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1000,1001,1002,
 &end
#
#   59 ILE  HN           59 ILE  QG2         4.50    (#   1322:25  Unique         2.11, 2.99 A)
 &rst
  ixpk= 1322, nxpk= 25, iat= 994,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1000,1001,1002,
 &end
#
#   60 GLY  HN           60 GLY  HA+         5.50    (#   1326:25  Unique         1.85, 2.58 A)
 &rst
  ixpk= 1326, nxpk= 25, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1015,1016,
 &end
#
#   60 GLY  HN           60 GLY  HA-         5.50    (#   1327:25  Unique         1.85, 2.58 A)
 &rst
  ixpk= 1327, nxpk= 25, iat=1013,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1015,1016,
 &end
#
#   61 SER  HN           60 GLY  HA+         5.50    (#   1328:25  Unique         2.51, 3.22 A)
 &rst
  ixpk= 1328, nxpk= 25, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1015,1016,
 &end
#
#   61 SER  HN           60 GLY  HA-         5.50    (#   1329:25  Unique         2.51, 3.22 A)
 &rst
  ixpk= 1329, nxpk= 25, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1015,1016,
 &end
#
#    0 AMB  25-3:1331    61 SER  HA          7.00    (#   1331:25  Single Ambig)
 &rst
  ixpk= 1331, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1054, 574,
 &end
#
#   61 SER  HB+          61 SER  HA          5.50    (#   1332:25  Unique         2.35, 2.74 A)
 &rst
  ixpk= 1332, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1024,1025,
 &end
#
#    0 AMB  25-3:1333    61 SER  HA          4.50    (#   1333:25  Single Ambig)
 &rst
  ixpk= 1333, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1056,1057,1056,1057,
 &end
#
#   54 VAL  QG+          54 VAL  HA          5.50    (#   1334:25  Unique         2.29, 3.59 A)
 &rst
  ixpk= 1334, nxpk= 25, iat=  -1, 904, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:1335    61 SER  HA          5.50    (#   1335:25  Single Ambig)
 &rst
  ixpk= 1335, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 594, 595,1015,1016,1045,1046,
 &end
#
#    0 AMB  25-3:1337    54 VAL  HA          5.50    (#   1337:25  Single Ambig)
 &rst
  ixpk= 1337, nxpk= 25, iat=  -1, 904, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 691, 692, 693, 695, 696, 697, 924, 925, 926, 390,
       391, 392,
 &end
#
#   64 ASN  HN           61 SER  HA          5.50    (#   1338:25  Unique         2.70, 3.37 A)
 &rst
  ixpk= 1338, nxpk= 25, iat=1052,1022, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   64 ASN  HD2+         61 SER  HA          5.50    (#   1339:25  Unique         4.26, 5.30 A)
 &rst
  ixpk= 1339, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1061,1062,
 &end
#
#   55 ILE  HN           54 VAL  HA          4.50    (#   1340:25  Unique         1.84, 2.07 A)
 &rst
  ixpk= 1340, nxpk= 25, iat= 918, 904, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   61 SER  HA           61 SER  HB+         5.50    (#   1341:25  Unique         2.35, 2.74 A)
 &rst
  ixpk= 1341, nxpk= 25, iat=1022,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1024,1025,
 &end
#
#   61 SER  HN           61 SER  HB+         5.50    (#   1345:25  Unique         2.52, 3.10 A)
 &rst
  ixpk= 1345, nxpk= 25, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1024,1025,
 &end
#
#    0 AMB  25-3:1346     0 AMB  25-1:1346   5.50    (#   1346:25  Double Ambig)
 &rst
  ixpk= 1346, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 939, 981,1068,
 igr2=1024,1025,1024,1025,1024,1025,
 &end
#
#   62 ALA  HN           62 ALA  HA          5.50    (#   1347:25  Unique         2.82, 2.84 A)
 &rst
  ixpk= 1347, nxpk= 25, iat=1031,1033, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   56 PHE  QD           62 ALA  HA          5.50    (#   1348:25  Unique         2.43, 3.58 A)
 &rst
  ixpk= 1348, nxpk= 25, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 945, 953,
 &end
#
#    0 AMB  25-3:1350     0 AMB  25-1:1350   4.50    (#   1350:25  Double Ambig)
 &rst
  ixpk= 1350, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 567, 568, 947, 951, 482, 491,
 igr2= 497,1033,
 &end
#
#    0 AMB  25-3:1351    29 ALA  HA          5.50    (#   1351:25  Single Ambig)
 &rst
  ixpk= 1351, nxpk= 25, iat=  -1, 497, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 435, 436, 435, 436,
 &end
#
#    9 ILE  QG2          62 ALA  HA          4.50    (#   1352:25  Unique         3.23, 4.05 A)
 &rst
  ixpk= 1352, nxpk= 25, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 137, 138, 139,
 &end
#
#   65 ALA  QB           62 ALA  HA          5.50    (#   1353:25  Unique         2.55, 3.73 A)
 &rst
  ixpk= 1353, nxpk= 25, iat=  -1,1033, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1070,1071,1072,
 &end
#
#    0 AMB  25-3:1354     0 AMB  25-1:1354   3.50    (#   1354:25  Double Ambig)
 &rst
  ixpk= 1354, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 499, 500, 501,1035,1036,1037,
 igr2= 497,1033,
 &end
#
#    9 ILE  QG2          62 ALA  QB          3.50    (#   1355:25  Unique         2.25, 3.89 A)
 &rst
  ixpk= 1355, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 137, 138, 139,
 igr2=1035,1036,1037,
 &end
#
#    5 PRO  HG-          62 ALA  QB          5.50    (#   1356:25  Unique         6.20, 7.90 A)
 &rst
  ixpk= 1356, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  76,  77,
 igr2=1035,1036,1037,
 &end
#
#    0 AMB  25-3:1357     0 AMB  25-1:1357   2.80    (#   1357:25  Double Ambig)
 &rst
  ixpk= 1357, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 497,1033,
 igr2= 499, 500, 501,1035,1036,1037,
 &end
#
#    0 AMB  25-3:1358    62 ALA  QB          4.50    (#   1358:25  Single Ambig)
 &rst
  ixpk= 1358, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 941, 942, 996,
 igr2=1035,1036,1037,
 &end
#
#   61 SER  HB+          62 ALA  QB          5.50    (#   1359:25  Unique         4.24, 5.68 A)
 &rst
  ixpk= 1359, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1024,1025,
 igr2=1035,1036,1037,
 &end
#
#    7 GLN  HA           62 ALA  QB          4.50    (#   1360:25  Unique         2.15, 3.33 A)
 &rst
  ixpk= 1360, nxpk= 25, iat= 102,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1035,1036,1037,
 &end
#
#   56 PHE  QD           62 ALA  QB          4.50    (#   1362:25  Unique         2.49, 4.73 A)
 &rst
  ixpk= 1362, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 945, 953,
 igr2=1035,1036,1037,
 &end
#
#   63 SER  HN           62 ALA  QB          4.50    (#   1363:25  Unique         2.33, 3.28 A)
 &rst
  ixpk= 1363, nxpk= 25, iat=1041,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1035,1036,1037,
 &end
#
#   62 ALA  HN           62 ALA  QB          3.50    (#   1364:25  Unique         2.41, 2.88 A)
 &rst
  ixpk= 1364, nxpk= 25, iat=1031,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1035,1036,1037,
 &end
#
#   59 ILE  QG2          62 ALA  QB          5.50    (#   1365:25  Unique         4.03, 5.98 A)
 &rst
  ixpk= 1365, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1000,1001,1002,
 igr2=1035,1036,1037,
 &end
#
#   30 ILE  HG1-         29 ALA  QB          5.50    (#   1366:25  Unique         2.20, 4.43 A)
 &rst
  ixpk= 1366, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 515, 516,
 igr2= 499, 500, 501,
 &end
#
#    0 AMB  25-3:1367    62 ALA  QB          5.50    (#   1367:25  Single Ambig)
 &rst
  ixpk= 1367, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1080,1081, 141, 142,
 igr2=1035,1036,1037,
 &end
#
#    0 AMB  25-3:1368    63 SER  HA          3.50    (#   1368:25  Single Ambig)
 &rst
  ixpk= 1368, nxpk= 25, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1045,1046,1045,1046,
 &end
#
#    0 AMB  25-3:1370    63 SER  HA          5.50    (#   1370:25  Single Ambig)
 &rst
  ixpk= 1370, nxpk= 25, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1070,1071,1072,1083,
 &end
#
#   66 LEU  MDX          63 SER  HA          5.50    (#   1371:25  Unique         3.08, 4.94 A)
 &rst
  ixpk= 1371, nxpk= 25, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HB+          63 SER  HA          5.50    (#   1372:25  Unique         1.99, 2.92 A)
 &rst
  ixpk= 1372, nxpk= 25, iat=  -1,1043, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1080,1081,
 &end
#
#   63 SER  HN            0 AMB  25-1:1376   3.50    (#   1376:25  Single Ambig)
 &rst
  ixpk= 1376, nxpk= 25, iat=1041,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1045,1046,1045,1046,
 &end
#
#   64 ASN  HN            0 AMB  25-1:1377   3.50    (#   1377:25  Single Ambig)
 &rst
  ixpk= 1377, nxpk= 25, iat=1052,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1045,1046,1045,1046,
 &end
#
#   63 SER  HA            0 AMB  25-1:1379   3.50    (#   1379:25  Single Ambig)
 &rst
  ixpk= 1379, nxpk= 25, iat=1043,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1045,1046,1045,1046,
 &end
#
#   64 ASN  HN           64 ASN  HA          3.50    (#   1384:25  Unique         2.83, 2.86 A)
 &rst
  ixpk= 1384, nxpk= 25, iat=1052,1054, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 LEU  HN           64 ASN  HA          5.50    (#   1385:25  Unique         4.50, 4.64 A)
 &rst
  ixpk= 1385, nxpk= 25, iat=1076,1054, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   68 THR  HN           64 ASN  HA          5.50    (#   1386:25  Unique         3.61, 3.87 A)
 &rst
  ixpk= 1386, nxpk= 25, iat=1119,1054, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   61 SER  HA           64 ASN  HA          5.50    (#   1390:25  Unique         4.69, 5.39 A)
 &rst
  ixpk= 1390, nxpk= 25, iat=1022,1054, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1391    64 ASN  HA          2.80    (#   1391:25  Single Ambig)
 &rst
  ixpk= 1391, nxpk= 25, iat=  -1,1054, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1056,1057,1056,1057,
 &end
#
#   67 ARG  HG-          64 ASN  HA          5.50    (#   1392:25  Unique         4.12, 5.37 A)
 &rst
  ixpk= 1392, nxpk= 25, iat=  -1,1054, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1102,1103,
 &end
#
#   67 ARG  HB+          64 ASN  HA          5.50    (#   1393:25  Unique         2.51, 3.59 A)
 &rst
  ixpk= 1393, nxpk= 25, iat=  -1,1054, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1099,1100,
 &end
#
#   67 ARG  HN           64 ASN  HA          5.50    (#   1394:25  Unique         3.41, 3.64 A)
 &rst
  ixpk= 1394, nxpk= 25, iat=1095,1054, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1395     0 AMB  25-1:1395   5.50    (#   1395:25  Double Ambig)
 &rst
  ixpk= 1395, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1= 576, 577, 576, 577,1033,
 igr2=1056,1057,1056,1057,1056,1057,
 &end
#
#   61 SER  HA            0 AMB  25-1:1396   5.50    (#   1396:25  Single Ambig)
 &rst
  ixpk= 1396, nxpk= 25, iat=1022,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1056,1057,1056,1057,
 &end
#
#   64 ASN  HA            0 AMB  25-1:1397   2.80    (#   1397:25  Single Ambig)
 &rst
  ixpk= 1397, nxpk= 25, iat=1054,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1056,1057,1056,1057,
 &end
#
#    0 AMB  25-3:1399     0 AMB  25-1:1399   4.50    (#   1399:25  Double Ambig)
 &rst
  ixpk= 1399, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1= 580, 588, 592,1095, 572,
 igr2=1056,1057,1056,1057,1056,1057,1056,1057,1056,1057,
      
 &end
#
#   64 ASN  HN            0 AMB  25-1:1400   3.50    (#   1400:25  Single Ambig)
 &rst
  ixpk= 1400, nxpk= 25, iat=1052,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1056,1057,1056,1057,
 &end
#
#    0 AMB  25-3:1401     0 AMB  25-1:1401   4.50    (#   1401:25  Double Ambig)
 &rst
  ixpk= 1401, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1061,1062,1061,1062,
 igr2=1056,1057,1056,1057,
 &end
#
#   65 ALA  HN            0 AMB  25-1:1402   3.50    (#   1402:25  Single Ambig)
 &rst
  ixpk= 1402, nxpk= 25, iat=1066,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1056,1057,1056,1057,
 &end
#
#    0 AMB  25-3:1404     0 AMB  25-1:1404   4.50    (#   1404:25  Double Ambig)
 &rst
  ixpk= 1404, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1061,1062,1061,1062,
 igr2=1056,1057,1056,1057,
 &end
#
#    0 AMB  25-3:1405     0 AMB  25-1:1405   4.50    (#   1405:25  Double Ambig)
 &rst
  ixpk= 1405, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1= 580, 588, 592,1095, 572,
 igr2=1056,1057,1056,1057,1056,1057,1056,1057,1056,1057,
      
 &end
#
#   64 ASN  HN            0 AMB  25-1:1406   3.50    (#   1406:25  Single Ambig)
 &rst
  ixpk= 1406, nxpk= 25, iat=1052,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1056,1057,1056,1057,
 &end
#
#   65 ALA  HN            0 AMB  25-1:1407   4.50    (#   1407:25  Single Ambig)
 &rst
  ixpk= 1407, nxpk= 25, iat=1066,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1056,1057,1056,1057,
 &end
#
#   64 ASN  HA            0 AMB  25-1:1408   3.50    (#   1408:25  Single Ambig)
 &rst
  ixpk= 1408, nxpk= 25, iat=1054,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1056,1057,1056,1057,
 &end
#
#   61 SER  HA            0 AMB  25-1:1409   5.50    (#   1409:25  Single Ambig)
 &rst
  ixpk= 1409, nxpk= 25, iat=1022,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1056,1057,1056,1057,
 &end
#
#    0 AMB  25-3:1410    42 ALA  QB          4.50    (#   1410:25  Single Ambig)
 &rst
  ixpk= 1410, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 333, 334, 811, 812, 811, 812,
 igr2= 705, 706, 707,
 &end
#
#    0 AMB  25-3:1411    42 ALA  QB          5.50    (#   1411:25  Single Ambig)
 &rst
  ixpk= 1411, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 687, 309,
 igr2= 705, 706, 707,
 &end
#
#    9 ILE  QD1          65 ALA  QB          3.50    (#   1412:25  Unique         2.66, 4.43 A)
 &rst
  ixpk= 1412, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 144, 145, 146,
 igr2=1070,1071,1072,
 &end
#
#    9 ILE  QG2          65 ALA  QB          3.50    (#   1413:25  Unique         3.17, 5.79 A)
 &rst
  ixpk= 1413, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 137, 138, 139,
 igr2=1070,1071,1072,
 &end
#
#    0 AMB  25-3:1414    65 ALA  QB          3.50    (#   1414:25  Single Ambig)
 &rst
  ixpk= 1414, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1080,1081, 141, 142,
 igr2=1070,1071,1072,
 &end
#
#   62 ALA  QB           65 ALA  QB          5.50    (#   1415:25  Unique         4.48, 6.16 A)
 &rst
  ixpk= 1415, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1035,1036,1037,
 igr2=1070,1071,1072,
 &end
#
#   66 LEU  HB+          65 ALA  QB          5.50    (#   1416:25  Unique         3.94, 5.47 A)
 &rst
  ixpk= 1416, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1080,1081,
 igr2=1070,1071,1072,
 &end
#
#   69 MET  HG-          65 ALA  QB          3.50    (#   1417:25  Unique         2.79, 4.78 A)
 &rst
  ixpk= 1417, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1140,1141,
 igr2=1070,1071,1072,
 &end
#
#    0 AMB  25-3:1418    65 ALA  QB          4.50    (#   1418:25  Single Ambig)
 &rst
  ixpk= 1418, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 576, 577, 528, 529,1056,1057,1056,1057,
 igr2=1070,1071,1072,
 &end
#
#    0 AMB  25-3:1419    65 ALA  QB          3.50    (#   1419:25  Single Ambig)
 &rst
  ixpk= 1419, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1033, 576, 577,
 igr2=1070,1071,1072,
 &end
#
#   31 PHE  QE           65 ALA  QB          4.50    (#   1420:25  Unique         2.30, 6.25 A)
 &rst
  ixpk= 1420, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 534, 538,
 igr2=1070,1071,1072,
 &end
#
#   56 PHE  QE           65 ALA  QB          3.50    (#   1421:25  Unique         2.87, 4.02 A)
 &rst
  ixpk= 1421, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 947, 951,
 igr2=1070,1071,1072,
 &end
#
#   56 PHE  QD           65 ALA  QB          3.50    (#   1422:25  Unique         3.80, 5.02 A)
 &rst
  ixpk= 1422, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 945, 953,
 igr2=1070,1071,1072,
 &end
#
#   64 ASN  HN           65 ALA  QB          5.50    (#   1423:25  Unique         4.46, 5.44 A)
 &rst
  ixpk= 1423, nxpk= 25, iat=1052,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1070,1071,1072,
 &end
#
#   31 PHE  QD           65 ALA  QB          3.50    (#   1424:25  Unique         2.30, 5.40 A)
 &rst
  ixpk= 1424, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 532, 540,
 igr2=1070,1071,1072,
 &end
#
#    0 AMB  25-3:1425    65 ALA  QB          5.50    (#   1425:25  Single Ambig)
 &rst
  ixpk= 1425, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1061,1062,1133,
 igr2=1070,1071,1072,
 &end
#
#    0 AMB  25-3:1426    65 ALA  QB          2.80    (#   1426:25  Single Ambig)
 &rst
  ixpk= 1426, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1076,1066,
 igr2=1070,1071,1072,
 &end
#
#    0 AMB  25-3:1427    65 ALA  QB          5.50    (#   1427:25  Single Ambig)
 &rst
  ixpk= 1427, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 574,1054,
 igr2=1070,1071,1072,
 &end
#
#   81 ILE  QG2          66 LEU  HA          4.50    (#   1428:25  Unique         2.31, 3.79 A)
 &rst
  ixpk= 1428, nxpk= 25, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1337,1338,1339,
 &end
#
#    0 AMB  25-3:1429    66 LEU  HA          4.50    (#   1429:25  Single Ambig)
 &rst
  ixpk= 1429, nxpk= 25, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1344,1345,1346, 137, 138, 139,
 &end
#
#   66 LEU  HG           66 LEU  HA          4.50    (#   1430:25  Unique         2.30, 2.57 A)
 &rst
  ixpk= 1430, nxpk= 25, iat=1083,1078, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   66 LEU  HB-          66 LEU  HA          4.50    (#   1431:25  Unique         2.50, 2.82 A)
 &rst
  ixpk= 1431, nxpk= 25, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1080,1081,
 &end
#
#    0 AMB  25-3:1432    66 LEU  HA          5.50    (#   1432:25  Single Ambig)
 &rst
  ixpk= 1432, nxpk= 25, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1080,1081,1335,
 &end
#
#   66 LEU  HN           66 LEU  HA          5.50    (#   1433:25  Unique         2.59, 2.78 A)
 &rst
  ixpk= 1433, nxpk= 25, iat=1076,1078, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   66 LEU  HN           66 LEU  HB-         4.50    (#   1435:25  Unique         2.03, 2.46 A)
 &rst
  ixpk= 1435, nxpk= 25, iat=1076,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1080,1081,
 &end
#
#   66 LEU  HN           66 LEU  HB+         4.50    (#   1436:25  Unique         2.03, 2.46 A)
 &rst
  ixpk= 1436, nxpk= 25, iat=1076,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1080,1081,
 &end
#
#   66 LEU  HA           66 LEU  HB-         4.50    (#   1437:25  Unique         2.50, 2.82 A)
 &rst
  ixpk= 1437, nxpk= 25, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1080,1081,
 &end
#
#   66 LEU  HA           66 LEU  HB+         5.50    (#   1438:25  Unique         2.50, 2.82 A)
 &rst
  ixpk= 1438, nxpk= 25, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1080,1081,
 &end
#
#   66 LEU  MDY          66 LEU  HB+         5.50    (#   1439:25  Unique         2.25, 3.32 A)
 &rst
  ixpk= 1439, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1080,1081,
 &end
#
#   66 LEU  MDY          66 LEU  HB-         5.50    (#   1440:25  Unique         2.25, 3.32 A)
 &rst
  ixpk= 1440, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1080,1081,
 &end
#
#   66 LEU  MDX          66 LEU  HB-         5.50    (#   1441:25  Unique         2.25, 3.32 A)
 &rst
  ixpk= 1441, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1080,1081,
 &end
#
#   66 LEU  MDX          66 LEU  HB+         5.50    (#   1442:25  Unique         2.25, 3.32 A)
 &rst
  ixpk= 1442, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1080,1081,
 &end
#
#   65 ALA  HA           66 LEU  HB+         5.50    (#   1443:25  Unique         5.54, 5.83 A)
 &rst
  ixpk= 1443, nxpk= 25, iat=1068,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1080,1081,
 &end
#
#   65 ALA  HA           66 LEU  HB-         5.50    (#   1444:25  Unique         5.54, 5.83 A)
 &rst
  ixpk= 1444, nxpk= 25, iat=1068,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1080,1081,
 &end
#
#   66 LEU  HA           66 LEU  HG          4.50    (#   1445:25  Unique         2.30, 2.57 A)
 &rst
  ixpk= 1445, nxpk= 25, iat=1078,1083, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:1446    66 LEU  HG          4.50    (#   1446:25  Single Ambig)
 &rst
  ixpk= 1446, nxpk= 25, iat=  -1,1083, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1080,1081,1335,
 &end
#
#   66 LEU  MDY          66 LEU  HG          3.50    (#   1447:25  Unique         2.11, 2.65 A)
 &rst
  ixpk= 1447, nxpk= 25, iat=  -1,1083, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  MDX          66 LEU  HG          5.50    (#   1448:25  Unique         2.11, 2.65 A)
 &rst
  ixpk= 1448, nxpk= 25, iat=  -1,1083, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#   81 ILE  QG2          66 LEU  HG          4.50    (#   1449:25  Unique         1.93, 2.89 A)
 &rst
  ixpk= 1449, nxpk= 25, iat=  -1,1083, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1337,1338,1339,
 &end
#
#   66 LEU  HN           66 LEU  HG          5.50    (#   1450:25  Unique         4.04, 4.19 A)
 &rst
  ixpk= 1450, nxpk= 25, iat=1076,1083, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1451    66 LEU  HG          5.50    (#   1451:25  Single Ambig)
 &rst
  ixpk= 1451, nxpk= 25, iat=  -1,1083, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1360,1041,
 &end
#
#    9 ILE  QD1          66 LEU  MDY         4.50    (#   1454:25  Unique         3.82, 5.90 A)
 &rst
  ixpk= 1454, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 144, 145, 146,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   81 ILE  QG2          66 LEU  MDY         4.50    (#   1455:25  Unique         2.75, 4.76 A)
 &rst
  ixpk= 1455, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1337,1338,1339,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HG           66 LEU  MDY         3.50    (#   1456:25  Unique         2.11, 2.65 A)
 &rst
  ixpk= 1456, nxpk= 25, iat=1083,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HB-          66 LEU  MDY         4.50    (#   1457:25  Unique         2.25, 3.32 A)
 &rst
  ixpk= 1457, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1080,1081,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1458    66 LEU  MDY         3.50    (#   1458:25  Single Ambig)
 &rst
  ixpk= 1458, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1335,1080,1081,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1459    66 LEU  MDY         5.50    (#   1459:25  Single Ambig)
 &rst
  ixpk= 1459, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 135,1102,1103,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   67 ARG  HG+          66 LEU  MDY         4.50    (#   1460:25  Unique         2.86, 6.36 A)
 &rst
  ixpk= 1460, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1102,1103,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1461    66 LEU  MDY         3.50    (#   1461:25  Single Ambig)
 &rst
  ixpk= 1461, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1097,1045,1046,1045,1046,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1462    66 LEU  MDY         4.50    (#   1462:25  Single Ambig)
 &rst
  ixpk= 1462, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1352,1043,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   83 TYR  QD           66 LEU  MDY         5.50    (#   1464:25  Unique         3.02, 6.71 A)
 &rst
  ixpk= 1464, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1368,1377,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   70 GLN  HE2-         66 LEU  MDY         4.50    (#   1465:25  Unique         1.99, 4.95 A)
 &rst
  ixpk= 1465, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1162,1163,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   67 ARG  HN           66 LEU  MDY         4.50    (#   1466:25  Unique         3.32, 4.81 A)
 &rst
  ixpk= 1466, nxpk= 25, iat=1095,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   70 GLN  HE2+         66 LEU  MDY         4.50    (#   1467:25  Unique         1.99, 4.95 A)
 &rst
  ixpk= 1467, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1162,1163,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HN           66 LEU  MDY         5.50    (#   1468:25  Unique         4.17, 5.18 A)
 &rst
  ixpk= 1468, nxpk= 25, iat=1076,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1472    66 LEU  MDY         4.50    (#   1472:25  Single Ambig)
 &rst
  ixpk= 1472, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 137, 138, 139,1344,1345,1346,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    9 ILE  QD1          66 LEU  MDX         4.50    (#   1473:25  Unique         3.82, 5.90 A)
 &rst
  ixpk= 1473, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 144, 145, 146,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   81 ILE  QG2          66 LEU  MDX         3.50    (#   1475:25  Unique         2.75, 4.76 A)
 &rst
  ixpk= 1475, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1337,1338,1339,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1476    66 LEU  MDX         3.50    (#   1476:25  Single Ambig)
 &rst
  ixpk= 1476, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 137, 138, 139,1344,1345,1346,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HG           66 LEU  MDX         3.50    (#   1477:25  Unique         2.11, 2.65 A)
 &rst
  ixpk= 1477, nxpk= 25, iat=1083,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HB-          66 LEU  MDX         4.50    (#   1478:25  Unique         2.25, 3.32 A)
 &rst
  ixpk= 1478, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1080,1081,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1479    66 LEU  MDX         3.50    (#   1479:25  Single Ambig)
 &rst
  ixpk= 1479, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1335,1080,1081,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HA           66 LEU  MDX         4.50    (#   1480:25  Unique         2.56, 4.10 A)
 &rst
  ixpk= 1480, nxpk= 25, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   82 ALA  HA           66 LEU  MDX         3.50    (#   1481:25  Unique         2.16, 3.90 A)
 &rst
  ixpk= 1481, nxpk= 25, iat=1352,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   81 ILE  HA           66 LEU  MDX         5.50    (#   1483:25  Unique         4.41, 6.04 A)
 &rst
  ixpk= 1483, nxpk= 25, iat=1333,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   83 TYR  QD           66 LEU  MDX         4.50    (#   1484:25  Unique         3.02, 6.71 A)
 &rst
  ixpk= 1484, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1368,1377,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   70 GLN  HE2+         66 LEU  MDX         5.50    (#   1485:25  Unique         1.99, 4.95 A)
 &rst
  ixpk= 1485, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1162,1163,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   83 TYR  HN           66 LEU  MDX         5.50    (#   1486:25  Unique         2.81, 5.03 A)
 &rst
  ixpk= 1486, nxpk= 25, iat=1360,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#   66 LEU  HN           66 LEU  MDX         4.50    (#   1487:25  Unique         4.17, 5.18 A)
 &rst
  ixpk= 1487, nxpk= 25, iat=1076,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1488    67 ARG  HA          5.50    (#   1488:25  Single Ambig)
 &rst
  ixpk= 1488, nxpk= 25, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1105,1106,1105,1106,
 &end
#
#   67 ARG  HB+          67 ARG  HA          2.80    (#   1489:25  Unique         2.28, 2.78 A)
 &rst
  ixpk= 1489, nxpk= 25, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1099,1100,
 &end
#
#   67 ARG  HG-          67 ARG  HA          4.50    (#   1490:25  Unique         2.26, 2.72 A)
 &rst
  ixpk= 1490, nxpk= 25, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1102,1103,
 &end
#
#    0 AMB  25-3:1491    67 ARG  HA          3.50    (#   1491:25  Single Ambig)
 &rst
  ixpk= 1491, nxpk= 25, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1102,1103,1099,1100,
 &end
#
#   66 LEU  MDY          67 ARG  HA          3.50    (#   1492:25  Unique         2.99, 5.11 A)
 &rst
  ixpk= 1492, nxpk= 25, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#   64 ASN  HA           67 ARG  HA          7.00    (#   1493:25  Unique         5.39, 5.70 A)
 &rst
  ixpk= 1493, nxpk= 25, iat=1054,1097, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   67 ARG  HN           67 ARG  HA          4.50    (#   1494:25  Unique         2.67, 2.83 A)
 &rst
  ixpk= 1494, nxpk= 25, iat=1095,1097, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:1495    67 ARG  HA          5.50    (#   1495:25  Single Ambig)
 &rst
  ixpk= 1495, nxpk= 25, iat=  -1,1097, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1162,1163,1119,
 &end
#
#    3 MET  HN           67 ARG  HA          5.50    (#   1496:25  Unique         5.32, 5.59 A)
 &rst
  ixpk= 1496, nxpk= 25, iat=  36,1097, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:1498     0 AMB  25-1:1498   3.50    (#   1498:25  Double Ambig)
 &rst
  ixpk= 1498, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.01, r4= 8.51,
 igr1= 834, 835, 834, 835, 834, 835,1105,1106,1105,1106,
      1105,1106,
 igr2= 828, 829, 828, 829, 828, 829,1099,1100,1099,1100,
        25,  26,
 &end
#
#    0 AMB  25-3:1499    67 ARG  HB-         4.50    (#   1499:25  Single Ambig)
 &rst
  ixpk= 1499, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1105,1106,1105,1106,
 igr2=1099,1100,
 &end
#
#    0 AMB  25-3:1500     0 AMB  25-1:1500   4.50    (#   1500:25  Double Ambig)
 &rst
  ixpk= 1500, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1097, 850, 851,1045,1046,
 igr2=1099,1100, 828, 829, 828, 829,1099,1100,
 &end
#
#   67 ARG  HA           67 ARG  HB-         3.50    (#   1501:25  Unique         2.28, 2.78 A)
 &rst
  ixpk= 1501, nxpk= 25, iat=1097,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1099,1100,
 &end
#
#    0 AMB  25-3:1502     0 AMB  25-1:1502   3.50    (#   1502:25  Double Ambig)
 &rst
  ixpk= 1502, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 824,1095,
 igr2= 828, 829, 828, 829,1099,1100,
 &end
#
#   67 ARG  HN           67 ARG  HB-         4.50    (#   1503:25  Unique         2.21, 2.69 A)
 &rst
  ixpk= 1503, nxpk= 25, iat=1095,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1099,1100,
 &end
#
#   68 THR  HN           67 ARG  HB+         5.50    (#   1504:25  Unique         1.98, 3.21 A)
 &rst
  ixpk= 1504, nxpk= 25, iat=1119,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1099,1100,
 &end
#
#   68 THR  HN           67 ARG  HB-         5.50    (#   1505:25  Unique         1.98, 3.21 A)
 &rst
  ixpk= 1505, nxpk= 25, iat=1119,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1099,1100,
 &end
#
#   64 ASN  HA           67 ARG  HB-         5.50    (#   1506:25  Unique         2.51, 3.59 A)
 &rst
  ixpk= 1506, nxpk= 25, iat=1054,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1099,1100,
 &end
#
#    0 AMB  25-3:1507     0 AMB  25-1:1507   3.50    (#   1507:25  Double Ambig)
 &rst
  ixpk= 1507, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=  23, 826,1054,
 igr2=  25,  26, 828, 829, 828, 829,1099,1100,
 &end
#
#   70 GLN  HB-          67 ARG  HG+         5.50    (#   1509:25  Unique         4.35, 6.23 A)
 &rst
  ixpk= 1509, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1154,1155,
 igr2=1102,1103,
 &end
#
#   70 GLN  HB-          67 ARG  HG-         5.50    (#   1510:25  Unique         4.35, 6.23 A)
 &rst
  ixpk= 1510, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1154,1155,
 igr2=1102,1103,
 &end
#
#    0 AMB  25-3:1511     0 AMB  25-1:1511   2.80    (#   1511:25  Double Ambig)
 &rst
  ixpk= 1511, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1=1105,1106,1105,1106, 834, 835, 834, 835,
 igr2=1102,1103,1102,1103, 831, 832, 831, 832,
 &end
#
#    0 AMB  25-3:1512    67 ARG  HG-         3.50    (#   1512:25  Single Ambig)
 &rst
  ixpk= 1512, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1105,1106,1105,1106,
 igr2=1102,1103,
 &end
#
#    0 AMB  25-3:1513    67 ARG  HG-         4.50    (#   1513:25  Single Ambig)
 &rst
  ixpk= 1513, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1097,1045,1046,
 igr2=1102,1103,
 &end
#
#    0 AMB  25-3:1514     0 AMB  25-1:1514   4.50    (#   1514:25  Double Ambig)
 &rst
  ixpk= 1514, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.80, r4= 9.30,
 igr1=1097,1045,1046,1045,1046,1015,1016,
 igr2=1102,1103,  76,  77,  76,  77,  76,  77,
 &end
#
#    0 AMB  25-3:1515     0 AMB  25-1:1515   4.50    (#   1515:25  Double Ambig)
 &rst
  ixpk= 1515, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=  73,  74,1015,1016,
 igr2=  76,  77,  76,  77,
 &end
#
#    0 AMB  25-3:1518     0 AMB  25-1:1518   5.50    (#   1518:25  Double Ambig)
 &rst
  ixpk= 1518, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1043,  55,
 igr2=1102,1103,  76,  77,  76,  77,
 &end
#
#    0 AMB  25-3:1519     0 AMB  25-1:1519   5.50    (#   1519:25  Double Ambig)
 &rst
  ixpk= 1519, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1054,  88,
 igr2=1102,1103,  76,  77,
 &end
#
#   67 ARG  HN           67 ARG  HG+         5.50    (#   1520:25  Unique         2.28, 3.80 A)
 &rst
  ixpk= 1520, nxpk= 25, iat=1095,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1102,1103,
 &end
#
#   67 ARG  HN           67 ARG  HG-         5.50    (#   1521:25  Unique         2.28, 3.80 A)
 &rst
  ixpk= 1521, nxpk= 25, iat=1095,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1102,1103,
 &end
#
#    0 AMB  25-3:1522     0 AMB  25-1:1522   5.50    (#   1522:25  Double Ambig)
 &rst
  ixpk= 1522, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=  43,  44,1157,1158,
 igr2=1102,1103,1102,1103,
 &end
#
#    0 AMB  25-3:1523    67 ARG  HG-         5.50    (#   1523:25  Single Ambig)
 &rst
  ixpk= 1523, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  43,  44,1157,1158,
 igr2=1102,1103,
 &end
#
#    0 AMB  25-3:1524    46 LEU  HG          2.80    (#   1524:25  Single Ambig)
 &rst
  ixpk= 1524, nxpk= 25, iat=  -1, 773, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 779, 780, 781, 775, 776, 777,
 &end
#
#    3 MET  HG-           0 AMB  25-1:1527   5.50    (#   1527:25  Single Ambig)
 &rst
  ixpk= 1527, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  43,  44,
 igr2=1105,1106,1105,1106,
 &end
#
#    0 AMB  25-3:1528     0 AMB  25-1:1528   5.50    (#   1528:25  Double Ambig)
 &rst
  ixpk= 1528, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 775, 776, 777, 779, 780, 781,
 igr2= 834, 835, 834, 835, 834, 835,
 &end
#
#   64 ASN  HA            0 AMB  25-1:1531   5.50    (#   1531:25  Single Ambig)
 &rst
  ixpk= 1531, nxpk= 25, iat=1054,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1105,1106,1105,1106,
 &end
#
#    0 AMB  25-3:1535     0 AMB  25-1:1535   5.50    (#   1535:25  Double Ambig)
 &rst
  ixpk= 1535, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1= 824,1095, 807,
 igr2= 834, 835, 834, 835,1105,1106,1105,1106, 834, 835,
      
 &end
#
#   68 THR  QG2          68 THR  HA          2.80    (#   1536:25  Unique         2.45, 3.11 A)
 &rst
  ixpk= 1536, nxpk= 25, iat=  -1,1121, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1125,1126,1127,
 &end
#
#   68 THR  HB           68 THR  HA          3.50    (#   1538:25  Unique         3.04, 3.05 A)
 &rst
  ixpk= 1538, nxpk= 25, iat=1123,1121, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   68 THR  HN           68 THR  HA          3.50    (#   1541:25  Unique         2.80, 2.87 A)
 &rst
  ixpk= 1541, nxpk= 25, iat=1119,1121, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  25-3:1542    68 THR  HA          7.00    (#   1542:25  Single Ambig)
 &rst
  ixpk= 1542, nxpk= 25, iat=  -1,1121, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1076,1066,
 &end
#
#   67 ARG  HG+          68 THR  HA          7.00    (#   1543:25  Unique         3.53, 5.56 A)
 &rst
  ixpk= 1543, nxpk= 25, iat=  -1,1121, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1102,1103,
 &end
#
#  102 PRO  HA           97 THR  HB          7.00    (#   1545:25  Unique         3.52, 5.61 A)
 &rst
  ixpk= 1545, nxpk= 25, iat=1680,1579, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   97 THR  QG2          97 THR  HB          3.50    (#   1550:25  Unique         2.06, 2.66 A)
 &rst
  ixpk= 1550, nxpk= 25, iat=  -1,1579, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1581,1582,1583,
 &end
#
#   67 ARG  HB-          68 THR  QG2         7.00    (#   1552:25  Unique         5.71, 7.02 A)
 &rst
  ixpk= 1552, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1099,1100,
 igr2=1125,1126,1127,
 &end
#
#   69 MET  HG-          68 THR  QG2         4.50    (#   1554:25  Unique         3.52, 5.32 A)
 &rst
  ixpk= 1554, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1140,1141,
 igr2=1125,1126,1127,
 &end
#
#   69 MET  HG+          68 THR  QG2         4.50    (#   1555:25  Unique         3.52, 5.32 A)
 &rst
  ixpk= 1555, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1140,1141,
 igr2=1125,1126,1127,
 &end
#
#   68 THR  HB           68 THR  QG2         3.50    (#   1556:25  Unique         2.41, 2.67 A)
 &rst
  ixpk= 1556, nxpk= 25, iat=1123,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1125,1126,1127,
 &end
#
#   68 THR  HA           68 THR  QG2         2.80    (#   1557:25  Unique         2.45, 3.11 A)
 &rst
  ixpk= 1557, nxpk= 25, iat=1121,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1125,1126,1127,
 &end
#
#   70 GLN  HN           68 THR  QG2         5.50    (#   1559:25  Unique         5.67, 6.47 A)
 &rst
  ixpk= 1559, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1125,1126,1127,
 &end
#
#   34 PHE  QE           68 THR  QG2         3.50    (#   1560:25  Unique         2.42, 4.81 A)
 &rst
  ixpk= 1560, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 582, 586,
 igr2=1125,1126,1127,
 &end
#
#   68 THR  HN           68 THR  QG2         4.50    (#   1561:25  Unique         4.41, 4.54 A)
 &rst
  ixpk= 1561, nxpk= 25, iat=1119,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1125,1126,1127,
 &end
#
#   81 ILE  QD1          69 MET  HA          4.50    (#   1567:25  Unique         4.19, 5.01 A)
 &rst
  ixpk= 1567, nxpk= 25, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1344,1345,1346,
 &end
#
#    0 AMB  25-3:1568    39 ASP  HA          4.50    (#   1568:25  Single Ambig)
 &rst
  ixpk= 1568, nxpk= 25, iat=  -1, 656, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 644, 645, 646, 648, 649, 650, 679, 680, 681, 691,
       692, 693, 695, 696, 697, 672, 673, 674,
 &end
#
#   37 ILE  QG2          39 ASP  HA          5.50    (#   1569:25  Unique         3.40, 4.10 A)
 &rst
  ixpk= 1569, nxpk= 25, iat=  -1, 656, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 622, 623, 624,
 &end
#
#    0 AMB  25-3:1570     0 AMB  25-1:1570   5.50    (#   1570:25  Double Ambig)
 &rst
  ixpk= 1570, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1125,1126,1127, 642, 639, 640, 928, 929,
 igr2=1135, 656,
 &end
#
#    0 AMB  25-3:1571    39 ASP  HA          5.50    (#   1571:25  Single Ambig)
 &rst
  ixpk= 1571, nxpk= 25, iat=  -1, 656, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 676, 677, 676, 677, 670,
 &end
#
#   69 MET  HB+          69 MET  HA          4.50    (#   1572:25  Unique         2.44, 2.77 A)
 &rst
  ixpk= 1572, nxpk= 25, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1137,1138,
 &end
#
#    0 AMB  25-3:1573    69 MET  HA          5.50    (#   1573:25  Single Ambig)
 &rst
  ixpk= 1573, nxpk= 25, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1157,1158,1195,1196,
 &end
#
#   39 ASP  HB+          39 ASP  HA          4.50    (#   1574:25  Unique         2.49, 2.78 A)
 &rst
  ixpk= 1574, nxpk= 25, iat=  -1, 656, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 658, 659,
 &end
#
#   72 PHE  HB-          69 MET  HA          4.50    (#   1575:25  Unique         2.33, 2.94 A)
 &rst
  ixpk= 1575, nxpk= 25, iat=  -1,1135, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1178,1179,
 &end
#
#   66 LEU  HA           69 MET  HA          7.00    (#   1576:25  Unique         6.00, 6.18 A)
 &rst
  ixpk= 1576, nxpk= 25, iat=1078,1135, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  25-3:1577    39 ASP  HA          5.50    (#   1577:25  Single Ambig)
 &rst
  ixpk= 1577, nxpk= 25, iat=  -1, 656, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 904, 687,
 &end
#
#   55 ILE  HA           39 ASP  HA          7.00    (#   1578:25  Unique         6.97, 7.01 A)
 &rst
  ixpk= 1578, nxpk= 25, iat= 920, 656, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   40 ILE  HN           39 ASP  HA          4.50    (#   1579:25  Unique         2.46, 2.50 A)
 &rst
  ixpk= 1579, nxpk= 25, iat= 666, 656, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   81 ILE  QD1          69 MET  HB+         4.50    (#   1580:25  Unique         2.33, 3.21 A)
 &rst
  ixpk= 1580, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1344,1345,1346,
 igr2=1137,1138,
 &end
#
#   81 ILE  QD1          69 MET  HB-         5.50    (#   1581:25  Unique         2.33, 3.21 A)
 &rst
  ixpk= 1581, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1344,1345,1346,
 igr2=1137,1138,
 &end
#
#    9 ILE  QD1          69 MET  HB-         5.50    (#   1582:25  Unique         4.21, 5.76 A)
 &rst
  ixpk= 1582, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 144, 145, 146,
 igr2=1137,1138,
 &end
#
#   70 GLN  HN           69 MET  HB-         5.50    (#   1583:25  Unique         2.90, 3.82 A)
 &rst
  ixpk= 1583, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1137,1138,
 &end
#
#   70 GLN  HN           69 MET  HB+         5.50    (#   1584:25  Unique         2.90, 3.82 A)
 &rst
  ixpk= 1584, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1137,1138,
 &end
#
#   69 MET  HN           69 MET  HB-         5.50    (#   1585:25  Unique         2.25, 3.02 A)
 &rst
  ixpk= 1585, nxpk= 25, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1137,1138,
 &end
#
#   69 MET  HN           69 MET  HB+         5.50    (#   1586:25  Unique         2.25, 3.02 A)
 &rst
  ixpk= 1586, nxpk= 25, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1137,1138,
 &end
#
#    0 AMB  25-3:1588     0 AMB  25-1:1588   2.80    (#   1588:25  Double Ambig)
 &rst
  ixpk= 1588, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 317, 318, 317, 318, 432, 433,1144,1145,1146,
 igr2= 311, 312, 311, 312, 426, 427,1140,1141,
 &end
#
#   69 MET  HB+          69 MET  HG-         2.80    (#   1589:25  Unique         2.35, 2.60 A)
 &rst
  ixpk= 1589, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1137,1138,
 igr2=1140,1141,
 &end
#
#    0 AMB  25-3:1590     0 AMB  25-1:1590   5.50    (#   1590:25  Double Ambig)
 &rst
  ixpk= 1590, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 482, 491,1150,
 igr2= 426, 427,1140,1141,
 &end
#
#    0 AMB  25-3:1591     0 AMB  25-1:1591   4.50    (#   1591:25  Double Ambig)
 &rst
  ixpk= 1591, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 422, 580, 588,
 igr2= 426, 427,1140,1141,
 &end
#
#    0 AMB  25-3:1592     0 AMB  25-1:1592   5.50    (#   1592:25  Double Ambig)
 &rst
  ixpk= 1592, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 307, 444,
 igr2= 311, 312, 426, 427,
 &end
#
#    0 AMB  25-3:1593     0 AMB  25-1:1593   5.50    (#   1593:25  Double Ambig)
 &rst
  ixpk= 1593, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 400, 524, 544,1174,
 igr2= 426, 427,1140,1141, 311, 312,
 &end
#
#   81 ILE  QD1          70 GLN  HA          4.50    (#   1594:25  Unique         2.31, 3.51 A)
 &rst
  ixpk= 1594, nxpk= 25, iat=  -1,1152, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1344,1345,1346,
 &end
#
#   70 GLN  HB-          70 GLN  HA          4.50    (#   1595:25  Unique         2.13, 2.68 A)
 &rst
  ixpk= 1595, nxpk= 25, iat=  -1,1152, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1154,1155,
 &end
#
#   70 GLN  HG-          70 GLN  HA          4.50    (#   1596:25  Unique         2.40, 3.43 A)
 &rst
  ixpk= 1596, nxpk= 25, iat=  -1,1152, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1157,1158,
 &end
#
#   70 GLN  HB+          70 GLN  HA          5.50    (#   1597:25  Unique         2.13, 2.68 A)
 &rst
  ixpk= 1597, nxpk= 25, iat=  -1,1152, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1154,1155,
 &end
#
#   70 GLN  HN           70 GLN  HA          5.50    (#   1598:25  Unique         2.72, 2.81 A)
 &rst
  ixpk= 1598, nxpk= 25, iat=1150,1152, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   71 GLY  HN           70 GLN  HA          3.50    (#   1599:25  Unique         1.97, 2.19 A)
 &rst
  ixpk= 1599, nxpk= 25, iat=1167,1152, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   70 GLN  HG+          70 GLN  HB+         4.50    (#   1601:25  Unique         2.24, 2.65 A)
 &rst
  ixpk= 1601, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1157,1158,
 igr2=1154,1155,
 &end
#
#   70 GLN  HG+          70 GLN  HB-         4.50    (#   1602:25  Unique         2.24, 2.65 A)
 &rst
  ixpk= 1602, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1157,1158,
 igr2=1154,1155,
 &end
#
#   66 LEU  MDY          70 GLN  HB-         5.50    (#   1603:25  Unique         2.32, 6.15 A)
 &rst
  ixpk= 1603, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1154,1155,
 &end
#
#   66 LEU  MDY          70 GLN  HB+         5.50    (#   1604:25  Unique         2.32, 6.15 A)
 &rst
  ixpk= 1604, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1154,1155,
 &end
#
#   70 GLN  HA           70 GLN  HB-         5.50    (#   1605:25  Unique         2.13, 2.68 A)
 &rst
  ixpk= 1605, nxpk= 25, iat=1152,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1154,1155,
 &end
#
#   70 GLN  HA           70 GLN  HB+         5.50    (#   1606:25  Unique         2.13, 2.68 A)
 &rst
  ixpk= 1606, nxpk= 25, iat=1152,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1154,1155,
 &end
#
#   70 GLN  HN           70 GLN  HB+         4.50    (#   1608:25  Unique         2.06, 2.83 A)
 &rst
  ixpk= 1608, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1154,1155,
 &end
#
#   70 GLN  HN           70 GLN  HB-         4.50    (#   1609:25  Unique         2.06, 2.83 A)
 &rst
  ixpk= 1609, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1154,1155,
 &end
#
#   82 ALA  HN           70 GLN  HB-         7.00    (#   1610:25  Unique         5.44, 7.44 A)
 &rst
  ixpk= 1610, nxpk= 25, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1154,1155,
 &end
#
#   82 ALA  HA           70 GLN  HB+         7.00    (#   1611:25  Unique         5.32, 7.19 A)
 &rst
  ixpk= 1611, nxpk= 25, iat=1352,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1154,1155,
 &end
#
#   67 ARG  HG-          70 GLN  HG-         4.50    (#   1612:25  Unique         4.12, 5.85 A)
 &rst
  ixpk= 1612, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1102,1103,
 igr2=1157,1158,
 &end
#
#   67 ARG  HG-          70 GLN  HG+         5.50    (#   1613:25  Unique         4.12, 5.85 A)
 &rst
  ixpk= 1613, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1102,1103,
 igr2=1157,1158,
 &end
#
#   70 GLN  HE2-         70 GLN  HG+         4.50    (#   1614:25  Unique         2.26, 3.34 A)
 &rst
  ixpk= 1614, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1162,1163,
 igr2=1157,1158,
 &end
#
#   70 GLN  HE2-         70 GLN  HG-         5.50    (#   1615:25  Unique         2.26, 3.34 A)
 &rst
  ixpk= 1615, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1162,1163,
 igr2=1157,1158,
 &end
#
#   70 GLN  HE2+         70 GLN  HG+         5.50    (#   1616:25  Unique         2.26, 3.34 A)
 &rst
  ixpk= 1616, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1162,1163,
 igr2=1157,1158,
 &end
#
#   70 GLN  HE2+         70 GLN  HG-         5.50    (#   1617:25  Unique         2.26, 3.34 A)
 &rst
  ixpk= 1617, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1162,1163,
 igr2=1157,1158,
 &end
#
#   70 GLN  HN           70 GLN  HG+         5.50    (#   1618:25  Unique         2.12, 3.33 A)
 &rst
  ixpk= 1618, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1157,1158,
 &end
#
#   70 GLN  HA           70 GLN  HG+         5.50    (#   1619:25  Unique         2.40, 3.43 A)
 &rst
  ixpk= 1619, nxpk= 25, iat=1152,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1157,1158,
 &end
#
#   73 PRO  HD+          72 PHE  HA          3.50    (#   1623:25  Unique         2.12, 2.39 A)
 &rst
  ixpk= 1623, nxpk= 25, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1195,1196,
 &end
#
#   72 PHE  HB-          72 PHE  HA          4.50    (#   1624:25  Unique         2.47, 2.77 A)
 &rst
  ixpk= 1624, nxpk= 25, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1178,1179,
 &end
#
#   73 PRO  HD-          72 PHE  HA          3.50    (#   1625:25  Unique         2.12, 2.39 A)
 &rst
  ixpk= 1625, nxpk= 25, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1195,1196,
 &end
#
#   72 PHE  QD           72 PHE  HA          4.50    (#   1627:25  Unique         2.60, 3.52 A)
 &rst
  ixpk= 1627, nxpk= 25, iat=  -1,1176, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1182,1190,
 &end
#
#   72 PHE  HN           72 PHE  HA          5.50    (#   1628:25  Unique         2.85, 2.87 A)
 &rst
  ixpk= 1628, nxpk= 25, iat=1174,1176, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   69 MET  QE           72 PHE  HB+         5.50    (#   1630:25  Unique         2.49, 3.90 A)
 &rst
  ixpk= 1630, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1144,1145,1146,
 igr2=1178,1179,
 &end
#
#   69 MET  QE           72 PHE  HB-         5.50    (#   1631:25  Unique         2.49, 3.90 A)
 &rst
  ixpk= 1631, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1144,1145,1146,
 igr2=1178,1179,
 &end
#
#   72 PHE  HA           72 PHE  HB-         4.50    (#   1634:25  Unique         2.47, 2.77 A)
 &rst
  ixpk= 1634, nxpk= 25, iat=1176,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1178,1179,
 &end
#
#    0 AMB  25-3:1635     0 AMB  25-1:1635   4.50    (#   1635:25  Double Ambig)
 &rst
  ixpk= 1635, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1182,1190, 945, 953,
 igr2=1178,1179, 941, 942,
 &end
#
#   72 PHE  QD           72 PHE  HB+         4.50    (#   1636:25  Unique         2.23, 3.09 A)
 &rst
  ixpk= 1636, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1182,1190,
 igr2=1178,1179,
 &end
#
#   72 PHE  HN           72 PHE  HB-         4.50    (#   1637:25  Unique         2.14, 2.50 A)
 &rst
  ixpk= 1637, nxpk= 25, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1178,1179,
 &end
#
#   72 PHE  HN           72 PHE  HB+         4.50    (#   1638:25  Unique         2.14, 2.50 A)
 &rst
  ixpk= 1638, nxpk= 25, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1178,1179,
 &end
#
#   74 PHE  QD           74 PHE  HB+         5.50    (#   1641:25  Unique         2.21, 3.07 A)
 &rst
  ixpk= 1641, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1216,1224,
 igr2=1212,1213,
 &end
#
#   74 PHE  QD           74 PHE  HB-         5.50    (#   1642:25  Unique         2.21, 3.07 A)
 &rst
  ixpk= 1642, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1216,1224,
 igr2=1212,1213,
 &end
#
#   75 TYR  HB-          75 TYR  HA          4.50    (#   1645:25  Unique         2.30, 2.82 A)
 &rst
  ixpk= 1645, nxpk= 25, iat=  -1,1230, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1232,1233,
 &end
#
#   75 TYR  HB+          75 TYR  HA          4.50    (#   1646:25  Unique         2.30, 2.82 A)
 &rst
  ixpk= 1646, nxpk= 25, iat=  -1,1230, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1232,1233,
 &end
#
#   77 LYS  HA           75 TYR  HA          7.00    (#   1648:25  Unique         6.78, 7.01 A)
 &rst
  ixpk= 1648, nxpk= 25, iat=1263,1230, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   75 TYR  QD           75 TYR  HA          4.50    (#   1649:25  Unique         2.47, 3.45 A)
 &rst
  ixpk= 1649, nxpk= 25, iat=  -1,1230, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1236,1245,
 &end
#
#   76 ASP  HN           75 TYR  HA          4.50    (#   1650:25  Unique         2.18, 2.81 A)
 &rst
  ixpk= 1650, nxpk= 25, iat=1249,1230, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   75 TYR  HN           75 TYR  HA          5.50    (#   1651:25  Unique         2.80, 2.91 A)
 &rst
  ixpk= 1651, nxpk= 25, iat=1228,1230, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   75 TYR  HA           75 TYR  HB+         4.50    (#   1652:25  Unique         2.30, 2.82 A)
 &rst
  ixpk= 1652, nxpk= 25, iat=1230,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1232,1233,
 &end
#
#   75 TYR  QD           75 TYR  HB+         4.50    (#   1653:25  Unique         2.19, 3.08 A)
 &rst
  ixpk= 1653, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1236,1245,
 igr2=1232,1233,
 &end
#
#   75 TYR  QD           75 TYR  HB-         5.50    (#   1654:25  Unique         2.19, 3.08 A)
 &rst
  ixpk= 1654, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1236,1245,
 igr2=1232,1233,
 &end
#
#   75 TYR  QE           75 TYR  HB+         5.50    (#   1655:25  Unique         4.51, 5.09 A)
 &rst
  ixpk= 1655, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1238,1243,
 igr2=1232,1233,
 &end
#
#   75 TYR  HA           75 TYR  HB-         5.50    (#   1656:25  Unique         2.30, 2.82 A)
 &rst
  ixpk= 1656, nxpk= 25, iat=1230,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1232,1233,
 &end
#
#   15 ASN  HD2+         75 TYR  HB+         5.50    (#   1657:25  Unique         2.26, 4.85 A)
 &rst
  ixpk= 1657, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 246, 247,
 igr2=1232,1233,
 &end
#
#   90 ILE  HN           89 ASP  HA          4.50    (#   1660:25  Unique         3.45, 3.60 A)
 &rst
  ixpk= 1660, nxpk= 25, iat=1460,1450, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   78 PRO  HD-          77 LYS  HA          3.50    (#   1667:25  Unique         1.97, 2.40 A)
 &rst
  ixpk= 1667, nxpk= 25, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1284,1285,
 &end
#
#   78 PRO  HD+          77 LYS  HA          3.50    (#   1668:25  Unique         1.97, 2.40 A)
 &rst
  ixpk= 1668, nxpk= 25, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1284,1285,
 &end
#
#    0 AMB  25-3:1669    77 LYS  HA          4.50    (#   1669:25  Single Ambig)
 &rst
  ixpk= 1669, nxpk= 25, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1268,1269,1268,1269,
 &end
#
#    0 AMB  25-3:1670    77 LYS  HA          4.50    (#   1670:25  Single Ambig)
 &rst
  ixpk= 1670, nxpk= 25, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1271,1272,1271,1272,
 &end
#
#   77 LYS  HB+          77 LYS  HA          4.50    (#   1671:25  Unique         2.33, 2.77 A)
 &rst
  ixpk= 1671, nxpk= 25, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1265,1266,
 &end
#
#   15 ASN  HD2-         77 LYS  HA          5.50    (#   1672:25  Unique         4.95, 6.34 A)
 &rst
  ixpk= 1672, nxpk= 25, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 246, 247,
 &end
#
#    0 AMB  25-3:1675    77 LYS  HB-         4.50    (#   1675:25  Single Ambig)
 &rst
  ixpk= 1675, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1268,1269,1268,1269,
 igr2=1265,1266,
 &end
#
#    0 AMB  25-3:1676     0 AMB  25-1:1676   3.50    (#   1676:25  Double Ambig)
 &rst
  ixpk= 1676, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1268,1269,1268,1269,
 igr2=1265,1266,1265,1266,
 &end
#
#    0 AMB  25-3:1677     0 AMB  25-1:1677   5.50    (#   1677:25  Double Ambig)
 &rst
  ixpk= 1677, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 208, 209,1321,1322,1321,1322,
 igr2=1265,1266,1265,1266,1265,1266,
 &end
#
#   77 LYS  HA           77 LYS  HB+         5.50    (#   1680:25  Unique         2.33, 2.77 A)
 &rst
  ixpk= 1680, nxpk= 25, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1265,1266,
 &end
#
#   77 LYS  HA           77 LYS  HB-         5.50    (#   1681:25  Unique         2.33, 2.77 A)
 &rst
  ixpk= 1681, nxpk= 25, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1265,1266,
 &end
#
#   77 LYS  HN           77 LYS  HB-         5.50    (#   1682:25  Unique         2.60, 3.36 A)
 &rst
  ixpk= 1682, nxpk= 25, iat=1261,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1265,1266,
 &end
#
#    0 AMB  25-3:1683    77 LYS  HB-         5.50    (#   1683:25  Single Ambig)
 &rst
  ixpk= 1683, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1271,1272,1271,1272,
 igr2=1265,1266,
 &end
#
#    0 AMB  25-3:1688     0 AMB  25-1:1688   3.50    (#   1688:25  Double Ambig)
 &rst
  ixpk= 1688, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 743, 744, 743, 744, 342, 343, 413, 414, 413, 414,
      1232,1233,
 igr2= 737, 738, 336, 337,1268,1269,
 &end
#
#   71 GLY  HA+          79 MET  HA          5.50    (#   1694:25  Unique         5.17, 6.11 A)
 &rst
  ixpk= 1694, nxpk= 25, iat=  -1,1299, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1169,1170,
 &end
#
#   79 MET  HG+          79 MET  HA          5.50    (#   1695:25  Unique         2.16, 3.24 A)
 &rst
  ixpk= 1695, nxpk= 25, iat=  -1,1299, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1304,1305,
 &end
#
#    0 AMB  25-3:1696     0 AMB  25-1:1696   4.50    (#   1696:25  Double Ambig)
 &rst
  ixpk= 1696, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 154, 155, 154, 155,1304,1305,
 igr2=1383,1299,
 &end
#
#    0 AMB  25-3:1697    79 MET  HA          4.50    (#   1697:25  Single Ambig)
 &rst
  ixpk= 1697, nxpk= 25, iat=  -1,1299, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1301,1302, 208, 209,1321,1322,
 &end
#
#    0 AMB  25-3:1698    79 MET  HA          4.50    (#   1698:25  Single Ambig)
 &rst
  ixpk= 1698, nxpk= 25, iat=  -1,1299, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1301,1302,1265,1266,
 &end
#
#   80 GLN  HN           79 MET  HA          3.50    (#   1699:25  Unique         2.22, 2.27 A)
 &rst
  ixpk= 1699, nxpk= 25, iat=1314,1299, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  25-3:1700    79 MET  HA          4.50    (#   1700:25  Single Ambig)
 &rst
  ixpk= 1700, nxpk= 25, iat=  -1,1299, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1297, 204,
 &end
#
#    0 AMB  25-3:1701    79 MET  HB-         4.50    (#   1701:25  Single Ambig)
 &rst
  ixpk= 1701, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1344,1345,1346, 177, 178, 179,
 igr2=1301,1302,
 &end
#
#    0 AMB  25-3:1702     0 AMB  25-1:1702   4.50    (#   1702:25  Double Ambig)
 &rst
  ixpk= 1702, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1344,1345,1346, 177, 178, 179,
 igr2=1301,1302,1301,1302,
 &end
#
#   80 GLN  HN           79 MET  HB-         5.50    (#   1703:25  Unique         2.47, 3.46 A)
 &rst
  ixpk= 1703, nxpk= 25, iat=1314,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1301,1302,
 &end
#
#   76 ASP  HN           77 LYS  HB+         5.50    (#   1704:25  Unique         4.41, 5.69 A)
 &rst
  ixpk= 1704, nxpk= 25, iat=1249,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1265,1266,
 &end
#
#    0 AMB  25-3:1705     0 AMB  25-1:1705   4.50    (#   1705:25  Double Ambig)
 &rst
  ixpk= 1705, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1297,1167,
 igr2=1301,1302,1301,1302,
 &end
#
#    0 AMB  25-3:1706    79 MET  HB-         5.50    (#   1706:25  Single Ambig)
 &rst
  ixpk= 1706, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1297,1167,
 igr2=1301,1302,
 &end
#
#   79 MET  HG-          79 MET  HB-         5.50    (#   1707:25  Unique         2.25, 2.64 A)
 &rst
  ixpk= 1707, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1304,1305,
 igr2=1301,1302,
 &end
#
#   79 MET  HG-          79 MET  HB+         5.50    (#   1708:25  Unique         2.25, 2.64 A)
 &rst
  ixpk= 1708, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1304,1305,
 igr2=1301,1302,
 &end
#
#   69 MET  QE           79 MET  HG+         5.50    (#   1709:25  Unique         2.62, 5.44 A)
 &rst
  ixpk= 1709, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1144,1145,1146,
 igr2=1304,1305,
 &end
#
#   69 MET  QE           79 MET  HG-         5.50    (#   1710:25  Unique         2.62, 5.44 A)
 &rst
  ixpk= 1710, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1144,1145,1146,
 igr2=1304,1305,
 &end
#
#   79 MET  HB+          79 MET  HG-         5.50    (#   1711:25  Unique         2.25, 2.64 A)
 &rst
  ixpk= 1711, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1301,1302,
 igr2=1304,1305,
 &end
#
#   79 MET  HB+          79 MET  HG+         5.50    (#   1712:25  Unique         2.25, 2.64 A)
 &rst
  ixpk= 1712, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1301,1302,
 igr2=1304,1305,
 &end
#
#    0 AMB  25-3:1713     0 AMB  25-1:1713   5.50    (#   1713:25  Double Ambig)
 &rst
  ixpk= 1713, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1344,1345,1346, 177, 178, 179,
 igr2=1304,1305,1304,1305,
 &end
#
#   11 ILE  QG2          79 MET  HG-         5.50    (#   1714:25  Unique         4.29, 5.53 A)
 &rst
  ixpk= 1714, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 177, 178, 179,
 igr2=1304,1305,
 &end
#
#    0 AMB  25-3:1715    79 MET  HG-         5.50    (#   1715:25  Single Ambig)
 &rst
  ixpk= 1715, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1299,1293,
 igr2=1304,1305,
 &end
#
#    0 AMB  25-3:1716     0 AMB  25-1:1716   5.50    (#   1716:25  Double Ambig)
 &rst
  ixpk= 1716, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1299,1293,
 igr2=1304,1305,1304,1305,
 &end
#
#    0 AMB  25-3:1717     0 AMB  25-1:1717   5.50    (#   1717:25  Double Ambig)
 &rst
  ixpk= 1717, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1301,1302,1137,1138,
 igr2=1304,1305,1304,1305,
 &end
#
#    0 AMB  25-3:1718    79 MET  HG-         5.50    (#   1718:25  Single Ambig)
 &rst
  ixpk= 1718, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1301,1302,1137,1138,
 igr2=1304,1305,
 &end
#
#    0 AMB  25-3:1719    80 GLN  HB-         2.80    (#   1719:25  Single Ambig)
 &rst
  ixpk= 1719, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 208, 209,1321,1322,1321,1322,
 igr2=1318,1319,
 &end
#
#    0 AMB  25-3:1720     0 AMB  25-1:1720   2.80    (#   1720:25  Double Ambig)
 &rst
  ixpk= 1720, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1= 208, 209,1321,1322,1321,1322, 373, 374, 107, 108,
      
 igr2=1318,1319,1318,1319,1318,1319, 370, 371, 104, 105,
      
 &end
#
#    0 AMB  25-3:1721     0 AMB  25-1:1721   3.50    (#   1721:25  Double Ambig)
 &rst
  ixpk= 1721, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr1= 831, 832, 385, 386, 317, 318, 317, 318, 432, 433,
      
 igr2= 255, 256, 370, 371,
 &end
#
#   81 ILE  HB           80 GLN  HB-         7.00    (#   1722:25  Unique         5.82, 6.40 A)
 &rst
  ixpk= 1722, nxpk= 25, iat=1335,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1318,1319,
 &end
#
#   80 GLN  HA           80 GLN  HB-         4.50    (#   1723:25  Unique         2.45, 2.78 A)
 &rst
  ixpk= 1723, nxpk= 25, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1318,1319,
 &end
#
#    0 AMB  25-3:1724    80 GLN  HB-         4.50    (#   1724:25  Single Ambig)
 &rst
  ixpk= 1724, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1314,1162,1163,
 igr2=1318,1319,
 &end
#
#    0 AMB  25-3:1725    80 GLN  HB-         5.50    (#   1725:25  Single Ambig)
 &rst
  ixpk= 1725, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 177, 178, 179,1344,1345,1346,
 igr2=1318,1319,
 &end
#
#    0 AMB  25-3:1726     0 AMB  25-1:1726   4.50    (#   1726:25  Double Ambig)
 &rst
  ixpk= 1726, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 177, 178, 179, 298, 299, 298, 299,1344,1345,1346,
      
 igr2=1318,1319, 255, 256, 255, 256,1318,1319,
 &end
#
#    0 AMB  25-3:1727    80 GLN  HB-         5.50    (#   1727:25  Single Ambig)
 &rst
  ixpk= 1727, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 204,1167,
 igr2=1318,1319,
 &end
#
#   12 ASN  HB-          80 GLN  HB+         5.50    (#   1728:25  Unique         2.67, 4.72 A)
 &rst
  ixpk= 1728, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 194, 195,
 igr2=1318,1319,
 &end
#
#   12 ASN  HB-          80 GLN  HB-         5.50    (#   1729:25  Unique         2.67, 4.72 A)
 &rst
  ixpk= 1729, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 194, 195,
 igr2=1318,1319,
 &end
#
#    0 AMB  25-3:1730     0 AMB  25-1:1730   5.50    (#   1730:25  Double Ambig)
 &rst
  ixpk= 1730, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.21, r4=12.71,
 igr1=1341,1342,1341,1342,1341,1342,1271,1272,1271,1272,
      1271,1272,
 igr2=1321,1322,1321,1322,1321,1322,1321,1322,1321,1322,
      
 &end
#
#   80 GLN  HB-           0 AMB  25-1:1731   2.80    (#   1731:25  Single Ambig)
 &rst
  ixpk= 1731, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1318,1319,
 igr2=1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1732     0 AMB  25-1:1732   2.80    (#   1732:25  Double Ambig)
 &rst
  ixpk= 1732, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1318,1319,1318,1319,
 igr2=1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1733     0 AMB  25-1:1733   4.50    (#   1733:25  Double Ambig)
 &rst
  ixpk= 1733, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1287,1288,1287,1288,1290,1291,1290,1291,1154,1155,
      
 igr2=1321,1322,1321,1322,1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1734     0 AMB  25-1:1734   4.50    (#   1734:25  Double Ambig)
 &rst
  ixpk= 1734, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 208, 209, 208, 209,
 igr2=1321,1322,1321,1322,
 &end
#
#   80 GLN  HA            0 AMB  25-1:1735   3.50    (#   1735:25  Single Ambig)
 &rst
  ixpk= 1735, nxpk= 25, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1321,1322,1321,1322,
 &end
#
#   80 GLN  HE2-          0 AMB  25-1:1736   4.50    (#   1736:25  Single Ambig)
 &rst
  ixpk= 1736, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1326,1327,
 igr2=1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1737     0 AMB  25-1:1737   3.50    (#   1737:25  Double Ambig)
 &rst
  ixpk= 1737, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1326,1327,1326,1327,
 igr2=1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1738     0 AMB  25-1:1738   4.50    (#   1738:25  Double Ambig)
 &rst
  ixpk= 1738, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1314,1162,1163,1162,1163,
 igr2=1321,1322,1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1739     0 AMB  25-1:1739   5.50    (#   1739:25  Double Ambig)
 &rst
  ixpk= 1739, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 213, 214, 213, 214,
 igr2=1321,1322,1321,1322,
 &end
#
#   81 ILE  HN            0 AMB  25-1:1740   4.50    (#   1740:25  Single Ambig)
 &rst
  ixpk= 1740, nxpk= 25, iat=1331,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1741     0 AMB  25-1:1741   5.50    (#   1741:25  Double Ambig)
 &rst
  ixpk= 1741, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1167,1297, 204,
 igr2=1321,1322,1321,1322,1321,1322,1321,1322,
 &end
#
#    0 AMB  25-3:1742    81 ILE  HA          3.50    (#   1742:25  Single Ambig)
 &rst
  ixpk= 1742, nxpk= 25, iat=  -1,1333, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 181, 182,1344,1345,1346,
 &end
#
#   82 ALA  HN           81 ILE  HA          3.50    (#   1745:25  Unique         1.95, 2.26 A)
 &rst
  ixpk= 1745, nxpk= 25, iat=1350,1333, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 LEU  HG           81 ILE  HB          4.50    (#   1746:25  Unique         2.74, 3.20 A)
 &rst
  ixpk= 1746, nxpk= 25, iat=1083,1335, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   81 ILE  QD1          81 ILE  HB          3.50    (#   1747:25  Unique         2.22, 3.19 A)
 &rst
  ixpk= 1747, nxpk= 25, iat=  -1,1335, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1344,1345,1346,
 &end
#
#   81 ILE  QG2          81 ILE  HB          3.50    (#   1748:25  Unique         2.35, 2.67 A)
 &rst
  ixpk= 1748, nxpk= 25, iat=  -1,1335, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1337,1338,1339,
 &end
#
#   70 GLN  HE2-         81 ILE  HB          7.00    (#   1749:25  Unique         3.15, 3.97 A)
 &rst
  ixpk= 1749, nxpk= 25, iat=  -1,1335, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1162,1163,
 &end
#
#   81 ILE  HN           81 ILE  HB          4.50    (#   1750:25  Unique         2.78, 2.93 A)
 &rst
  ixpk= 1750, nxpk= 25, iat=1331,1335, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   66 LEU  MDY          81 ILE  HB          5.50    (#   1751:25  Unique         2.20, 4.18 A)
 &rst
  ixpk= 1751, nxpk= 25, iat=  -1,1335, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#   71 GLY  HN           81 ILE  HB          5.50    (#   1753:25  Unique         5.17, 5.50 A)
 &rst
  ixpk= 1753, nxpk= 25, iat=1167,1335, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   67 ARG  HA            0 AMB  25-1:1754   5.50    (#   1754:25  Single Ambig)
 &rst
  ixpk= 1754, nxpk= 25, iat=1097,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1341,1342,1341,1342,
 &end
#
#    0 AMB  25-3:1755     0 AMB  25-1:1755   3.50    (#   1755:25  Double Ambig)
 &rst
  ixpk= 1755, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 557,1152,
 igr2= 559, 560, 559, 560,1341,1342,1341,1342,
 &end
#
#   33 GLN  HN            0 AMB  25-1:1757   5.50    (#   1757:25  Single Ambig)
 &rst
  ixpk= 1757, nxpk= 25, iat= 555,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 559, 560, 559, 560,
 &end
#
#    0 AMB  25-3:1758     0 AMB  25-1:1758   5.50    (#   1758:25  Double Ambig)
 &rst
  ixpk= 1758, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 580, 588, 572,
 igr2= 559, 560, 559, 560, 559, 560,
 &end
#
#   69 MET  HN            0 AMB  25-1:1759   5.50    (#   1759:25  Single Ambig)
 &rst
  ixpk= 1759, nxpk= 25, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1341,1342,1341,1342,
 &end
#
#    0 AMB  25-3:1760     0 AMB  25-1:1760   2.80    (#   1760:25  Double Ambig)
 &rst
  ixpk= 1760, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1=1344,1345,1346, 177, 178, 179, 181, 182,
 igr2=1341,1342,1341,1342,1341,1342,1341,1342,
 &end
#
#    9 ILE  QD1          81 ILE  QD1         5.50    (#   1761:25  Unique         2.67, 4.80 A)
 &rst
  ixpk= 1761, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 144, 145, 146,
 igr2=1344,1345,1346,
 &end
#
#    0 AMB  25-3:1762    81 ILE  QD1         4.50    (#   1762:25  Single Ambig)
 &rst
  ixpk= 1762, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
 igr1=1085,1086,1087,1089,1090,1091, 184, 185, 186,
 igr2=1344,1345,1346,
 &end
#
#    0 AMB  25-3:1763    81 ILE  QD1         4.50    (#   1763:25  Single Ambig)
 &rst
  ixpk= 1763, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1083,1070,1071,1072,
 igr2=1344,1345,1346,
 &end
#
#    0 AMB  25-3:1764    81 ILE  QD1         2.80    (#   1764:25  Single Ambig)
 &rst
  ixpk= 1764, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1341,1342,1341,1342,
 igr2=1344,1345,1346,
 &end
#
#   69 MET  HB+          81 ILE  QD1         3.50    (#   1765:25  Unique         2.33, 3.21 A)
 &rst
  ixpk= 1765, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1137,1138,
 igr2=1344,1345,1346,
 &end
#
#   69 MET  QE           81 ILE  QD1         5.50    (#   1766:25  Unique         4.17, 6.36 A)
 &rst
  ixpk= 1766, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1144,1145,1146,
 igr2=1344,1345,1346,
 &end
#
#    0 AMB  25-3:1767    81 ILE  QD1         4.50    (#   1767:25  Single Ambig)
 &rst
  ixpk= 1767, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1137,1138,1308,1309,1310,
 igr2=1344,1345,1346,
 &end
#
#    0 AMB  25-3:1768    81 ILE  QD1         5.50    (#   1768:25  Single Ambig)
 &rst
  ixpk= 1768, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1301,1302,1154,1155,
 igr2=1344,1345,1346,
 &end
#
#   66 LEU  HA           81 ILE  QD1         4.50    (#   1769:25  Unique         2.72, 3.70 A)
 &rst
  ixpk= 1769, nxpk= 25, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1344,1345,1346,
 &end
#
#   70 GLN  HA           81 ILE  QD1         4.50    (#   1770:25  Unique         2.31, 3.51 A)
 &rst
  ixpk= 1770, nxpk= 25, iat=1152,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1344,1345,1346,
 &end
#
#   81 ILE  HA           81 ILE  QD1         5.50    (#   1771:25  Unique         4.43, 4.84 A)
 &rst
  ixpk= 1771, nxpk= 25, iat=1333,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1344,1345,1346,
 &end
#
#   31 PHE  QE           81 ILE  QD1         5.50    (#   1772:25  Unique         2.22, 4.47 A)
 &rst
  ixpk= 1772, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 534, 538,
 igr2=1344,1345,1346,
 &end
#
#   70 GLN  HN           81 ILE  QD1         4.50    (#   1773:25  Unique         2.80, 3.97 A)
 &rst
  ixpk= 1773, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1344,1345,1346,
 &end
#
#   69 MET  HN           81 ILE  QD1         5.50    (#   1774:25  Unique         3.72, 4.64 A)
 &rst
  ixpk= 1774, nxpk= 25, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1344,1345,1346,
 &end
#
#   81 ILE  HN           81 ILE  QD1         5.50    (#   1775:25  Unique         4.18, 5.10 A)
 &rst
  ixpk= 1775, nxpk= 25, iat=1331,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1344,1345,1346,
 &end
#
#    0 AMB  25-3:1776    81 ILE  QD1         5.50    (#   1776:25  Single Ambig)
 &rst
  ixpk= 1776, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1167,1297,
 igr2=1344,1345,1346,
 &end
#
#   66 LEU  MDX          81 ILE  QG2         3.50    (#   1777:25  Unique         2.75, 4.76 A)
 &rst
  ixpk= 1777, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1337,1338,1339,
 &end
#
#    9 ILE  QD1          81 ILE  QG2         3.50    (#   1778:25  Unique         2.16, 3.80 A)
 &rst
  ixpk= 1778, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 144, 145, 146,
 igr2=1337,1338,1339,
 &end
#
#    0 AMB  25-3:1779    81 ILE  QG2         4.50    (#   1779:25  Single Ambig)
 &rst
  ixpk= 1779, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
 igr1=1085,1086,1087,1089,1090,1091, 184, 185, 186,
 igr2=1337,1338,1339,
 &end
#
#   66 LEU  HG           81 ILE  QG2         3.50    (#   1781:25  Unique         1.93, 2.89 A)
 &rst
  ixpk= 1781, nxpk= 25, iat=1083,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1337,1338,1339,
 &end
#
#    0 AMB  25-3:1782    81 ILE  QG2         3.50    (#   1782:25  Single Ambig)
 &rst
  ixpk= 1782, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 181, 182, 141, 142,
 igr2=1337,1338,1339,
 &end
#
#    0 AMB  25-3:1783    81 ILE  QG2         2.80    (#   1783:25  Single Ambig)
 &rst
  ixpk= 1783, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1=1341,1342,1341,1342, 135,
 igr2=1337,1338,1339,
 &end
#
#   81 ILE  HB           81 ILE  QG2         2.80    (#   1784:25  Unique         2.35, 2.67 A)
 &rst
  ixpk= 1784, nxpk= 25, iat=1335,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1337,1338,1339,
 &end
#
#   66 LEU  HA           81 ILE  QG2         3.50    (#   1785:25  Unique         2.31, 3.79 A)
 &rst
  ixpk= 1785, nxpk= 25, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1337,1338,1339,
 &end
#
#   11 ILE  HA           81 ILE  QG2         4.50    (#   1786:25  Unique         2.22, 3.47 A)
 &rst
  ixpk= 1786, nxpk= 25, iat= 173,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1337,1338,1339,
 &end
#
#   81 ILE  HA           81 ILE  QG2         3.50    (#   1788:25  Unique         2.39, 3.01 A)
 &rst
  ixpk= 1788, nxpk= 25, iat=1333,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1337,1338,1339,
 &end
#
#   82 ALA  HN           81 ILE  QG2         3.50    (#   1789:25  Unique         1.83, 2.94 A)
 &rst
  ixpk= 1789, nxpk= 25, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1337,1338,1339,
 &end
#
#   66 LEU  HN           81 ILE  QG2         5.50    (#   1790:25  Unique         4.44, 6.04 A)
 &rst
  ixpk= 1790, nxpk= 25, iat=1076,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1337,1338,1339,
 &end
#
#   83 TYR  HN           82 ALA  HA          3.50    (#   1791:25  Unique         2.54, 2.65 A)
 &rst
  ixpk= 1791, nxpk= 25, iat=1360,1352, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   82 ALA  HN           82 ALA  HA          4.50    (#   1793:25  Unique         2.74, 2.93 A)
 &rst
  ixpk= 1793, nxpk= 25, iat=1350,1352, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   82 ALA  QB           82 ALA  HA          2.80    (#   1794:25  Unique         2.45, 2.69 A)
 &rst
  ixpk= 1794, nxpk= 25, iat=  -1,1352, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1354,1355,1356,
 &end
#
#   66 LEU  MDX          82 ALA  HA          3.50    (#   1795:25  Unique         2.16, 3.90 A)
 &rst
  ixpk= 1795, nxpk= 25, iat=  -1,1352, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#    0 AMB  25-3:1797     0 AMB  25-1:1797   2.80    (#   1797:25  Double Ambig)
 &rst
  ixpk= 1797, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1=1265,1266,1265,1266, 404, 405, 404, 405,1287,1288,
      
 igr2=1268,1269,1268,1269, 336, 337,1268,1269,
 &end
#
#   33 GLN  HA           34 PHE  HB+         5.50    (#   1801:25  Unique         5.10, 6.12 A)
 &rst
  ixpk= 1801, nxpk= 25, iat= 557,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 576, 577,
 &end
#
#    0 AMB  25-3:1803     0 AMB  25-1:1803   3.50    (#   1803:25  Double Ambig)
 &rst
  ixpk= 1803, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 580, 588, 572, 592,
 igr2= 576, 577, 576, 577, 576, 577,
 &end
#
#    0 AMB  25-3:1804    34 PHE  HB-         3.50    (#   1804:25  Single Ambig)
 &rst
  ixpk= 1804, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 580, 588, 572, 592,
 igr2= 576, 577,
 &end
#
#   56 PHE  QE            0 AMB  25-1:1805   5.50    (#   1805:25  Single Ambig)
 &rst
  ixpk= 1805, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 947, 951,
 igr2= 528, 529, 576, 577,
 &end
#
#    0 AMB  25-3:1806    34 PHE  HB-         5.50    (#   1806:25  Single Ambig)
 &rst
  ixpk= 1806, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 947, 951, 582, 586,
 igr2= 576, 577,
 &end
#
#    0 AMB  25-3:1807     0 AMB  25-1:1807   5.50    (#   1807:25  Double Ambig)
 &rst
  ixpk= 1807, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1268,1269,1268,1269,1354,1355,1356,1335,
 igr2=1299,1383,
 &end
#
#    0 AMB  25-3:1808    84 SER  HA          4.50    (#   1808:25  Single Ambig)
 &rst
  ixpk= 1808, nxpk= 25, iat=  -1,1383, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1392,1381,
 &end
#
#   84 SER  HB-          84 SER  HA          3.50    (#   1811:25  Unique         2.35, 2.71 A)
 &rst
  ixpk= 1811, nxpk= 25, iat=  -1,1383, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1385,1386,
 &end
#
#    0 AMB  25-3:1812    84 SER  HA          5.50    (#   1812:25  Single Ambig)
 &rst
  ixpk= 1812, nxpk= 25, iat=  -1,1383, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 154, 155, 154, 155,
 &end
#
#    8 THR  QG2          84 SER  HB+         4.50    (#   1815:25  Unique         2.37, 4.17 A)
 &rst
  ixpk= 1815, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 123, 124, 125,
 igr2=1385,1386,
 &end
#
#    8 THR  QG2          84 SER  HB-         5.50    (#   1816:25  Unique         2.37, 4.17 A)
 &rst
  ixpk= 1816, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 123, 124, 125,
 igr2=1385,1386,
 &end
#
#   84 SER  HA           84 SER  HB-         4.50    (#   1817:25  Unique         2.35, 2.71 A)
 &rst
  ixpk= 1817, nxpk= 25, iat=1383,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1385,1386,
 &end
#
#   84 SER  HA           84 SER  HB+         4.50    (#   1818:25  Unique         2.35, 2.71 A)
 &rst
  ixpk= 1818, nxpk= 25, iat=1383,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1385,1386,
 &end
#
#    8 THR  HB           84 SER  HB-         4.50    (#   1819:25  Unique         2.12, 3.05 A)
 &rst
  ixpk= 1819, nxpk= 25, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1385,1386,
 &end
#
#    8 THR  HB           84 SER  HB+         4.50    (#   1820:25  Unique         2.12, 3.05 A)
 &rst
  ixpk= 1820, nxpk= 25, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1385,1386,
 &end
#
#    0 AMB  25-3:1824     0 AMB  25-1:1824   4.50    (#   1824:25  Double Ambig)
 &rst
  ixpk= 1824, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1392,1381,
 igr2=1385,1386,1385,1386,
 &end
#
#    0 AMB  25-3:1825     0 AMB  25-1:1825   5.50    (#   1825:25  Double Ambig)
 &rst
  ixpk= 1825, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 158, 167, 160, 165,
 igr2=1385,1386,1385,1386,
 &end
#
#   36 GLN  HB-          36 GLN  HA          3.50    (#   1827:25  Unique         2.22, 2.74 A)
 &rst
  ixpk= 1827, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 603, 604,
 &end
#
#   36 GLN  HG+          36 GLN  HA          4.50    (#   1828:25  Unique         2.31, 3.43 A)
 &rst
  ixpk= 1828, nxpk= 25, iat=  -1, 601, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 606, 607,
 &end
#
#    0 AMB  25-3:1829     0 AMB  25-1:1829   5.50    (#   1829:25  Double Ambig)
 &rst
  ixpk= 1829, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1396,1397,1396,1397, 626, 627,
 igr2=1394, 601,
 &end
#
#    0 AMB  25-3:1830     0 AMB  25-1:1830   5.50    (#   1830:25  Double Ambig)
 &rst
  ixpk= 1830, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 599,1392,
 igr2= 601,1394,
 &end
#
#   88 SER  HB+          88 SER  HA          3.50    (#   1833:25  Unique         2.21, 2.72 A)
 &rst
  ixpk= 1833, nxpk= 25, iat=  -1,1439, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1441,1442,
 &end
#
#   89 ASP  HN           88 SER  HA          5.50    (#   1834:25  Unique         3.51, 3.57 A)
 &rst
  ixpk= 1834, nxpk= 25, iat=1448,1439, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   92 ALA  QB           88 SER  HB+         5.50    (#   1842:25  Unique         4.08, 6.04 A)
 &rst
  ixpk= 1842, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1499,1500,1501,
 igr2=1441,1442,
 &end
#
#   55 ILE  HG1+         84 SER  HB-         5.50    (#   1843:25  Unique         5.85, 7.18 A)
 &rst
  ixpk= 1843, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 928, 929,
 igr2=1385,1386,
 &end
#
#  102 PRO  HA          101 ARG  HA          4.50    (#   1850:25  Unique         4.28, 4.45 A)
 &rst
  ixpk= 1850, nxpk= 25, iat=1680,1648, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   90 ILE  HA           90 ILE  HB          4.50    (#   1857:25  Unique         2.16, 2.40 A)
 &rst
  ixpk= 1857, nxpk= 25, iat=1462,1464, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   90 ILE  HN           90 ILE  HB          4.50    (#   1859:25  Unique         3.57, 3.69 A)
 &rst
  ixpk= 1859, nxpk= 25, iat=1460,1464, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   90 ILE  HN           90 ILE  HG1+        5.50    (#   1866:25  Unique         2.05, 2.78 A)
 &rst
  ixpk= 1866, nxpk= 25, iat=1460,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1470,1471,
 &end
#
#   90 ILE  HN           90 ILE  HG1-        5.50    (#   1867:25  Unique         2.05, 2.78 A)
 &rst
  ixpk= 1867, nxpk= 25, iat=1460,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1470,1471,
 &end
#
#   90 ILE  HG1+         90 ILE  QD1         2.80    (#   1871:25  Unique         2.30, 2.66 A)
 &rst
  ixpk= 1871, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1470,1471,
 igr2=1473,1474,1475,
 &end
#
#   90 ILE  HG1+         90 ILE  QG2         3.50    (#   1879:25  Unique         2.46, 3.56 A)
 &rst
  ixpk= 1879, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1470,1471,
 igr2=1466,1467,1468,
 &end
#
#   91 VAL  HA           90 ILE  QG2         5.50    (#   1883:25  Unique         6.47, 6.66 A)
 &rst
  ixpk= 1883, nxpk= 25, iat=1481,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1466,1467,1468,
 &end
#
#   53 PHE  QE           90 ILE  QG2         5.50    (#   1886:25  Unique         2.71, 4.55 A)
 &rst
  ixpk= 1886, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 892, 896,
 igr2=1466,1467,1468,
 &end
#
#   91 VAL  HN           90 ILE  QG2         4.50    (#   1887:25  Unique         4.30, 4.90 A)
 &rst
  ixpk= 1887, nxpk= 25, iat=1479,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1466,1467,1468,
 &end
#
#   90 ILE  HN           90 ILE  QG2         4.50    (#   1889:25  Unique         2.23, 3.32 A)
 &rst
  ixpk= 1889, nxpk= 25, iat=1460,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1466,1467,1468,
 &end
#
#   93 LYS  HN           90 ILE  QG2         5.50    (#   1890:25  Unique         5.23, 6.22 A)
 &rst
  ixpk= 1890, nxpk= 25, iat=1505,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1466,1467,1468,
 &end
#
#   94 ILE  HB           91 VAL  HA          5.50    (#   1891:25  Unique         2.34, 4.98 A)
 &rst
  ixpk= 1891, nxpk= 25, iat=1531,1481, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   87 ASP  HA           91 VAL  HB          5.50    (#   1897:25  Unique         4.35, 5.29 A)
 &rst
  ixpk= 1897, nxpk= 25, iat=1427,1483, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   91 VAL  HN           91 VAL  HB          4.50    (#   1898:25  Unique         2.34, 2.45 A)
 &rst
  ixpk= 1898, nxpk= 25, iat=1479,1483, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   90 ILE  HG1-         91 VAL  QG+         3.50    (#   1901:25  Unique         2.34, 5.30 A)
 &rst
  ixpk= 1901, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1470,1471,
 igr2=1485,1486,1487,1489,1490,1491,
 &end
#
#   90 ILE  HB           91 VAL  QG+         5.50    (#   1902:25  Unique         4.64, 6.56 A)
 &rst
  ixpk= 1902, nxpk= 25, iat=1464,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1485,1486,1487,1489,1490,1491,
 &end
#
#   94 ILE  HG1-         91 VAL  QG+         5.50    (#   1903:25  Unique         3.81, 5.35 A)
 &rst
  ixpk= 1903, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1537,1538,
 igr2=1485,1486,1487,1489,1490,1491,
 &end
#
#   91 VAL  HB           91 VAL  QG+         3.50    (#   1904:25  Unique         2.28, 2.68 A)
 &rst
  ixpk= 1904, nxpk= 25, iat=1483,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1485,1486,1487,1489,1490,1491,
 &end
#
#   91 VAL  HA           91 VAL  QG+         3.50    (#   1905:25  Unique         2.15, 3.15 A)
 &rst
  ixpk= 1905, nxpk= 25, iat=1481,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1485,1486,1487,1489,1490,1491,
 &end
#
#   89 ASP  HA           91 VAL  QG+         5.50    (#   1907:25  Unique         6.21, 7.42 A)
 &rst
  ixpk= 1907, nxpk= 25, iat=1450,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1485,1486,1487,1489,1490,1491,
 &end
#
#   91 VAL  HN           91 VAL  QG+         4.50    (#   1908:25  Unique         2.07, 3.86 A)
 &rst
  ixpk= 1908, nxpk= 25, iat=1479,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1485,1486,1487,1489,1490,1491,
 &end
#
#    0 AMB  25-3:1910    41 VAL  QG-         5.50    (#   1910:25  Single Ambig)
 &rst
  ixpk= 1910, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 886, 887, 886, 887,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   98 PHE  HA           92 ALA  HA          5.50    (#   1919:25  Unique         4.05, 4.81 A)
 &rst
  ixpk= 1919, nxpk= 25, iat=1591,1497, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   91 VAL  QG-          92 ALA  QB          5.50    (#   1922:25  Unique         4.33, 6.90 A)
 &rst
  ixpk= 1922, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1485,1486,1487,1489,1490,1491,
 igr2=1499,1500,1501,
 &end
#
#   94 ILE  HG1+         92 ALA  QB          7.00    (#   1923:25  Unique         6.22, 7.44 A)
 &rst
  ixpk= 1923, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1537,1538,
 igr2=1499,1500,1501,
 &end
#
#   98 PHE  HB-          92 ALA  QB          5.50    (#   1928:25  Unique         2.44, 5.08 A)
 &rst
  ixpk= 1928, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1593,1594,
 igr2=1499,1500,1501,
 &end
#
#   89 ASP  HA           92 ALA  QB          4.50    (#   1930:25  Unique         2.35, 3.70 A)
 &rst
  ixpk= 1930, nxpk= 25, iat=1450,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1499,1500,1501,
 &end
#
#   98 PHE  QD           92 ALA  QB          5.50    (#   1932:25  Unique         2.56, 6.30 A)
 &rst
  ixpk= 1932, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1597,1605,
 igr2=1499,1500,1501,
 &end
#
#   17 LYS  HN           17 LYS  HG+         4.50    (#   1944:25  Unique         2.29, 3.30 A)
 &rst
  ixpk= 1944, nxpk= 25, iat= 266,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 273, 274,
 &end
#
#    0 AMB  25-3:1951     0 AMB  25-1:1951   5.50    (#   1951:25  Double Ambig)
 &rst
  ixpk= 1951, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.00, r4=11.50,
 igr1= 859, 860, 859, 860, 859, 860, 862, 863,
 igr2= 798, 799, 798, 799, 798, 799, 798, 799,
 &end
#
#   94 ILE  QD1          94 ILE  HA          4.50    (#   1952:25  Unique         4.20, 5.05 A)
 &rst
  ixpk= 1952, nxpk= 25, iat=  -1,1529, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1540,1541,1542,
 &end
#
#   64 ASN  HN            0 AMB  25-1:1957   4.50    (#   1957:25  Single Ambig)
 &rst
  ixpk= 1957, nxpk= 25, iat=1052,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1045,1046,1045,1046,
 &end
#
#   91 VAL  HA           94 ILE  HB          5.50    (#   1960:25  Unique         2.34, 4.98 A)
 &rst
  ixpk= 1960, nxpk= 25, iat=1481,1531, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 ILE  HA           94 ILE  HB          5.50    (#   1961:25  Unique         2.25, 2.41 A)
 &rst
  ixpk= 1961, nxpk= 25, iat=1529,1531, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 ILE  HG1+         94 ILE  HB          5.50    (#   1964:25  Unique         2.01, 2.72 A)
 &rst
  ixpk= 1964, nxpk= 25, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1537,1538,
 &end
#
#   94 ILE  HA           94 ILE  HG1+        4.50    (#   1969:25  Unique         2.46, 3.74 A)
 &rst
  ixpk= 1969, nxpk= 25, iat=1529,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1537,1538,
 &end
#
#    0 AMB  25-3:1971     0 AMB  25-1:1971   5.50    (#   1971:25  Double Ambig)
 &rst
  ixpk= 1971, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 622, 623, 624, 464, 465, 466,
 igr2= 676, 677, 676, 677,
 &end
#
#   94 ILE  HG1+         94 ILE  QD1         2.80    (#   1973:25  Unique         2.20, 2.64 A)
 &rst
  ixpk= 1973, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1537,1538,
 igr2=1540,1541,1542,
 &end
#
#   90 ILE  HG1-         94 ILE  QD1         4.50    (#   1974:25  Unique         2.48, 6.05 A)
 &rst
  ixpk= 1974, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1470,1471,
 igr2=1540,1541,1542,
 &end
#
#   90 ILE  HG1+         90 ILE  QD1         3.50    (#   1975:25  Unique         2.30, 2.66 A)
 &rst
  ixpk= 1975, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1470,1471,
 igr2=1473,1474,1475,
 &end
#
#   91 VAL  HA           94 ILE  QD1         5.50    (#   1980:25  Unique         2.59, 3.56 A)
 &rst
  ixpk= 1980, nxpk= 25, iat=1481,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1540,1541,1542,
 &end
#
#   94 ILE  HA           94 ILE  QD1         5.50    (#   1981:25  Unique         4.20, 5.05 A)
 &rst
  ixpk= 1981, nxpk= 25, iat=1529,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1540,1541,1542,
 &end
#
#   90 ILE  HG1-         94 ILE  QG2         4.50    (#   1983:25  Unique         4.95, 6.58 A)
 &rst
  ixpk= 1983, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1470,1471,
 igr2=1533,1534,1535,
 &end
#
#   94 ILE  HG1+         94 ILE  QG2         2.80    (#   1984:25  Unique         2.34, 3.53 A)
 &rst
  ixpk= 1984, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1537,1538,
 igr2=1533,1534,1535,
 &end
#
#   94 ILE  HA           94 ILE  QG2         3.50    (#   1990:25  Unique         2.11, 3.09 A)
 &rst
  ixpk= 1990, nxpk= 25, iat=1529,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1533,1534,1535,
 &end
#
#   15 ASN  HB+          77 LYS  HE-         4.50    (#   2010:25  Unique         2.54, 5.08 A)
 &rst
  ixpk= 2010, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 241, 242,
 igr2=1274,1275,
 &end
#
#   61 SER  HN            5 PRO  HA          7.00    (#   2022:25  Unique         6.20, 6.99 A)
 &rst
  ixpk= 2022, nxpk= 25, iat=1020,  82, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   97 THR  QG2          97 THR  HA          3.50    (#   2023:25  Unique         2.06, 2.93 A)
 &rst
  ixpk= 2023, nxpk= 25, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1581,1582,1583,
 &end
#
#    0 AMB  25-3:2024    68 THR  QG2         5.50    (#   2024:25  Single Ambig)
 &rst
  ixpk= 2024, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1061,1062,1133,
 igr2=1125,1126,1127,
 &end
#
#   89 ASP  HA           98 PHE  HA          5.50    (#   2027:25  Unique         4.40, 5.25 A)
 &rst
  ixpk= 2027, nxpk= 25, iat=1450,1591, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 PHE  HB+          98 PHE  HA          4.50    (#   2028:25  Unique         2.04, 2.56 A)
 &rst
  ixpk= 2028, nxpk= 25, iat=  -1,1591, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1593,1594,
 &end
#
#   98 PHE  QD           98 PHE  HA          4.50    (#   2031:25  Unique         2.17, 3.92 A)
 &rst
  ixpk= 2031, nxpk= 25, iat=  -1,1591, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1597,1605,
 &end
#
#   98 PHE  HA           98 PHE  HB+         4.50    (#   2034:25  Unique         2.04, 2.56 A)
 &rst
  ixpk= 2034, nxpk= 25, iat=1591,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1593,1594,
 &end
#
#   98 PHE  HA           98 PHE  HB-         3.50    (#   2035:25  Unique         2.04, 2.56 A)
 &rst
  ixpk= 2035, nxpk= 25, iat=1591,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1593,1594,
 &end
#
#   98 PHE  QD           98 PHE  HB+         3.50    (#   2040:25  Unique         2.30, 3.09 A)
 &rst
  ixpk= 2040, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1597,1605,
 igr2=1593,1594,
 &end
#
#   98 PHE  QD           98 PHE  HB-         3.50    (#   2041:25  Unique         2.30, 3.09 A)
 &rst
  ixpk= 2041, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1597,1605,
 igr2=1593,1594,
 &end
#
#  100 GLU  HN           99 LYS  HA          4.50    (#   2048:25  Unique         2.20, 3.24 A)
 &rst
  ixpk= 2048, nxpk= 25, iat=1631,1611, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  100 GLU  HB-         100 GLU  HA          4.50    (#   2061:25  Unique         2.14, 2.66 A)
 &rst
  ixpk= 2061, nxpk= 25, iat=  -1,1633, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1635,1636,
 &end
#
#  100 GLU  HB+         100 GLU  HA          3.50    (#   2062:25  Unique         2.14, 2.66 A)
 &rst
  ixpk= 2062, nxpk= 25, iat=  -1,1633, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1635,1636,
 &end
#
#    0 AMB  25-3:2068     0 AMB  25-1:2068   2.80    (#   2068:25  Double Ambig)
 &rst
  ixpk= 2068, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=  28,  29,  28,  29,
 igr2=  25,  26,  25,  26,
 &end
#
#    2 GLU  HA            2 GLU  HB+         5.50    (#   2070:25  Unique         2.21, 2.72 A)
 &rst
  ixpk= 2070, nxpk= 25, iat=  23,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  25,  26,
 &end
#
#    0 AMB  25-3:2075     0 AMB  25-1:2075   5.50    (#   2075:25  Double Ambig)
 &rst
  ixpk= 2075, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1105,1106,1105,1106,
 igr2=  25,  26,  25,  26,
 &end
#
#    0 AMB  25-3:2076     0 AMB  25-1:2076   2.80    (#   2076:25  Double Ambig)
 &rst
  ixpk= 2076, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1= 734, 735, 734, 735, 426, 427, 333, 334,
 igr2= 740, 741, 740, 741, 432, 433, 740, 741,
 &end
#
#    0 AMB  25-3:2078     0 AMB  25-1:2078   2.80    (#   2078:25  Double Ambig)
 &rst
  ixpk= 2078, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 737, 738, 429, 430,
 igr2= 740, 741, 740, 741, 432, 433,
 &end
#
#  101 ARG  HA          101 ARG  HB+         4.50    (#   2081:25  Unique         2.28, 2.68 A)
 &rst
  ixpk= 2081, nxpk= 25, iat=1648,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1650,1651,
 &end
#
#    0 AMB  25-3:2087    46 LEU  HG          2.80    (#   2087:25  Single Ambig)
 &rst
  ixpk= 2087, nxpk= 25, iat=  -1, 773, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 779, 780, 781, 775, 776, 777,
 &end
#
#    0 AMB  25-3:2090     0 AMB  25-1:2090   5.50    (#   2090:25  Double Ambig)
 &rst
  ixpk= 2090, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 253, 768, 268, 787, 850, 851,
 igr2= 831, 832, 773,
 &end
#
#   49 ARG  HA           49 ARG  HG-         4.50    (#   2091:25  Unique         2.26, 2.69 A)
 &rst
  ixpk= 2091, nxpk= 25, iat= 826,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 831, 832,
 &end
#
#   34 PHE  HA           34 PHE  HB+         4.50    (#   2097:25  Unique         2.42, 2.74 A)
 &rst
  ixpk= 2097, nxpk= 25, iat= 574,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 576, 577,
 &end
#
#    0 AMB  25-3:2106    44 LYS  HB-         2.80    (#   2106:25  Single Ambig)
 &rst
  ixpk= 2106, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 737, 738, 737, 738,
 igr2= 734, 735,
 &end
#
#   20 LYS  HN            0 AMB  25-1:2114   4.50    (#   2114:25  Single Ambig)
 &rst
  ixpk= 2114, nxpk= 25, iat= 329,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 743, 744, 743, 744,
 &end
#
#   76 ASP  HN            0 AMB  25-1:2115   5.50    (#   2115:25  Single Ambig)
 &rst
  ixpk= 2115, nxpk= 25, iat=1249,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 279, 280, 279, 280,
 &end
#
#  102 PRO  HD+         102 PRO  HA          4.50    (#   2119:25  Unique         3.48, 3.80 A)
 &rst
  ixpk= 2119, nxpk= 25, iat=  -1,1680, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1671,1672,
 &end
#
#  102 PRO  HA          102 PRO  HB+         4.50    (#   2121:25  Unique         2.27, 2.56 A)
 &rst
  ixpk= 2121, nxpk= 25, iat=1680,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1677,1678,
 &end
#
#  101 ARG  HA          102 PRO  HD-         3.50    (#   2134:25  Unique         2.00, 2.45 A)
 &rst
  ixpk= 2134, nxpk= 25, iat=1648,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1671,1672,
 &end
#
#  102 PRO  HA          102 PRO  HD-         5.50    (#   2143:25  Unique         3.48, 3.80 A)
 &rst
  ixpk= 2143, nxpk= 25, iat=1680,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1671,1672,
 &end
#
#   78 PRO  HA           73 PRO  HA          3.50    (#   2145:25  Unique         2.19, 2.35 A)
 &rst
  ixpk= 2145, nxpk= 25, iat=1293,1204, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   73 PRO  HB+          73 PRO  HA          3.50    (#   2147:25  Unique         2.28, 2.53 A)
 &rst
  ixpk= 2147, nxpk= 25, iat=  -1,1204, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1201,1202,
 &end
#
#   74 PHE  HN           73 PRO  HA          4.50    (#   2148:25  Unique         2.29, 2.39 A)
 &rst
  ixpk= 2148, nxpk= 25, iat=1208,1204, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   74 PHE  HB-          73 PRO  HB-         5.50    (#   2149:25  Unique         5.17, 6.48 A)
 &rst
  ixpk= 2149, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1212,1213,
 igr2=1201,1202,
 &end
#
#   79 MET  HG-          73 PRO  HB+         5.50    (#   2150:25  Unique         6.20, 7.11 A)
 &rst
  ixpk= 2150, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1304,1305,
 igr2=1201,1202,
 &end
#
#   73 PRO  HA           73 PRO  HB+         5.50    (#   2151:25  Unique         2.28, 2.53 A)
 &rst
  ixpk= 2151, nxpk= 25, iat=1204,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1201,1202,
 &end
#
#   73 PRO  HA           73 PRO  HB-         5.50    (#   2152:25  Unique         2.28, 2.53 A)
 &rst
  ixpk= 2152, nxpk= 25, iat=1204,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1201,1202,
 &end
#
#   77 LYS  HN           73 PRO  HB+         5.50    (#   2153:25  Unique         4.33, 4.99 A)
 &rst
  ixpk= 2153, nxpk= 25, iat=1261,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1201,1202,
 &end
#
#   72 PHE  HA           73 PRO  HD+         3.50    (#   2155:25  Unique         2.12, 2.39 A)
 &rst
  ixpk= 2155, nxpk= 25, iat=1176,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1195,1196,
 &end
#
#   72 PHE  HA           73 PRO  HD-         4.50    (#   2156:25  Unique         2.12, 2.39 A)
 &rst
  ixpk= 2156, nxpk= 25, iat=1176,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1195,1196,
 &end
#
#   73 PRO  HB+          73 PRO  HD-         4.50    (#   2157:25  Unique         2.84, 3.71 A)
 &rst
  ixpk= 2157, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1201,1202,
 igr2=1195,1196,
 &end
#
#   73 PRO  HB-          73 PRO  HD-         5.50    (#   2158:25  Unique         2.84, 3.71 A)
 &rst
  ixpk= 2158, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1201,1202,
 igr2=1195,1196,
 &end
#
#   73 PRO  HB-          73 PRO  HD+         4.50    (#   2160:25  Unique         2.84, 3.71 A)
 &rst
  ixpk= 2160, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1201,1202,
 igr2=1195,1196,
 &end
#
#   72 PHE  QD           73 PRO  HD+         5.50    (#   2161:25  Unique         3.01, 4.17 A)
 &rst
  ixpk= 2161, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1182,1190,
 igr2=1195,1196,
 &end
#
#   72 PHE  QD           73 PRO  HD-         5.50    (#   2162:25  Unique         3.01, 4.17 A)
 &rst
  ixpk= 2162, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1182,1190,
 igr2=1195,1196,
 &end
#
#    0 AMB  25-3:2164    78 PRO  HA          5.50    (#   2164:25  Single Ambig)
 &rst
  ixpk= 2164, nxpk= 25, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1287,1288,1265,1266,
 &end
#
#    0 AMB  25-3:2165    78 PRO  HA          5.50    (#   2165:25  Single Ambig)
 &rst
  ixpk= 2165, nxpk= 25, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1290,1291,1287,1288,
 &end
#
#    7 GLN  HN            5 PRO  HA          7.00    (#   2167:25  Unique         3.84, 5.90 A)
 &rst
  ixpk= 2167, nxpk= 25, iat= 100,  82, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   79 MET  HN           78 PRO  HA          5.50    (#   2169:25  Unique         2.19, 2.25 A)
 &rst
  ixpk= 2169, nxpk= 25, iat=1297,1293, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   75 TYR  HN           78 PRO  HA          5.50    (#   2170:25  Unique         4.69, 4.99 A)
 &rst
  ixpk= 2170, nxpk= 25, iat=1228,1293, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:2171    78 PRO  HA          5.50    (#   2171:25  Single Ambig)
 &rst
  ixpk= 2171, nxpk= 25, iat=  -1,1293, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1287,1288,1265,1266,
 &end
#
#    0 AMB  25-3:2172     0 AMB  25-1:2172   4.50    (#   2172:25  Double Ambig)
 &rst
  ixpk= 2172, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1169,1170,1284,1285,
 igr2=1290,1291,1290,1291,
 &end
#
#    0 AMB  25-3:2173    78 PRO  HB-         4.50    (#   2173:25  Single Ambig)
 &rst
  ixpk= 2173, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1169,1170,1284,1285,
 igr2=1290,1291,
 &end
#
#    0 AMB  25-3:2174     0 AMB  25-1:2174   3.50    (#   2174:25  Double Ambig)
 &rst
  ixpk= 2174, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1293,1169,1170,
 igr2=1290,1291,1290,1291,
 &end
#
#    0 AMB  25-3:2175    78 PRO  HB-         3.50    (#   2175:25  Single Ambig)
 &rst
  ixpk= 2175, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1293,1169,1170,
 igr2=1290,1291,
 &end
#
#   73 PRO  HA           78 PRO  HB+         5.50    (#   2176:25  Unique         3.28, 4.50 A)
 &rst
  ixpk= 2176, nxpk= 25, iat=1204,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1290,1291,
 &end
#
#   80 GLN  HE2-         78 PRO  HB+         5.50    (#   2177:25  Unique         3.51, 5.73 A)
 &rst
  ixpk= 2177, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1326,1327,
 igr2=1290,1291,
 &end
#
#   78 PRO  HD+          78 PRO  HG+         4.50    (#   2179:25  Unique         2.17, 2.60 A)
 &rst
  ixpk= 2179, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1284,1285,
 igr2=1287,1288,
 &end
#
#   78 PRO  HD-          78 PRO  HG+         4.50    (#   2180:25  Unique         2.17, 2.60 A)
 &rst
  ixpk= 2180, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1284,1285,
 igr2=1287,1288,
 &end
#
#   78 PRO  HD-          78 PRO  HG-         3.50    (#   2181:25  Unique         2.17, 2.60 A)
 &rst
  ixpk= 2181, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1284,1285,
 igr2=1287,1288,
 &end
#
#   78 PRO  HD+          78 PRO  HG-         4.50    (#   2182:25  Unique         2.17, 2.60 A)
 &rst
  ixpk= 2182, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1284,1285,
 igr2=1287,1288,
 &end
#
#    0 AMB  25-3:2183     0 AMB  25-1:2183   5.50    (#   2183:25  Double Ambig)
 &rst
  ixpk= 2183, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1293,1169,1170,
 igr2=1287,1288,1287,1288,
 &end
#
#   77 LYS  HA           78 PRO  HG+         5.50    (#   2184:25  Unique         4.23, 4.55 A)
 &rst
  ixpk= 2184, nxpk= 25, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1287,1288,
 &end
#
#   13 ASN  HD2-         78 PRO  HG+         5.50    (#   2185:25  Unique         2.80, 4.13 A)
 &rst
  ixpk= 2185, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 213, 214,
 igr2=1287,1288,
 &end
#
#   78 PRO  HA           78 PRO  HD+         4.50    (#   2188:25  Unique         3.37, 3.84 A)
 &rst
  ixpk= 2188, nxpk= 25, iat=1293,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1284,1285,
 &end
#
#   77 LYS  HA           78 PRO  HD-         3.50    (#   2189:25  Unique         1.97, 2.40 A)
 &rst
  ixpk= 2189, nxpk= 25, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1284,1285,
 &end
#
#   77 LYS  HA           78 PRO  HD+         3.50    (#   2190:25  Unique         1.97, 2.40 A)
 &rst
  ixpk= 2190, nxpk= 25, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1284,1285,
 &end
#
#   13 ASN  HD2-         78 PRO  HD+         4.50    (#   2191:25  Unique         2.51, 4.02 A)
 &rst
  ixpk= 2191, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 213, 214,
 igr2=1284,1285,
 &end
#
#   13 ASN  HD2-         78 PRO  HD-         5.50    (#   2192:25  Unique         2.51, 4.02 A)
 &rst
  ixpk= 2192, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 213, 214,
 igr2=1284,1285,
 &end
#
#   13 ASN  HD2+         78 PRO  HD+         5.50    (#   2193:25  Unique         2.51, 4.02 A)
 &rst
  ixpk= 2193, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 213, 214,
 igr2=1284,1285,
 &end
#
#    0 AMB  25-3:2194     0 AMB  25-1:2194   5.50    (#   2194:25  Double Ambig)
 &rst
  ixpk= 2194, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1204,1251,
 igr2=1284,1285,1284,1285,
 &end
#
#    0 AMB  25-3:2195    78 PRO  HD-         5.50    (#   2195:25  Single Ambig)
 &rst
  ixpk= 2195, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1271,1272,1271,1272,
 igr2=1284,1285,
 &end
#
#    5 PRO  HG-           5 PRO  HB+         4.50    (#   2196:25  Unique         2.15, 2.62 A)
 &rst
  ixpk= 2196, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  76,  77,
 igr2=  79,  80,
 &end
#
#    5 PRO  HG-           5 PRO  HB-         2.80    (#   2197:25  Unique         2.15, 2.62 A)
 &rst
  ixpk= 2197, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=  76,  77,
 igr2=  79,  80,
 &end
#
#    0 AMB  25-3:2198     0 AMB  25-1:2198   5.50    (#   2198:25  Double Ambig)
 &rst
  ixpk= 2198, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=  73,  74,1015,1016,
 igr2=  79,  80,  79,  80,
 &end
#
#    0 AMB  25-3:2199     5 PRO  HB-         5.50    (#   2199:25  Single Ambig)
 &rst
  ixpk= 2199, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  73,  74,1015,1016,
 igr2=  79,  80,
 &end
#
#    5 PRO  HB+           5 PRO  HG-         4.50    (#   2200:25  Unique         2.15, 2.62 A)
 &rst
  ixpk= 2200, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  79,  80,
 igr2=  76,  77,
 &end
#
#    5 PRO  HB+           5 PRO  HG+         3.50    (#   2201:25  Unique         2.15, 2.62 A)
 &rst
  ixpk= 2201, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  79,  80,
 igr2=  76,  77,
 &end
#
#    0 AMB  25-3:2202     0 AMB  25-1:2202   5.50    (#   2202:25  Double Ambig)
 &rst
  ixpk= 2202, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=  25,  26,  40,  41,  40,  41,
 igr2=1102,1103,1102,1103,1102,1103,
 &end
#
#    5 PRO  HD+           5 PRO  HG-         3.50    (#   2205:25  Unique         1.90, 2.61 A)
 &rst
  ixpk= 2205, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  73,  74,
 igr2=  76,  77,
 &end
#
#    5 PRO  HD+           5 PRO  HG+         5.50    (#   2206:25  Unique         1.90, 2.61 A)
 &rst
  ixpk= 2206, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  73,  74,
 igr2=  76,  77,
 &end
#
#    5 PRO  HD-           5 PRO  HG-         3.50    (#   2207:25  Unique         1.90, 2.61 A)
 &rst
  ixpk= 2207, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  73,  74,
 igr2=  76,  77,
 &end
#
#    4 LEU  HA            5 PRO  HG-         5.50    (#   2208:25  Unique         4.04, 4.48 A)
 &rst
  ixpk= 2208, nxpk= 25, iat=  55,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  76,  77,
 &end
#
#    0 AMB  25-3:2210     0 AMB  25-1:2210   5.50    (#   2210:25  Double Ambig)
 &rst
  ixpk= 2210, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1119,1162,1163,
 igr2=1102,1103,1102,1103,
 &end
#
#    0 AMB  25-3:2212     5 PRO  HD-         4.50    (#   2212:25  Single Ambig)
 &rst
  ixpk= 2212, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=  62,  63,  64,  66,  67,  68,  62,  63,  64,  66,
        67,  68,
 igr2=  73,  74,
 &end
#
#    0 AMB  25-3:2213     0 AMB  25-1:2213   4.50    (#   2213:25  Double Ambig)
 &rst
  ixpk= 2213, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=  62,  63,  64,  66,  67,  68,  62,  63,  64,  66,
        67,  68,
 igr2=  73,  74,  73,  74,
 &end
#
#    0 AMB  25-3:2214     0 AMB  25-1:2214   4.50    (#   2214:25  Double Ambig)
 &rst
  ixpk= 2214, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=  57,  58,  79,  80,
 igr2=  73,  74,  73,  74,
 &end
#
#    0 AMB  25-3:2215     0 AMB  25-1:2215   4.50    (#   2215:25  Double Ambig)
 &rst
  ixpk= 2215, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=  76,  77,  79,  80,
 igr2=  73,  74,  73,  74,
 &end
#
#    5 PRO  HG-           5 PRO  HD+         4.50    (#   2216:25  Unique         1.90, 2.61 A)
 &rst
  ixpk= 2216, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  76,  77,
 igr2=  73,  74,
 &end
#
#    4 LEU  HA            5 PRO  HD+         3.50    (#   2221:25  Unique         2.02, 2.43 A)
 &rst
  ixpk= 2221, nxpk= 25, iat=  55,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=  73,  74,
 &end
#
#   73 PRO  HA           78 PRO  HD-         4.50    (#   2224:25  Unique         4.58, 5.18 A)
 &rst
  ixpk= 2224, nxpk= 25, iat=1204,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1284,1285,
 &end
#
#    0 AMB  25-3:2225    45 THR  QG2         4.50    (#   2225:25  Single Ambig)
 &rst
  ixpk= 2225, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,
 igr2= 758, 759, 760,
 &end
#
#    0 AMB  25-3:2227    45 THR  QG2         4.50    (#   2227:25  Single Ambig)
 &rst
  ixpk= 2227, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 715, 716, 770, 771,
 igr2= 758, 759, 760,
 &end
#
#    0 AMB  25-3:2228    45 THR  QG2         4.50    (#   2228:25  Single Ambig)
 &rst
  ixpk= 2228, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 789, 790, 811, 812, 811, 812,
 igr2= 758, 759, 760,
 &end
#
#   48 MET  HG-          45 THR  QG2         5.50    (#   2231:25  Unique         3.07, 5.14 A)
 &rst
  ixpk= 2231, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 814, 815,
 igr2= 758, 759, 760,
 &end
#
#   45 THR  HB           45 THR  QG2         3.50    (#   2233:25  Unique         2.36, 2.67 A)
 &rst
  ixpk= 2233, nxpk= 25, iat= 756,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 758, 759, 760,
 &end
#
#    0 AMB  25-3:2235    45 THR  QG2         4.50    (#   2235:25  Single Ambig)
 &rst
  ixpk= 2235, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 752, 807,
 igr2= 758, 759, 760,
 &end
#
#    0 AMB  25-3:2237     6 ASN  HA          3.50    (#   2237:25  Single Ambig)
 &rst
  ixpk= 2237, nxpk= 25, iat=  -1,  88, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  90,  91,  90,  91,
 &end
#
#   59 ILE  QG2           6 ASN  HA          4.50    (#   2238:25  Unique         2.14, 3.86 A)
 &rst
  ixpk= 2238, nxpk= 25, iat=  -1,  88, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1000,1001,1002,
 &end
#
#    7 GLN  HN            6 ASN  HA          4.50    (#   2239:25  Unique         2.12, 2.49 A)
 &rst
  ixpk= 2239, nxpk= 25, iat= 100,  88, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:2240     6 ASN  HA          4.50    (#   2240:25  Single Ambig)
 &rst
  ixpk= 2240, nxpk= 25, iat=  -1,  88, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1007,1008,1009,1004,1005, 137, 138, 139,
 &end
#
#    0 AMB  25-3:2241    78 PRO  HD-         4.50    (#   2241:25  Single Ambig)
 &rst
  ixpk= 2241, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1287,1288,1290,1291,
 igr2=1284,1285,
 &end
#
#    0 AMB  25-3:2242     0 AMB  25-1:2242   4.50    (#   2242:25  Double Ambig)
 &rst
  ixpk= 2242, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1287,1288,1290,1291,
 igr2=1284,1285,1284,1285,
 &end
#
#   30 ILE  QG2          69 MET  QE          4.50    (#   2243:25  Unique         2.40, 5.69 A)
 &rst
  ixpk= 2243, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 511, 512, 513,
 igr2=1144,1145,1146,
 &end
#
#   30 ILE  HB           69 MET  QE          4.50    (#   2244:25  Unique         2.78, 4.14 A)
 &rst
  ixpk= 2244, nxpk= 25, iat= 509,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1144,1145,1146,
 &end
#
#   30 ILE  QD1          69 MET  QE          3.50    (#   2245:25  Unique         2.36, 4.36 A)
 &rst
  ixpk= 2245, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 518, 519, 520,
 igr2=1144,1145,1146,
 &end
#
#   81 ILE  QD1          69 MET  QE          4.50    (#   2246:25  Unique         4.17, 6.36 A)
 &rst
  ixpk= 2246, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1344,1345,1346,
 igr2=1144,1145,1146,
 &end
#
#    0 AMB  25-3:2248    69 MET  QE          3.50    (#   2248:25  Single Ambig)
 &rst
  ixpk= 2248, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1137,1138,1140,1141,
 igr2=1144,1145,1146,
 &end
#
#   79 MET  HB+          69 MET  QE          4.50    (#   2249:25  Unique         4.31, 6.44 A)
 &rst
  ixpk= 2249, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1301,1302,
 igr2=1144,1145,1146,
 &end
#
#   79 MET  HG-          69 MET  QE          5.50    (#   2250:25  Unique         2.62, 5.44 A)
 &rst
  ixpk= 2250, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1304,1305,
 igr2=1144,1145,1146,
 &end
#
#    0 AMB  25-3:2251    69 MET  QE          3.50    (#   2251:25  Single Ambig)
 &rst
  ixpk= 2251, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1178,1179,1212,1213,
 igr2=1144,1145,1146,
 &end
#
#    0 AMB  25-3:2252    69 MET  QE          3.50    (#   2252:25  Single Ambig)
 &rst
  ixpk= 2252, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1178,1179,1212,1213,
 igr2=1144,1145,1146,
 &end
#
#   31 PHE  QE           69 MET  QE          4.50    (#   2253:25  Unique         2.64, 4.67 A)
 &rst
  ixpk= 2253, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 534, 538,
 igr2=1144,1145,1146,
 &end
#
#   70 GLN  HN           69 MET  QE          5.50    (#   2254:25  Unique         5.16, 6.78 A)
 &rst
  ixpk= 2254, nxpk= 25, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1144,1145,1146,
 &end
#
#   72 PHE  QD           69 MET  QE          3.50    (#   2255:25  Unique         2.35, 4.25 A)
 &rst
  ixpk= 2255, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1182,1190,
 igr2=1144,1145,1146,
 &end
#
#   74 PHE  QE           69 MET  QE          4.50    (#   2256:25  Unique         3.57, 6.72 A)
 &rst
  ixpk= 2256, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1218,1222,
 igr2=1144,1145,1146,
 &end
#
#    0 AMB  25-3:2257    69 MET  QE          4.50    (#   2257:25  Single Ambig)
 &rst
  ixpk= 2257, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1216,1224,1184,1188,
 igr2=1144,1145,1146,
 &end
#
#    0 AMB  25-3:2258    69 MET  QE          4.50    (#   2258:25  Single Ambig)
 &rst
  ixpk= 2258, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 524,1174, 544,
 igr2=1144,1145,1146,
 &end
#
#    0 AMB  25-3:2260    79 MET  QE          5.50    (#   2260:25  Single Ambig)
 &rst
  ixpk= 2260, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1= 181, 182,1344,1345,1346,
 igr2=1308,1309,1310,
 &end
#
#   11 ILE  QG2          79 MET  QE          5.50    (#   2261:25  Unique         2.25, 3.54 A)
 &rst
  ixpk= 2261, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 177, 178, 179,
 igr2=1308,1309,1310,
 &end
#
#   52 ALA  QB           48 MET  QE          5.50    (#   2262:25  Unique         4.09, 5.29 A)
 &rst
  ixpk= 2262, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 876, 877, 878,
 igr2= 818, 819, 820,
 &end
#
#   42 ALA  QB           48 MET  QE          4.50    (#   2264:25  Unique         4.02, 5.96 A)
 &rst
  ixpk= 2264, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 705, 706, 707,
 igr2= 818, 819, 820,
 &end
#
#   11 ILE  HB           79 MET  QE          4.50    (#   2265:25  Unique         4.44, 5.46 A)
 &rst
  ixpk= 2265, nxpk= 25, iat= 175,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1308,1309,1310,
 &end
#
#   47 LYS  HG+          48 MET  QE          5.50    (#   2266:25  Unique         4.01, 6.94 A)
 &rst
  ixpk= 2266, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 792, 793,
 igr2= 818, 819, 820,
 &end
#
#    0 AMB  25-3:2268    79 MET  QE          4.50    (#   2268:25  Single Ambig)
 &rst
  ixpk= 2268, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1341,1342,1341,1342,
 igr2=1308,1309,1310,
 &end
#
#    0 AMB  25-3:2269    79 MET  QE          3.50    (#   2269:25  Single Ambig)
 &rst
  ixpk= 2269, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1301,1302,1265,1266,
 igr2=1308,1309,1310,
 &end
#
#   48 MET  HG+          48 MET  QE          3.50    (#   2270:25  Unique         2.27, 3.63 A)
 &rst
  ixpk= 2270, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 814, 815,
 igr2= 818, 819, 820,
 &end
#
#   69 MET  QE           79 MET  QE          3.50    (#   2271:25  Unique         4.02, 7.37 A)
 &rst
  ixpk= 2271, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1144,1145,1146,
 igr2=1308,1309,1310,
 &end
#
#    0 AMB  25-3:2274    48 MET  QE          3.50    (#   2274:25  Single Ambig)
 &rst
  ixpk= 2274, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 859, 860, 859, 860, 862, 863,
 igr2= 818, 819, 820,
 &end
#
#   79 MET  HG-          79 MET  QE          4.50    (#   2275:25  Unique         2.23, 3.61 A)
 &rst
  ixpk= 2275, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1304,1305,
 igr2=1308,1309,1310,
 &end
#
#    0 AMB  25-3:2276    48 MET  QE          4.50    (#   2276:25  Single Ambig)
 &rst
  ixpk= 2276, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 814, 815, 886, 887, 886, 887,
 igr2= 818, 819, 820,
 &end
#
#   48 MET  HA           48 MET  QE          4.50    (#   2277:25  Unique         2.05, 3.14 A)
 &rst
  ixpk= 2277, nxpk= 25, iat= 809,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 818, 819, 820,
 &end
#
#   52 ALA  HA           48 MET  QE          4.50    (#   2279:25  Unique         2.10, 2.82 A)
 &rst
  ixpk= 2279, nxpk= 25, iat= 874,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 818, 819, 820,
 &end
#
#   53 PHE  QD           48 MET  QE          4.50    (#   2280:25  Unique         2.28, 4.47 A)
 &rst
  ixpk= 2280, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 890, 898,
 igr2= 818, 819, 820,
 &end
#
#   53 PHE  QE           48 MET  QE          4.50    (#   2281:25  Unique         2.59, 4.66 A)
 &rst
  ixpk= 2281, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 892, 896,
 igr2= 818, 819, 820,
 &end
#
#   74 PHE  QD           79 MET  QE          5.50    (#   2282:25  Unique         2.72, 4.65 A)
 &rst
  ixpk= 2282, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1216,1224,
 igr2=1308,1309,1310,
 &end
#
#   53 PHE  HN           48 MET  QE          4.50    (#   2284:25  Unique         2.39, 3.55 A)
 &rst
  ixpk= 2284, nxpk= 25, iat= 882,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 818, 819, 820,
 &end
#
#    0 AMB  25-3:2286    40 ILE  QG2         2.80    (#   2286:25  Single Ambig)
 &rst
  ixpk= 2286, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1= 670, 407, 408, 676, 677,
 igr2= 672, 673, 674,
 &end
#
#    0 AMB  25-3:2287    40 ILE  QG2         3.50    (#   2287:25  Single Ambig)
 &rst
  ixpk= 2287, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 407, 408, 705, 706, 707,
 igr2= 672, 673, 674,
 &end
#
#   52 ALA  QB           40 ILE  QG2         4.50    (#   2288:25  Unique         3.64, 5.39 A)
 &rst
  ixpk= 2288, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 876, 877, 878,
 igr2= 672, 673, 674,
 &end
#
#   54 VAL  QG-          40 ILE  QG2         4.50    (#   2289:25  Unique         3.10, 5.87 A)
 &rst
  ixpk= 2289, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 908, 909, 910, 912, 913, 914,
 igr2= 672, 673, 674,
 &end
#
#    0 AMB  25-3:2290    40 ILE  QG2         4.50    (#   2290:25  Single Ambig)
 &rst
  ixpk= 2290, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 687, 904,
 igr2= 672, 673, 674,
 &end
#
#   40 ILE  HA           40 ILE  QG2         3.50    (#   2291:25  Unique         2.45, 3.20 A)
 &rst
  ixpk= 2291, nxpk= 25, iat= 668,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 672, 673, 674,
 &end
#
#   41 VAL  HN           40 ILE  QG2         3.50    (#   2292:25  Unique         2.62, 3.34 A)
 &rst
  ixpk= 2292, nxpk= 25, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 672, 673, 674,
 &end
#
#    0 AMB  25-3:2293    40 ILE  QG2         5.50    (#   2293:25  Single Ambig)
 &rst
  ixpk= 2293, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 666, 474,
 igr2= 672, 673, 674,
 &end
#
#   23 LEU  QD2          40 ILE  QG2         4.50    (#   2294:25  Unique         3.79, 5.33 A)
 &rst
  ixpk= 2294, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 394, 395, 396,
 igr2= 672, 673, 674,
 &end
#
#   27 LEU  QD1          40 ILE  QG2         2.80    (#   2295:25  Unique         2.03, 3.34 A)
 &rst
  ixpk= 2295, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 464, 465, 466,
 igr2= 672, 673, 674,
 &end
#
#   24 LYS  HA           40 ILE  QG2         4.50    (#   2296:25  Unique         2.26, 3.54 A)
 &rst
  ixpk= 2296, nxpk= 25, iat= 402,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 672, 673, 674,
 &end
#
#    0 AMB  25-3:2297     0 AMB  25-1:2297   3.50    (#   2297:25  Double Ambig)
 &rst
  ixpk= 2297, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,
 igr2= 715, 716, 715, 716,
 &end
#
#    0 AMB  25-3:2298    43 LEU  HB-         3.50    (#   2298:25  Single Ambig)
 &rst
  ixpk= 2298, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,
 igr2= 715, 716,
 &end
#
#    0 AMB  25-3:2301     0 AMB  25-1:2301   3.50    (#   2301:25  Double Ambig)
 &rst
  ixpk= 2301, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 779, 780, 781, 775, 776, 777,
 igr2= 770, 771, 770, 771,
 &end
#
#    0 AMB  25-3:2302    46 LEU  HB-         3.50    (#   2302:25  Single Ambig)
 &rst
  ixpk= 2302, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 779, 780, 781, 775, 776, 777,
 igr2= 770, 771,
 &end
#
#   46 LEU  HA           46 LEU  HB+         4.50    (#   2303:25  Unique         1.94, 2.69 A)
 &rst
  ixpk= 2303, nxpk= 25, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 770, 771,
 &end
#
#   46 LEU  HA           46 LEU  HB-         4.50    (#   2304:25  Unique         1.94, 2.69 A)
 &rst
  ixpk= 2304, nxpk= 25, iat= 768,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 770, 771,
 &end
#
#   44 LYS  HA           46 LEU  HB-         7.00    (#   2307:25  Unique         6.13, 7.57 A)
 &rst
  ixpk= 2307, nxpk= 25, iat= 732,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 770, 771,
 &end
#
#   45 THR  QG2          45 THR  HB          2.80    (#   2309:25  Unique         2.36, 2.67 A)
 &rst
  ixpk= 2309, nxpk= 25, iat=  -1, 756, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 758, 759, 760,
 &end
#
#   30 ILE  QG2          30 ILE  HB          3.50    (#   2312:25  Unique         2.34, 2.67 A)
 &rst
  ixpk= 2312, nxpk= 25, iat=  -1, 509, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 511, 512, 513,
 &end
#
#   30 ILE  QD1          30 ILE  HB          4.50    (#   2313:25  Unique         2.35, 3.13 A)
 &rst
  ixpk= 2313, nxpk= 25, iat=  -1, 509, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 518, 519, 520,
 &end
#
#   30 ILE  HG1-         30 ILE  HB          4.50    (#   2314:25  Unique         2.45, 2.80 A)
 &rst
  ixpk= 2314, nxpk= 25, iat=  -1, 509, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 515, 516,
 &end
#
#   30 ILE  HG1+         30 ILE  HB          4.50    (#   2315:25  Unique         2.45, 2.80 A)
 &rst
  ixpk= 2315, nxpk= 25, iat=  -1, 509, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 515, 516,
 &end
#
#   30 ILE  HA           30 ILE  HB          5.50    (#   2316:25  Unique         2.41, 2.64 A)
 &rst
  ixpk= 2316, nxpk= 25, iat= 507, 509, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:2317    30 ILE  HB          5.50    (#   2317:25  Single Ambig)
 &rst
  ixpk= 2317, nxpk= 25, iat=  -1, 509, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 567, 568,1216,1224,1184,1188,
 &end
#
#    0 AMB  25-3:2318    30 ILE  HB          4.50    (#   2318:25  Single Ambig)
 &rst
  ixpk= 2318, nxpk= 25, iat=  -1, 509, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 580, 588, 572,
 &end
#
#   31 PHE  HN           30 ILE  HB          5.50    (#   2319:25  Unique         2.35, 3.42 A)
 &rst
  ixpk= 2319, nxpk= 25, iat= 524, 509, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   68 THR  QG2          68 THR  HB          3.50    (#   2320:25  Unique         2.41, 2.67 A)
 &rst
  ixpk= 2320, nxpk= 25, iat=  -1,1123, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1125,1126,1127,
 &end
#
#    8 THR  QG2           8 THR  HB          4.50    (#   2321:25  Unique         2.32, 2.67 A)
 &rst
  ixpk= 2321, nxpk= 25, iat=  -1, 121, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 123, 124, 125,
 &end
#
#   68 THR  HN           68 THR  HB          4.50    (#   2324:25  Unique         2.53, 2.58 A)
 &rst
  ixpk= 2324, nxpk= 25, iat=1119,1123, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:2325     0 AMB  25-1:2325   4.50    (#   2325:25  Double Ambig)
 &rst
  ixpk= 2325, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 102, 368,
 igr2= 107, 108, 373, 374,
 &end
#
#    0 AMB  25-3:2326     0 AMB  25-1:2326   4.50    (#   2326:25  Double Ambig)
 &rst
  ixpk= 2326, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 102, 368,
 igr2= 107, 108, 373, 374,
 &end
#
#   18 ILE  QG2          22 GLU  HG+         5.50    (#   2327:25  Unique         4.04, 5.45 A)
 &rst
  ixpk= 2327, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 294, 295, 296,
 igr2= 373, 374,
 &end
#
#   18 ILE  QG2          22 GLU  HG-         4.50    (#   2328:25  Unique         4.04, 5.45 A)
 &rst
  ixpk= 2328, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 294, 295, 296,
 igr2= 373, 374,
 &end
#
#   22 GLU  HN           22 GLU  HG-         5.50    (#   2331:25  Unique         1.89, 2.96 A)
 &rst
  ixpk= 2331, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 373, 374,
 &end
#
#   22 GLU  HN           22 GLU  HG+         5.50    (#   2332:25  Unique         1.89, 2.96 A)
 &rst
  ixpk= 2332, nxpk= 25, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 373, 374,
 &end
#
#    0 AMB  25-3:2333     0 AMB  25-1:2333   4.50    (#   2333:25  Double Ambig)
 &rst
  ixpk= 2333, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 100, 381,
 igr2= 107, 108, 373, 374,
 &end
#
#    0 AMB  25-3:2334     3 MET  HG-         3.50    (#   2334:25  Single Ambig)
 &rst
  ixpk= 2334, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=  40,  41,  40,  41,
 igr2=  43,  44,
 &end
#
#    0 AMB  25-3:2335     3 MET  HG-         5.50    (#   2335:25  Single Ambig)
 &rst
  ixpk= 2335, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  38,1043,
 igr2=  43,  44,
 &end
#
#   61 SER  HA           61 SER  HB-         5.50    (#   2340:25  Unique         2.35, 2.74 A)
 &rst
  ixpk= 2340, nxpk= 25, iat=1022,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1024,1025,
 &end
#
#   90 ILE  HG1-         90 ILE  HA          5.50    (#   2343:25  Unique         3.52, 3.82 A)
 &rst
  ixpk= 2343, nxpk= 25, iat=  -1,1462, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1470,1471,
 &end
#
#   90 ILE  HN           90 ILE  HA          5.50    (#   2346:25  Unique         2.84, 2.89 A)
 &rst
  ixpk= 2346, nxpk= 25, iat=1460,1462, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:2348    25 LYS  HA          5.50    (#   2348:25  Single Ambig)
 &rst
  ixpk= 2348, nxpk= 25, iat=  -1, 424, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 432, 433, 432, 433,
 &end
#
#   24 LYS  HB-          25 LYS  HA          5.50    (#   2349:25  Unique         3.49, 4.73 A)
 &rst
  ixpk= 2349, nxpk= 25, iat=  -1, 424, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 404, 405,
 &end
#
#    0 AMB  25-3:2350    25 LYS  HA          3.50    (#   2350:25  Single Ambig)
 &rst
  ixpk= 2350, nxpk= 25, iat=  -1, 424, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 426, 427, 426, 427,
 &end
#
#   28 TYR  HB+          25 LYS  HA          4.50    (#   2351:25  Unique         2.68, 3.58 A)
 &rst
  ixpk= 2351, nxpk= 25, iat=  -1, 424, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 478, 479,
 &end
#
#   28 TYR  QD           25 LYS  HA          5.50    (#   2352:25  Unique         2.16, 5.12 A)
 &rst
  ixpk= 2352, nxpk= 25, iat=  -1, 424, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 482, 491,
 &end
#
#   66 LEU  MDX          82 ALA  QB          5.50    (#   2357:25  Unique         4.28, 6.23 A)
 &rst
  ixpk= 2357, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1354,1355,1356,
 &end
#
#    0 AMB  25-3:2360    82 ALA  QB          4.50    (#   2360:25  Single Ambig)
 &rst
  ixpk= 2360, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 154, 155, 154, 155,
 igr2=1354,1355,1356,
 &end
#
#   82 ALA  HA           82 ALA  QB          2.80    (#   2361:25  Unique         2.45, 2.69 A)
 &rst
  ixpk= 2361, nxpk= 25, iat=1352,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1354,1355,1356,
 &end
#
#    0 AMB  25-3:2362    82 ALA  QB          5.50    (#   2362:25  Single Ambig)
 &rst
  ixpk= 2362, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1333, 152,
 igr2=1354,1355,1356,
 &end
#
#    0 AMB  25-3:2363    82 ALA  QB          4.50    (#   2363:25  Single Ambig)
 &rst
  ixpk= 2363, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 158, 167, 160, 165,
 igr2=1354,1355,1356,
 &end
#
#   83 TYR  QD           82 ALA  QB          5.50    (#   2364:25  Unique         3.33, 5.81 A)
 &rst
  ixpk= 2364, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1368,1377,
 igr2=1354,1355,1356,
 &end
#
#   83 TYR  HN           82 ALA  QB          2.80    (#   2365:25  Unique         1.88, 3.12 A)
 &rst
  ixpk= 2365, nxpk= 25, iat=1360,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1354,1355,1356,
 &end
#
#   82 ALA  HN           82 ALA  QB          3.50    (#   2366:25  Unique         2.74, 3.43 A)
 &rst
  ixpk= 2366, nxpk= 25, iat=1350,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1354,1355,1356,
 &end
#
#    0 AMB  25-3:2370    43 LEU  QD-         3.50    (#   2370:25  Single Ambig)
 &rst
  ixpk= 2370, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 758, 759, 760, 705, 706, 707,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#    0 AMB  25-3:2372    43 LEU  QD-         2.80    (#   2372:25  Single Ambig)
 &rst
  ixpk= 2372, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 718, 715, 716,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#    4 LEU  HB-           4 LEU  MDY         2.80    (#   2373:25  Unique         2.33, 3.43 A)
 &rst
  ixpk= 2373, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=  57,  58,
 igr2=  62,  63,  64,  66,  67,  68,
 &end
#
#    0 AMB  25-3:2374     0 AMB  25-1:2374   2.80    (#   2374:25  Double Ambig)
 &rst
  ixpk= 2374, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 718, 715, 716,  60,
 igr2= 720, 721, 722, 724, 725, 726,  62,  63,  64,  66,
        67,  68,
 &end
#
#    0 AMB  25-3:2375    43 LEU  QD-         5.50    (#   2375:25  Single Ambig)
 &rst
  ixpk= 2375, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 811, 812, 811, 812,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#    5 PRO  HG-           4 LEU  MDY         5.50    (#   2376:25  Unique         4.50, 7.36 A)
 &rst
  ixpk= 2376, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  76,  77,
 igr2=  62,  63,  64,  66,  67,  68,
 &end
#
#    0 AMB  25-3:2377     0 AMB  25-1:2377   4.50    (#   2377:25  Double Ambig)
 &rst
  ixpk= 2377, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 339, 340,  79,  80,
 igr2= 720, 721, 722, 724, 725, 726,  62,  63,  64,  66,
        67,  68,
 &end
#
#    5 PRO  HD+           4 LEU  MDY         4.50    (#   2378:25  Unique         2.51, 5.26 A)
 &rst
  ixpk= 2378, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=  73,  74,
 igr2=  62,  63,  64,  66,  67,  68,
 &end
#
#    5 PRO  HD-           4 LEU  MDY         4.50    (#   2379:25  Unique         2.51, 5.26 A)
 &rst
  ixpk= 2379, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=  73,  74,
 igr2=  62,  63,  64,  66,  67,  68,
 &end
#
#   43 LEU  HA           43 LEU  QD-         3.50    (#   2380:25  Unique         2.21, 4.05 A)
 &rst
  ixpk= 2380, nxpk= 25, iat= 713,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#    0 AMB  25-3:2381     0 AMB  25-1:2381   3.50    (#   2381:25  Double Ambig)
 &rst
  ixpk= 2381, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=  55, 713,
 igr2=  62,  63,  64,  66,  67,  68, 720, 721, 722, 724,
       725, 726,
 &end
#
#   45 THR  HB           43 LEU  QD-         5.50    (#   2390:25  Unique         3.04, 5.94 A)
 &rst
  ixpk= 2390, nxpk= 25, iat= 756,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#   53 PHE  QD            8 THR  QG2         4.50    (#   2391:25  Unique         2.34, 5.06 A)
 &rst
  ixpk= 2391, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 890, 898,
 igr2= 123, 124, 125,
 &end
#
#    8 THR  HN            8 THR  QG2         5.50    (#   2393:25  Unique         4.44, 4.69 A)
 &rst
  ixpk= 2393, nxpk= 25, iat= 117,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 123, 124, 125,
 &end
#
#    0 AMB  25-3:2394     0 AMB  25-1:2394   2.80    (#   2394:25  Double Ambig)
 &rst
  ixpk= 2394, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 131, 882,
 igr2= 123, 124, 125, 876, 877, 878,
 &end
#
#    8 THR  HA            8 THR  QG2         4.50    (#   2395:25  Unique         2.36, 3.06 A)
 &rst
  ixpk= 2395, nxpk= 25, iat= 119,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 123, 124, 125,
 &end
#
#   53 PHE  HA            0 AMB  25-1:2396   5.50    (#   2396:25  Single Ambig)
 &rst
  ixpk= 2396, nxpk= 25, iat= 884,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 123, 124, 125, 876, 877, 878,
 &end
#
#    0 AMB  25-3:2397     8 THR  QG2         4.50    (#   2397:25  Single Ambig)
 &rst
  ixpk= 2397, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1385,1386,1385,1386,
 igr2= 123, 124, 125,
 &end
#
#    8 THR  HB            8 THR  QG2         4.50    (#   2398:25  Unique         2.32, 2.67 A)
 &rst
  ixpk= 2398, nxpk= 25, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 123, 124, 125,
 &end
#
#    0 AMB  25-3:2399     8 THR  QG2         4.50    (#   2399:25  Single Ambig)
 &rst
  ixpk= 2399, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 886, 887, 886, 887,
 igr2= 123, 124, 125,
 &end
#
#    0 AMB  25-3:2401    38 LEU  QD-         3.50    (#   2401:25  Single Ambig)
 &rst
  ixpk= 2401, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 642, 639, 640,
 igr2= 644, 645, 646, 648, 649, 650,
 &end
#
#    0 AMB  25-3:2402    38 LEU  QD-         4.50    (#   2402:25  Single Ambig)
 &rst
  ixpk= 2402, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 964, 965, 964, 965, 961, 962,
 igr2= 644, 645, 646, 648, 649, 650,
 &end
#
#    0 AMB  25-3:2403    38 LEU  QD-         5.50    (#   2403:25  Single Ambig)
 &rst
  ixpk= 2403, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1= 967, 968, 967, 968, 922,
 igr2= 644, 645, 646, 648, 649, 650,
 &end
#
#   38 LEU  HA           38 LEU  QD-         4.50    (#   2405:25  Unique         2.24, 3.86 A)
 &rst
  ixpk= 2405, nxpk= 25, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 644, 645, 646, 648, 649, 650,
 &end
#
#    0 AMB  25-3:2408    61 SER  HA          4.50    (#   2408:25  Single Ambig)
 &rst
  ixpk= 2408, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1020,1061,1062,
 &end
#
#    0 AMB  25-3:2413    10 TYR  HA          5.50    (#   2413:25  Single Ambig)
 &rst
  ixpk= 2413, nxpk= 25, iat=  -1, 152, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 154, 155, 154, 155,
 &end
#
#   10 TYR  HA            0 AMB  25-1:2414   5.50    (#   2414:25  Single Ambig)
 &rst
  ixpk= 2414, nxpk= 25, iat= 152,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 154, 155, 154, 155,
 &end
#
#   10 TYR  QD            0 AMB  25-1:2415   5.50    (#   2415:25  Single Ambig)
 &rst
  ixpk= 2415, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 158, 167,
 igr2= 154, 155, 154, 155,
 &end
#
#   82 ALA  QB            0 AMB  25-1:2418   5.50    (#   2418:25  Single Ambig)
 &rst
  ixpk= 2418, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1354,1355,1356,
 igr2= 154, 155, 154, 155,
 &end
#
#   11 ILE  HA           11 ILE  HG1-        5.50    (#   2419:25  Unique         2.37, 2.72 A)
 &rst
  ixpk= 2419, nxpk= 25, iat= 173,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 181, 182,
 &end
#
#   11 ILE  HA           11 ILE  HG1+        5.50    (#   2420:25  Unique         2.37, 2.72 A)
 &rst
  ixpk= 2420, nxpk= 25, iat= 173,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 181, 182,
 &end
#
#   14 LEU  HB-          14 LEU  HA          5.50    (#   2421:25  Unique         2.50, 2.87 A)
 &rst
  ixpk= 2421, nxpk= 25, iat=  -1, 220, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 222, 223,
 &end
#
#   27 LEU  HN           27 LEU  HG          5.50    (#   2422:25  Unique         2.47, 2.66 A)
 &rst
  ixpk= 2422, nxpk= 25, iat= 455, 462, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   30 ILE  QG2          30 ILE  HA          5.50    (#   2423:25  Unique         2.04, 2.91 A)
 &rst
  ixpk= 2423, nxpk= 25, iat=  -1, 507, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 511, 512, 513,
 &end
#
#   30 ILE  HB           30 ILE  HA          5.50    (#   2424:25  Unique         2.41, 2.64 A)
 &rst
  ixpk= 2424, nxpk= 25, iat= 509, 507, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:2425     0 AMB  25-1:2425   5.50    (#   2425:25  Double Ambig)
 &rst
  ixpk= 2425, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 544, 599,
 igr2= 548, 549, 548, 549,
 &end
#
#   34 PHE  HA           32 SER  HB+         7.00    (#   2427:25  Unique         7.37, 7.72 A)
 &rst
  ixpk= 2427, nxpk= 25, iat= 574,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 548, 549,
 &end
#
#   32 SER  HA           32 SER  HB+         5.50    (#   2428:25  Unique         2.34, 2.74 A)
 &rst
  ixpk= 2428, nxpk= 25, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 548, 549,
 &end
#
#   31 PHE  HB-          32 SER  HB+         5.50    (#   2430:25  Unique         4.67, 5.98 A)
 &rst
  ixpk= 2430, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 528, 529,
 igr2= 548, 549,
 &end
#
#    0 AMB  25-3:2431    44 LYS  HA          5.50    (#   2431:25  Single Ambig)
 &rst
  ixpk= 2431, nxpk= 25, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 734, 735, 740, 741, 740, 741, 831, 832, 831, 832,
      
 &end
#
#    0 AMB  25-3:2432    44 LYS  HA          5.50    (#   2432:25  Single Ambig)
 &rst
  ixpk= 2432, nxpk= 25, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 828, 829, 828, 829, 811, 812, 811, 812,
 &end
#
#    0 AMB  25-3:2434    44 LYS  HA          5.50    (#   2434:25  Single Ambig)
 &rst
  ixpk= 2434, nxpk= 25, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 824, 807,
 &end
#
#   45 THR  QG2          45 THR  HA          4.50    (#   2437:25  Unique         2.23, 2.98 A)
 &rst
  ixpk= 2437, nxpk= 25, iat=  -1, 754, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 758, 759, 760,
 &end
#
#   55 ILE  HG1+         55 ILE  HA          5.50    (#   2438:25  Unique         2.15, 3.32 A)
 &rst
  ixpk= 2438, nxpk= 25, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 928, 929,
 &end
#
#    0 AMB  25-3:2439    55 ILE  HA          5.50    (#   2439:25  Single Ambig)
 &rst
  ixpk= 2439, nxpk= 25, iat=  -1, 920, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 107, 108, 658, 659,
 &end
#
#    0 AMB  25-3:2442    48 MET  HA          3.50    (#   2442:25  Single Ambig)
 &rst
  ixpk= 2442, nxpk= 25, iat=  -1, 809, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 824, 807,
 &end
#
#    0 AMB  25-3:2443    48 MET  HA          4.50    (#   2443:25  Single Ambig)
 &rst
  ixpk= 2443, nxpk= 25, iat=  -1, 809, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 859, 860, 859, 860, 862, 863,
 &end
#
#    0 AMB  25-3:2444    48 MET  HA          4.50    (#   2444:25  Single Ambig)
 &rst
  ixpk= 2444, nxpk= 25, iat=  -1, 809, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 811, 812, 811, 812,
 &end
#
#   51 GLN  HN           50 GLY  HA+         7.00    (#   2445:25  Unique         2.59, 3.31 A)
 &rst
  ixpk= 2445, nxpk= 25, iat= 855,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 850, 851,
 &end
#
#   51 GLN  HN           50 GLY  HA-         5.50    (#   2446:25  Unique         2.59, 3.31 A)
 &rst
  ixpk= 2446, nxpk= 25, iat= 855,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 850, 851,
 &end
#
#   52 ALA  QB           52 ALA  HA          3.50    (#   2447:25  Unique         2.35, 2.66 A)
 &rst
  ixpk= 2447, nxpk= 25, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 876, 877, 878,
 &end
#
#   54 VAL  QG+          54 VAL  HA          5.50    (#   2448:25  Unique         2.29, 3.59 A)
 &rst
  ixpk= 2448, nxpk= 25, iat=  -1, 904, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 908, 909, 910, 912, 913, 914,
 &end
#
#   54 VAL  QG-          54 VAL  HA          4.50    (#   2449:25  Unique         2.29, 3.59 A)
 &rst
  ixpk= 2449, nxpk= 25, iat=  -1, 904, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 908, 909, 910, 912, 913, 914,
 &end
#
#   40 ILE  HA           54 VAL  HA          5.50    (#   2450:25  Unique         2.17, 2.25 A)
 &rst
  ixpk= 2450, nxpk= 25, iat= 668, 904, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   55 ILE  HN           54 VAL  HA          4.50    (#   2451:25  Unique         1.84, 2.07 A)
 &rst
  ixpk= 2451, nxpk= 25, iat= 918, 904, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   61 SER  HN           61 SER  HB-         5.50    (#   2452:25  Unique         2.52, 3.10 A)
 &rst
  ixpk= 2452, nxpk= 25, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1024,1025,
 &end
#
#   68 THR  HA           68 THR  HB          4.50    (#   2453:25  Unique         3.04, 3.05 A)
 &rst
  ixpk= 2453, nxpk= 25, iat=1121,1123, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  25-3:2455    68 THR  HB          5.50    (#   2455:25  Single Ambig)
 &rst
  ixpk= 2455, nxpk= 25, iat=  -1,1123, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1099,1100,1137,1138,
 &end
#
#   77 LYS  HN           77 LYS  HA          5.50    (#   2456:25  Unique         2.85, 2.93 A)
 &rst
  ixpk= 2456, nxpk= 25, iat=1261,1263, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   79 MET  HA           79 MET  HB+         5.50    (#   2457:25  Unique         2.44, 2.80 A)
 &rst
  ixpk= 2457, nxpk= 25, iat=1299,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1301,1302,
 &end
#
#   79 MET  HA           79 MET  HB-         5.50    (#   2458:25  Unique         2.44, 2.80 A)
 &rst
  ixpk= 2458, nxpk= 25, iat=1299,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1301,1302,
 &end
#
#   79 MET  HG+          79 MET  HB+         5.50    (#   2459:25  Unique         2.25, 2.64 A)
 &rst
  ixpk= 2459, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1304,1305,
 igr2=1301,1302,
 &end
#
#   94 ILE  QG2          90 ILE  HG1+        5.50    (#   2473:25  Unique         4.95, 6.58 A)
 &rst
  ixpk= 2473, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1533,1534,1535,
 igr2=1470,1471,
 &end
#
#   94 ILE  QG2          90 ILE  HG1-        5.50    (#   2474:25  Unique         4.95, 6.58 A)
 &rst
  ixpk= 2474, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1533,1534,1535,
 igr2=1470,1471,
 &end
#
#   91 VAL  HB           90 ILE  QG2         7.00    (#   2477:25  Unique         6.63, 7.29 A)
 &rst
  ixpk= 2477, nxpk= 25, iat=1483,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=1466,1467,1468,
 &end
#
#   91 VAL  HN           91 VAL  HA          5.50    (#   2480:25  Unique         2.76, 2.80 A)
 &rst
  ixpk= 2480, nxpk= 25, iat=1479,1481, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   57 LYS  HA           38 LEU  QD-         5.50    (#   2481:25  Unique         2.27, 4.25 A)
 &rst
  ixpk= 2481, nxpk= 25, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 644, 645, 646, 648, 649, 650,
 &end
#
#   41 VAL  HA           41 VAL  QG-         4.50    (#   2482:25  Unique         2.17, 3.19 A)
 &rst
  ixpk= 2482, nxpk= 25, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   46 LEU  QD2          47 LYS  HA          4.50    (#   2490:25  Unique         2.89, 4.77 A)
 &rst
  ixpk= 2490, nxpk= 25, iat=  -1, 787, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 779, 780, 781,
 &end
#
#    0 AMB  25-3:2494     7 GLN  HA          5.50    (#   2494:25  Single Ambig)
 &rst
  ixpk= 2494, nxpk= 25, iat=  -1, 102, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 117,1041,
 &end
#
#    0 AMB  25-3:2502    59 ILE  QD1         5.50    (#   2502:25  Single Ambig)
 &rst
  ixpk= 2502, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  90,  91,  90,  91,
 igr2=1007,1008,1009,
 &end
#
#    0 AMB  25-3:2503    59 ILE  QD1         5.50    (#   2503:25  Single Ambig)
 &rst
  ixpk= 2503, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 983, 984, 104, 105,
 igr2=1007,1008,1009,
 &end
#
#   17 LYS  HN           17 LYS  HG-         4.50    (#   2508:25  Unique         2.29, 3.30 A)
 &rst
  ixpk= 2508, nxpk= 25, iat= 266,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 273, 274,
 &end
#
#   77 LYS  HE+          77 LYS  HD-         4.50    (#   2513:25  Unique         2.15, 2.72 A)
 &rst
  ixpk= 2513, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1274,1275,
 igr2=1271,1272,
 &end
#
#    9 ILE  HN            8 THR  HA          4.50    (#   2514:25  Unique         2.12, 2.26 A)
 &rst
  ixpk= 2514, nxpk= 25, iat= 131, 119, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    3 MET  HN            2 GLU  HA          3.50    (#   2515:25  Unique         2.18, 2.54 A)
 &rst
  ixpk= 2515, nxpk= 25, iat=  36,  23, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  25-3:2520     0 AMB  25-1:2520   3.50    (#   2520:25  Double Ambig)
 &rst
  ixpk= 2520, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
 igr1= 642, 639, 640, 222, 223,
 igr2= 644, 645, 646, 648, 649, 650, 644, 645, 646, 648,
       649, 650, 298, 299,
 &end
#
#    0 AMB  25-3:2521     0 AMB  25-1:2521   3.50    (#   2521:25  Double Ambig)
 &rst
  ixpk= 2521, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
 igr1= 639, 640, 273, 274,
 igr2= 644, 645, 646, 648, 649, 650, 298, 299,
 &end
#
#   57 LYS  HA           38 LEU  QD+         4.50    (#   2522:25  Unique         2.27, 4.25 A)
 &rst
  ixpk= 2522, nxpk= 25, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 644, 645, 646, 648, 649, 650,
 &end
#
#    0 AMB  25-3:2523     0 AMB  25-1:2523   5.50    (#   2523:25  Double Ambig)
 &rst
  ixpk= 2523, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 637, 220,
 igr2= 644, 645, 646, 648, 649, 650, 298, 299,
 &end
#
#   15 ASN  HD2+         18 ILE  HG1-        5.50    (#   2524:25  Unique         2.48, 5.63 A)
 &rst
  ixpk= 2524, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 246, 247,
 igr2= 298, 299,
 &end
#
#    7 GLN  HE2+         38 LEU  QD+         5.50    (#   2525:25  Unique         2.55, 4.83 A)
 &rst
  ixpk= 2525, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 112, 113,
 igr2= 644, 645, 646, 648, 649, 650,
 &end
#
#   37 ILE  QG2          37 ILE  HA          5.50    (#   2527:25  Unique         2.26, 3.25 A)
 &rst
  ixpk= 2527, nxpk= 25, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 622, 623, 624,
 &end
#
#   37 ILE  HA           37 ILE  HB          5.50    (#   2528:25  Unique         2.85, 3.03 A)
 &rst
  ixpk= 2528, nxpk= 25, iat= 618, 620, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:2532    40 ILE  QD1         4.50    (#   2532:25  Single Ambig)
 &rst
  ixpk= 2532, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 402, 476,
 igr2= 679, 680, 681,
 &end
#
#   41 VAL  HN           41 VAL  HA          5.50    (#   2533:25  Unique         2.77, 2.95 A)
 &rst
  ixpk= 2533, nxpk= 25, iat= 685, 687, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  25-3:2534    41 VAL  HA          5.50    (#   2534:25  Single Ambig)
 &rst
  ixpk= 2534, nxpk= 25, iat=  -1, 687, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 689, 718, 670, 715, 716,
 &end
#
#    0 AMB  25-3:2535    41 VAL  HA          4.50    (#   2535:25  Single Ambig)
 &rst
  ixpk= 2535, nxpk= 25, iat=  -1, 687, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 691, 692, 693, 695, 696, 697, 672, 673, 674,
 &end
#
#   41 VAL  HN           41 VAL  QG-         5.50    (#   2537:25  Unique         2.26, 4.27 A)
 &rst
  ixpk= 2537, nxpk= 25, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 691, 692, 693, 695, 696, 697,
 &end
#
#   19 LYS  HG-          19 LYS  HA          4.50    (#   2538:25  Unique         2.37, 2.84 A)
 &rst
  ixpk= 2538, nxpk= 25, iat=  -1, 309, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 314, 315,
 &end
#
#    0 AMB  25-3:2539    19 LYS  HA          3.50    (#   2539:25  Single Ambig)
 &rst
  ixpk= 2539, nxpk= 25, iat=  -1, 309, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 317, 318, 317, 318, 311, 312,
 &end
#
#   19 LYS  HB+          19 LYS  HA          4.50    (#   2540:25  Unique         2.51, 2.80 A)
 &rst
  ixpk= 2540, nxpk= 25, iat=  -1, 309, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 311, 312,
 &end
#
#   19 LYS  HN           19 LYS  HA          4.50    (#   2541:25  Unique         2.86, 2.89 A)
 &rst
  ixpk= 2541, nxpk= 25, iat= 307, 309, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 PRO  HD+           4 LEU  HB-         5.50    (#   2545:25  Unique         2.25, 4.01 A)
 &rst
  ixpk= 2545, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  73,  74,
 igr2=  57,  58,
 &end
#
#    5 PRO  HD-           4 LEU  HB+         5.50    (#   2546:25  Unique         2.25, 4.01 A)
 &rst
  ixpk= 2546, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  73,  74,
 igr2=  57,  58,
 &end
#
#    4 LEU  HN            4 LEU  HB-         4.50    (#   2547:25  Unique         2.19, 3.05 A)
 &rst
  ixpk= 2547, nxpk= 25, iat=  53,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  57,  58,
 &end
#
#   49 ARG  HA           49 ARG  HG-         5.50    (#   2549:25  Unique         2.26, 2.69 A)
 &rst
  ixpk= 2549, nxpk= 25, iat= 826,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 831, 832,
 &end
#
#   54 VAL  QG-          54 VAL  HB          5.50    (#   2550:25  Unique         2.18, 2.64 A)
 &rst
  ixpk= 2550, nxpk= 25, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:2551    54 VAL  HB          5.50    (#   2551:25  Single Ambig)
 &rst
  ixpk= 2551, nxpk= 25, iat=  -1, 906, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 902, 131,
 &end
#
#   52 ALA  QB           54 VAL  QG-         5.50    (#   2552:25  Unique         3.17, 6.58 A)
 &rst
  ixpk= 2552, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 876, 877, 878,
 igr2= 908, 909, 910, 912, 913, 914,
 &end
#
#    0 AMB  25-3:2553     0 AMB  25-1:2553   5.50    (#   2553:25  Double Ambig)
 &rst
  ixpk= 2553, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 918, 117,
 igr2= 928, 929, 928, 929,
 &end
#
#   59 ILE  HA           59 ILE  HB          5.50    (#   2554:25  Unique         2.37, 2.42 A)
 &rst
  ixpk= 2554, nxpk= 25, iat= 996, 998, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   61 SER  HN           62 ALA  QB          5.50    (#   2555:25  Unique         4.41, 5.27 A)
 &rst
  ixpk= 2555, nxpk= 25, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1035,1036,1037,
 &end
#
#    0 AMB  25-3:2556     0 AMB  25-1:2556   5.50    (#   2556:25  Double Ambig)
 &rst
  ixpk= 2556, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1041, 117,
 igr2=1043, 920,
 &end
#
#    0 AMB  25-3:2558    84 SER  HB-         4.50    (#   2558:25  Single Ambig)
 &rst
  ixpk= 2558, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1392,1381,
 igr2=1385,1386,
 &end
#
#    0 AMB  25-3:2560    40 ILE  QD1         3.50    (#   2560:25  Single Ambig)
 &rst
  ixpk= 2560, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 622, 623, 624, 464, 465, 466,
 igr2= 679, 680, 681,
 &end
#
#   61 SER  HB+          61 SER  HA          5.50    (#   2561:25  Unique         2.35, 2.74 A)
 &rst
  ixpk= 2561, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1024,1025,
 &end
#
#   61 SER  HB-          61 SER  HA          5.50    (#   2562:25  Unique         2.35, 2.74 A)
 &rst
  ixpk= 2562, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1024,1025,
 &end
#
#    0 AMB  25-3:2563    61 SER  HA          5.50    (#   2563:25  Single Ambig)
 &rst
  ixpk= 2563, nxpk= 25, iat=  -1,1022, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1020,1061,1062,
 &end
#
#    0 AMB  25-3:2568     0 AMB  25-1:2568   3.50    (#   2568:25  Double Ambig)
 &rst
  ixpk= 2568, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 758, 759, 760, 705, 706, 707,
 igr2= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,
 &end
#
#    0 AMB  25-3:2569     0 AMB  25-1:2569   2.80    (#   2569:25  Double Ambig)
 &rst
  ixpk= 2569, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 718, 715, 716,
 igr2= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,
 &end
#
#   48 MET  QE           43 LEU  QD+         4.50    (#   2571:25  Unique         3.72, 7.60 A)
 &rst
  ixpk= 2571, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 818, 819, 820,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#   48 MET  HG-          43 LEU  QD+         5.50    (#   2572:25  Unique         2.22, 5.48 A)
 &rst
  ixpk= 2572, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 814, 815,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#   43 LEU  HA           43 LEU  QD+         5.50    (#   2573:25  Unique         2.21, 4.05 A)
 &rst
  ixpk= 2573, nxpk= 25, iat= 713,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 720, 721, 722, 724, 725, 726,
 &end
#
#   66 LEU  MDY           3 MET  QE          3.50    (#   2576:25  Unique         2.14, 5.10 A)
 &rst
  ixpk= 2576, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=  47,  48,  49,
 &end
#
#   66 LEU  HB+           3 MET  QE          4.50    (#   2578:25  Unique         2.46, 6.15 A)
 &rst
  ixpk= 2578, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1080,1081,
 igr2=  47,  48,  49,
 &end
#
#   67 ARG  HG+           3 MET  QE          3.50    (#   2579:25  Unique         2.23, 4.07 A)
 &rst
  ixpk= 2579, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1102,1103,
 igr2=  47,  48,  49,
 &end
#
#    0 AMB  25-3:2580     3 MET  QE          2.80    (#   2580:25  Single Ambig)
 &rst
  ixpk= 2580, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=  25,  26,1157,1158,
 igr2=  47,  48,  49,
 &end
#
#   70 GLN  HE2-          3 MET  QE          4.50    (#   2587:25  Unique         2.11, 4.02 A)
 &rst
  ixpk= 2587, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1162,1163,
 igr2=  47,  48,  49,
 &end
#
#    0 AMB  25-3:2589    46 LEU  QD2         2.80    (#   2589:25  Single Ambig)
 &rst
  ixpk= 2589, nxpk= 25, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 773, 770, 771,
 igr2= 779, 780, 781,
 &end
#
#   12 ASN  HB-          12 ASN  HA          5.50    (#   2591:25  Unique         2.39, 2.66 A)
 &rst
  ixpk= 2591, nxpk= 25, iat=  -1, 192, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 194, 195,
 &end
#
# 8 THR PHI:  (7 GLN C)-(8 THR N)-(8 THR CA)-(8 THR C) -179.0 -99.0
 &rst     iat =   114,   116,   118,   128,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
   rk2 =   50.0, rk3 =   50.0,    &end

# 9 ILE PHI:  (8 THR C)-(9 ILE N)-(9 ILE CA)-(9 ILE C) -179.0 -99.0
 &rst     iat =   128,   130,   132,   147,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 10 TYR PHI:  (9 ILE C)-(10 TYR N)-(10 TYR CA)-(10 TYR C) -179.0 -99.0
 &rst     iat =   147,   149,   151,   168,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 11 ILE PHI:  (10 TYR C)-(11 ILE N)-(11 ILE CA)-(11 ILE C) -179.0 -99.0
 &rst     iat =   168,   170,   172,   187,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 20 LYS PHI:  (19 LYS C)-(20 LYS N)-(20 LYS CA)-(20 LYS C) -88.0 -28.0
 &rst     iat =   326,   328,   330,   348,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 21 GLU PHI:  (20 LYS C)-(21 GLU N)-(21 GLU CA)-(21 GLU C) -88.0 -28.0
 &rst     iat =   348,   350,   352,   363,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 22 GLU PHI:  (21 GLU C)-(22 GLU N)-(22 GLU CA)-(22 GLU C) -88.0 -28.0
 &rst     iat =   363,   365,   367,   378,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 23 LEU PHI:  (22 GLU C)-(23 LEU N)-(23 LEU CA)-(23 LEU C) -88.0 -28.0
 &rst     iat =   378,   380,   382,   397,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 24 LYS PHI:  (23 LEU C)-(24 LYS N)-(24 LYS CA)-(24 LYS C) -88.0 -28.0
 &rst     iat =   397,   399,   401,   419,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 25 LYS PHI:  (24 LYS C)-(25 LYS N)-(25 LYS CA)-(25 LYS C) -88.0 -28.0
 &rst     iat =   419,   421,   423,   441,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 26 SER PHI:  (25 LYS C)-(26 SER N)-(26 SER CA)-(26 SER C) -88.0 -28.0
 &rst     iat =   441,   443,   445,   452,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 27 LEU PHI:  (26 SER C)-(27 LEU N)-(27 LEU CA)-(27 LEU C) -88.0 -28.0
 &rst     iat =   452,   454,   456,   471,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 28 TYR PHI:  (27 LEU C)-(28 TYR N)-(28 TYR CA)-(28 TYR C) -88.0 -28.0
 &rst     iat =   471,   473,   475,   492,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 29 ALA PHI:  (28 TYR C)-(29 ALA N)-(29 ALA CA)-(29 ALA C) -107.0 -27.0
 &rst     iat =   492,   494,   496,   502,
   r1 = -108.0, r2 = -107.0, r3 = -27.0, r4 = -26.0,
 &end

# 38 LEU PHI:  (37 ILE C)-(38 LEU N)-(38 LEU CA)-(38 LEU C) -179.0 -99.0
 &rst     iat =   632,   634,   636,   651,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 39 ASP PHI:  (38 LEU C)-(39 ASP N)-(39 ASP CA)-(39 ASP C) -179.0 -99.0
 &rst     iat =   651,   653,   655,   663,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 40 ILE PHI:  (39 ASP C)-(40 ILE N)-(40 ILE CA)-(40 ILE C) -179.0 -99.0
 &rst     iat =   663,   665,   667,   682,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 41 VAL PHI:  (40 ILE C)-(41 VAL N)-(41 VAL CA)-(41 VAL C) -179.0 -99.0
 &rst     iat =   682,   684,   686,   698,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 42 ALA PHI:  (41 VAL C)-(42 ALA N)-(42 ALA CA)-(42 ALA C) -179.0 -99.0
 &rst     iat =   698,   700,   702,   708,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 43 LEU PHI:  (42 ALA C)-(43 LEU N)-(43 LEU CA)-(43 LEU C) -179.0 -99.0
 &rst     iat =   708,   710,   712,   727,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 48 MET PHI:  (47 LYS C)-(48 MET N)-(48 MET CA)-(48 MET C) -143.0 -63.0
 &rst     iat =   804,   806,   808,   821,
   r1 = -144.0, r2 = -143.0, r3 = -63.0, r4 = -62.0,
 &end

# 51 GLN PHI:  (50 GLY C)-(51 GLN N)-(51 GLN CA)-(51 GLN C) -179.0 -99.0
 &rst     iat =   852,   854,   856,   869,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 52 ALA PHI:  (51 GLN C)-(52 ALA N)-(52 ALA CA)-(52 ALA C) -179.0 -99.0
 &rst     iat =   869,   871,   873,   879,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 53 PHE PHI:  (52 ALA C)-(53 PHE N)-(53 PHE CA)-(53 PHE C) -179.0 -99.0
 &rst     iat =   879,   881,   883,   899,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 54 VAL PHI:  (53 PHE C)-(54 VAL N)-(54 VAL CA)-(54 VAL C) -179.0 -99.0
 &rst     iat =   899,   901,   903,   915,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 55 ILE PHI:  (54 VAL C)-(55 ILE N)-(55 ILE CA)-(55 ILE C) -179.0 -99.0
 &rst     iat =   915,   917,   919,   934,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 59 ILE PHI:  (58 GLU C)-(59 ILE N)-(59 ILE CA)-(59 ILE C) -88.0 -28.0
 &rst     iat =   991,   993,   995,  1010,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 60 GLY PHI:  (59 ILE C)-(60 GLY N)-(60 GLY CA)-(60 GLY C) -88.0 -28.0
 &rst     iat =  1010,  1012,  1014,  1017,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 61 SER PHI:  (60 GLY C)-(61 SER N)-(61 SER CA)-(61 SER C) -88.0 -28.0
 &rst     iat =  1017,  1019,  1021,  1028,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 62 ALA PHI:  (61 SER C)-(62 ALA N)-(62 ALA CA)-(62 ALA C) -88.0 -28.0
 &rst     iat =  1028,  1030,  1032,  1038,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 63 SER PHI:  (62 ALA C)-(63 SER N)-(63 SER CA)-(63 SER C) -88.0 -28.0
 &rst     iat =  1038,  1040,  1042,  1049,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 64 ASN PHI:  (63 SER C)-(64 ASN N)-(64 ASN CA)-(64 ASN C) -88.0 -28.0
 &rst     iat =  1049,  1051,  1053,  1063,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 65 ALA PHI:  (64 ASN C)-(65 ALA N)-(65 ALA CA)-(65 ALA C) -88.0 -28.0
 &rst     iat =  1063,  1065,  1067,  1073,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 66 LEU PHI:  (65 ALA C)-(66 LEU N)-(66 LEU CA)-(66 LEU C) -88.0 -28.0
 &rst     iat =  1073,  1075,  1077,  1092,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 67 ARG PHI:  (66 LEU C)-(67 ARG N)-(67 ARG CA)-(67 ARG C) -88.0 -28.0
 &rst     iat =  1092,  1094,  1096,  1116,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 68 THR PHI:  (67 ARG C)-(68 THR N)-(68 THR CA)-(68 THR C) -88.0 -28.0
 &rst     iat =  1116,  1118,  1120,  1130,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 80 GLN PHI:  (79 MET C)-(80 GLN N)-(80 GLN CA)-(80 GLN C) -179.0 -99.0
 &rst     iat =  1311,  1313,  1315,  1328,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 81 ILE PHI:  (80 GLN C)-(81 ILE N)-(81 ILE CA)-(81 ILE C) -179.0 -99.0
 &rst     iat =  1328,  1330,  1332,  1347,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 82 ALA PHI:  (81 ILE C)-(82 ALA N)-(82 ALA CA)-(82 ALA C) -179.0 -99.0
 &rst     iat =  1347,  1349,  1351,  1357,
   r1 = -180.0, r2 = -179.0, r3 = -99.0, r4 = -98.0,
 &end

# 90 ILE PHI:  (89 ASP C)-(90 ILE N)-(90 ILE CA)-(90 ILE C) -88.0 -28.0
 &rst     iat =  1457,  1459,  1461,  1476,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 91 VAL PHI:  (90 ILE C)-(91 VAL N)-(91 VAL CA)-(91 VAL C) -88.0 -28.0
 &rst     iat =  1476,  1478,  1480,  1492,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 92 ALA PHI:  (91 VAL C)-(92 ALA N)-(92 ALA CA)-(92 ALA C) -88.0 -28.0
 &rst     iat =  1492,  1494,  1496,  1502,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 93 LYS PHI:  (92 ALA C)-(93 LYS N)-(93 LYS CA)-(93 LYS C) -88.0 -28.0
 &rst     iat =  1502,  1504,  1506,  1524,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 94 ILE PHI:  (93 LYS C)-(94 ILE N)-(94 ILE CA)-(94 ILE C) -88.0 -28.0
 &rst     iat =  1524,  1526,  1528,  1543,
   r1 = -89.0, r2 = -88.0, r3 = -28.0, r4 = -27.0,
 &end

# 8 THR PSI:  (8 THR N)-(8 THR CA)-(8 THR C)-(9 ILE N)  95.0 175.0
 &rst     iat =   116,   118,   128,   130,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 9 ILE PSI:  (9 ILE N)-(9 ILE CA)-(9 ILE C)-(10 TYR N)  95.0 175.0
 &rst     iat =   130,   132,   147,   149,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 10 TYR PSI:  (10 TYR N)-(10 TYR CA)-(10 TYR C)-(11 ILE N)  95.0 175.0
 &rst     iat =   149,   151,   168,   170,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 11 ILE PSI:  (11 ILE N)-(11 ILE CA)-(11 ILE C)-(12 ASN N)  95.0 175.0
 &rst     iat =   170,   172,   187,   189,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 20 LYS PSI:  (20 LYS N)-(20 LYS CA)-(20 LYS C)-(21 GLU N) -77.0 -17.0
 &rst     iat =   328,   330,   348,   350,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 21 GLU PSI:  (21 GLU N)-(21 GLU CA)-(21 GLU C)-(22 GLU N) -77.0 -17.0
 &rst     iat =   350,   352,   363,   365,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 22 GLU PSI:  (22 GLU N)-(22 GLU CA)-(22 GLU C)-(23 LEU N) -77.0 -17.0
 &rst     iat =   365,   367,   378,   380,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 23 LEU PSI:  (23 LEU N)-(23 LEU CA)-(23 LEU C)-(24 LYS N) -77.0 -17.0
 &rst     iat =   380,   382,   397,   399,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 24 LYS PSI:  (24 LYS N)-(24 LYS CA)-(24 LYS C)-(25 LYS N) -77.0 -17.0
 &rst     iat =   399,   401,   419,   421,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 25 LYS PSI:  (25 LYS N)-(25 LYS CA)-(25 LYS C)-(26 SER N) -77.0 -17.0
 &rst     iat =   421,   423,   441,   443,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 26 SER PSI:  (26 SER N)-(26 SER CA)-(26 SER C)-(27 LEU N) -77.0 -17.0
 &rst     iat =   443,   445,   452,   454,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 27 LEU PSI:  (27 LEU N)-(27 LEU CA)-(27 LEU C)-(28 TYR N) -77.0 -17.0
 &rst     iat =   454,   456,   471,   473,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 28 TYR PSI:  (28 TYR N)-(28 TYR CA)-(28 TYR C)-(29 ALA N) -77.0 -17.0
 &rst     iat =   473,   475,   492,   494,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 29 ALA PSI:  (29 ALA N)-(29 ALA CA)-(29 ALA C)-(30 ILE N) -58.0  38.0
 &rst     iat =   494,   496,   502,   504,
   r1 = -59.0, r2 = -58.0, r3 =  38.0, r4 =  39.0,
 &end

# 37 ILE PSI:  (37 ILE N)-(37 ILE CA)-(37 ILE C)-(38 LEU N)  95.0 175.0
 &rst     iat =   615,   617,   632,   634,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 39 ASP PSI:  (39 ASP N)-(39 ASP CA)-(39 ASP C)-(40 ILE N)  95.0 175.0
 &rst     iat =   653,   655,   663,   665,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 40 ILE PSI:  (40 ILE N)-(40 ILE CA)-(40 ILE C)-(41 VAL N)  95.0 175.0
 &rst     iat =   665,   667,   682,   684,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 41 VAL PSI:  (41 VAL N)-(41 VAL CA)-(41 VAL C)-(42 ALA N)  95.0 175.0
 &rst     iat =   684,   686,   698,   700,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 42 ALA PSI:  (42 ALA N)-(42 ALA CA)-(42 ALA C)-(43 LEU N)  95.0 175.0
 &rst     iat =   700,   702,   708,   710,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 43 LEU PSI:  (43 LEU N)-(43 LEU CA)-(43 LEU C)-(44 LYS N)  95.0 175.0
 &rst     iat =   710,   712,   727,   729,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 51 GLN PSI:  (51 GLN N)-(51 GLN CA)-(51 GLN C)-(52 ALA N)  95.0 175.0
 &rst     iat =   854,   856,   869,   871,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 52 ALA PSI:  (52 ALA N)-(52 ALA CA)-(52 ALA C)-(53 PHE N)  95.0 175.0
 &rst     iat =   871,   873,   879,   881,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 53 PHE PSI:  (53 PHE N)-(53 PHE CA)-(53 PHE C)-(54 VAL N)  95.0 175.0
 &rst     iat =   881,   883,   899,   901,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 54 VAL PSI:  (54 VAL N)-(54 VAL CA)-(54 VAL C)-(55 ILE N)  95.0 175.0
 &rst     iat =   901,   903,   915,   917,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 55 ILE PSI:  (55 ILE N)-(55 ILE CA)-(55 ILE C)-(56 PHE N)  95.0 175.0
 &rst     iat =   917,   919,   934,   936,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 56 PHE PSI:  (56 PHE N)-(56 PHE CA)-(56 PHE C)-(57 LYS N)  95.0 175.0
 &rst     iat =   936,   938,   954,   956,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 59 ILE PSI:  (59 ILE N)-(59 ILE CA)-(59 ILE C)-(60 GLY N) -77.0 -17.0
 &rst     iat =   993,   995,  1010,  1012,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 60 GLY PSI:  (60 GLY N)-(60 GLY CA)-(60 GLY C)-(61 SER N) -77.0 -17.0
 &rst     iat =  1012,  1014,  1017,  1019,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 61 SER PSI:  (61 SER N)-(61 SER CA)-(61 SER C)-(62 ALA N) -77.0 -17.0
 &rst     iat =  1019,  1021,  1028,  1030,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 62 ALA PSI:  (62 ALA N)-(62 ALA CA)-(62 ALA C)-(63 SER N) -77.0 -17.0
 &rst     iat =  1030,  1032,  1038,  1040,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 63 SER PSI:  (63 SER N)-(63 SER CA)-(63 SER C)-(64 ASN N) -77.0 -17.0
 &rst     iat =  1040,  1042,  1049,  1051,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 64 ASN PSI:  (64 ASN N)-(64 ASN CA)-(64 ASN C)-(65 ALA N) -77.0 -17.0
 &rst     iat =  1051,  1053,  1063,  1065,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 65 ALA PSI:  (65 ALA N)-(65 ALA CA)-(65 ALA C)-(66 LEU N) -77.0 -17.0
 &rst     iat =  1065,  1067,  1073,  1075,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 66 LEU PSI:  (66 LEU N)-(66 LEU CA)-(66 LEU C)-(67 ARG N) -77.0 -17.0
 &rst     iat =  1075,  1077,  1092,  1094,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 67 ARG PSI:  (67 ARG N)-(67 ARG CA)-(67 ARG C)-(68 THR N) -77.0 -17.0
 &rst     iat =  1094,  1096,  1116,  1118,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 68 THR PSI:  (68 THR N)-(68 THR CA)-(68 THR C)-(69 MET N) -77.0 -17.0
 &rst     iat =  1118,  1120,  1130,  1132,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 80 GLN PSI:  (80 GLN N)-(80 GLN CA)-(80 GLN C)-(81 ILE N)  95.0 175.0
 &rst     iat =  1313,  1315,  1328,  1330,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 81 ILE PSI:  (81 ILE N)-(81 ILE CA)-(81 ILE C)-(82 ALA N)  95.0 175.0
 &rst     iat =  1330,  1332,  1347,  1349,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 82 ALA PSI:  (82 ALA N)-(82 ALA CA)-(82 ALA C)-(83 TYR N)  95.0 175.0
 &rst     iat =  1349,  1351,  1357,  1359,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 83 TYR PSI:  (83 TYR N)-(83 TYR CA)-(83 TYR C)-(84 SER N)  95.0 175.0
 &rst     iat =  1359,  1361,  1378,  1380,
   r1 =  94.0, r2 =  95.0, r3 = 175.0, r4 = 176.0,
 &end

# 90 ILE PSI:  (90 ILE N)-(90 ILE CA)-(90 ILE C)-(91 VAL N) -77.0 -17.0
 &rst     iat =  1459,  1461,  1476,  1478,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 91 VAL PSI:  (91 VAL N)-(91 VAL CA)-(91 VAL C)-(92 ALA N) -77.0 -17.0
 &rst     iat =  1478,  1480,  1492,  1494,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 92 ALA PSI:  (92 ALA N)-(92 ALA CA)-(92 ALA C)-(93 LYS N) -77.0 -17.0
 &rst     iat =  1494,  1496,  1502,  1504,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 93 LYS PSI:  (93 LYS N)-(93 LYS CA)-(93 LYS C)-(94 ILE N) -77.0 -17.0
 &rst     iat =  1504,  1506,  1524,  1526,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 94 ILE PSI:  (94 ILE N)-(94 ILE CA)-(94 ILE C)-(95 LYS N) -77.0 -17.0
 &rst     iat =  1526,  1528,  1543,  1545,
   r1 = -78.0, r2 = -77.0, r3 = -17.0, r4 = -16.0,
 &end

# 9 ILE CHI1:  (9 ILE N)-(9 ILE CA)-(9 ILE CB)-(9 ILE CG1)  30.0  90.0
 &rst     iat =   130,   132,   134,   140,
   r1 =  29.0, r2 =  30.0, r3 =  90.0, r4 =  91.0,
 &end

# 11 ILE CHI1:  (11 ILE N)-(11 ILE CA)-(11 ILE CB)-(11 ILE CG1) -90.0 -30.0
 &rst     iat =   170,   172,   174,   180,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 22 GLU CHI1:  (22 GLU N)-(22 GLU CA)-(22 GLU CB)-(22 GLU CG) -90.0 -30.0
 &rst     iat =   365,   367,   369,   372,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 27 LEU CHI1:  (27 LEU N)-(27 LEU CA)-(27 LEU CB)-(27 LEU CG) -90.0 -30.0
 &rst     iat =   454,   456,   458,   461,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 31 PHE CHI1:  (31 PHE N)-(31 PHE CA)-(31 PHE CB)-(31 PHE CG) -90.0 -30.0
 &rst     iat =   523,   525,   527,   530,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 37 ILE CHI1:  (37 ILE N)-(37 ILE CA)-(37 ILE CB)-(37 ILE CG1) -90.0 -30.0
 &rst     iat =   615,   617,   619,   625,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 38 LEU CHI1:  (38 LEU N)-(38 LEU CA)-(38 LEU CB)-(38 LEU CG) 150.0 210.0
 &rst     iat =   634,   636,   638,   641,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 39 ASP CHI1:  (39 ASP N)-(39 ASP CA)-(39 ASP CB)-(39 ASP CG) 150.0 210.0
 &rst     iat =   653,   655,   657,   660,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 40 ILE CHI1:  (40 ILE N)-(40 ILE CA)-(40 ILE CB)-(40 ILE CG1) -90.0 -30.0
 &rst     iat =   665,   667,   669,   675,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 41 VAL CHI1:  (41 VAL N)-(41 VAL CA)-(41 VAL CB)-(41 VAL CG1) 150.0 210.0
 &rst     iat =   684,   686,   688,   690,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 55 ILE CHI1:  (55 ILE N)-(55 ILE CA)-(55 ILE CB)-(55 ILE CG1) -90.0 -30.0
 &rst     iat =   917,   919,   921,   927,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 61 SER CHI1:  (61 SER N)-(61 SER CA)-(61 SER CB)-(61 SER OG) -90.0 -30.0
 &rst     iat =  1019,  1021,  1023,  1026,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 64 ASN CHI1:  (64 ASN N)-(64 ASN CA)-(64 ASN CB)-(64 ASN CG) 150.0 210.0
 &rst     iat =  1051,  1053,  1055,  1058,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 66 LEU CHI1:  (66 LEU N)-(66 LEU CA)-(66 LEU CB)-(66 LEU CG) 150.0 210.0
 &rst     iat =  1075,  1077,  1079,  1082,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 68 THR CHI1:  (68 THR N)-(68 THR CA)-(68 THR CB)-(68 THR OG1) -90.0 -30.0
 &rst     iat =  1118,  1120,  1122,  1128,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 69 MET CHI1:  (69 MET N)-(69 MET CA)-(69 MET CB)-(69 MET CG) -90.0 -30.0
 &rst     iat =  1132,  1134,  1136,  1139,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 74 PHE CHI1:  (74 PHE N)-(74 PHE CA)-(74 PHE CB)-(74 PHE CG) 150.0 210.0
 &rst     iat =  1207,  1209,  1211,  1214,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 81 ILE CHI1:  (81 ILE N)-(81 ILE CA)-(81 ILE CB)-(81 ILE CG1) -90.0 -30.0
 &rst     iat =  1330,  1332,  1334,  1340,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 88 SER CHI1:  (88 SER N)-(88 SER CA)-(88 SER CB)-(88 SER OG) -90.0 -30.0
 &rst     iat =  1436,  1438,  1440,  1443,
   r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0,
 &end

# 89 ASP CHI1:  (89 ASP N)-(89 ASP CA)-(89 ASP CB)-(89 ASP CG) 150.0 210.0
 &rst     iat =  1447,  1449,  1451,  1454,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 91 VAL CHI1:  (91 VAL N)-(91 VAL CA)-(91 VAL CB)-(91 VAL CG1) 150.0 210.0
 &rst     iat =  1478,  1480,  1482,  1484,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 91 VAL CHI1:  (91 VAL N)-(91 VAL CA)-(91 VAL CB)-(91 VAL CG1) 150.0 210.0
 &rst     iat =  1478,  1480,  1482,  1484,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end

# 91 VAL CHI1:  (91 VAL N)-(91 VAL CA)-(91 VAL CB)-(91 VAL CG1) 150.0 210.0
 &rst     iat =  1478,  1480,  1482,  1484,
   r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
 &end
#
#
# 11 ILE N 52 ALA O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 880, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, 
      rk2=40.0, rk3=40.0, ir6=1, ialtd=0,
 &end
#
#  9 ILE N 54 VAL O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 130, 916, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 12 ASN N 80 GLN O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 189,1329, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 10 TYR N 82 ALA O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 149,1358, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 39 ASP- N 55 ILE O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 653, 935, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 41 VAL N 53 PHE O     3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 684, 900, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 25 LYS+ N 21 GLU- O     3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 421, 364, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 26 SER N 22 GLU- O     3.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 443, 379, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 27 LEU N 23 LEU O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 454, 398, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 28 TYR N 24 LYS+ O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 473, 420, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 29 ALA N 25 LYS+ O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 494, 442, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 30 ILE N 26 SER O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat= 504, 453, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 63 SER N 59 ILE O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1040,1011, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 64 ASN N 60 GLY O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1051,1018, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 65 ALA N 61 SER O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1065,1029, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 66 LEU N 62 ALA O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1075,1039, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 67 ARG+ N 63 SER O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1094,1050, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 68 THR N 64 ASN O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1118,1064, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 69 MET N 65 ALA O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1132,1074, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 93 LYS+ N 89 ASP- O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1504,1458, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 94 ILE N 90 ILE O     3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1526,1477, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 95 LYS+ N 91 VAL O    3.00
 &rst
  ixpk= 0, nxpk= 0, iat=1545,1493, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 11 ILE HN 52 ALA O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 171, 880, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#  9 ILE HN 54 VAL O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 131, 916, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 12 ASN HN 80 GLN O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 190,1329, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 10 TYR HN 82 ALA O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 150,1358, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 39 ASP- HN 55 ILE O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 935, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 41 VAL HN 53 PHE O     2.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 685, 900, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 25 LYS+ HN 21 GLU- O     2.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 422, 364, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 26 SER HN 22 GLU- O     2.00 
 &rst
  ixpk= 0, nxpk= 0, iat= 444, 379, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 27 LEU HN 23 LEU O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 455, 398, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 28 TYR HN 24 LYS+ O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 474, 420, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 29 ALA HN 25 LYS+ O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 495, 442, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 30 ILE HN 26 SER O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 453, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 63 SER HN 59 ILE O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1041,1011, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 64 ASN HN 60 GLY O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1052,1018, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 65 ALA HN 61 SER O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1066,1029, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 66 LEU HN 62 ALA O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1076,1039, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 67 ARG+ HN 63 SER O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1095,1050, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 68 THR HN 64 ASN O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1119,1064, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 69 MET HN 65 ALA O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1133,1074, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 93 LYS+ HN 89 ASP- O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1505,1458, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 94 ILE HN 90 ILE O     2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1527,1477, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 95 LYS+ HN 91 VAL O    2.00
 &rst
  ixpk= 0, nxpk= 0, iat=1546,1493, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
#   70 GLN  HE2+         81 ILE  HN          4.50    (#      0:10  Unique         2.13, 3.52 A)
 &rst
  ixpk= 0, nxpk= 10, iat=  -1,1331, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr1=1162,1163,
 &end
#
#   80 GLN  HA           81 ILE  HN          2.80    (#      1:10  Unique         2.17, 2.26 A)
 &rst
  ixpk= 1, nxpk= 10, iat=1316,1331, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:2       81 ILE  HN          5.50    (#      2:10  Single Ambig)
 &rst
  ixpk= 2, nxpk= 10, iat=  -1,1331, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1321,1322,1321,1322,
 &end
#
#   81 ILE  HB           81 ILE  HN          3.50    (#      3:10  Unique         2.78, 2.93 A)
 &rst
  ixpk= 3, nxpk= 10, iat=1335,1331, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   39 ASP  HN           38 LEU  HN          3.50    (#      4:10  Unique         1.90, 2.00 A)
 &rst
  ixpk= 4, nxpk= 10, iat= 654, 635, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   38 LEU  HA           38 LEU  HN          4.50    (#      5:10  Unique         2.79, 2.95 A)
 &rst
  ixpk= 5, nxpk= 10, iat= 637, 635, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   37 ILE  HA           38 LEU  HN          3.50    (#      6:10  Unique         2.04, 2.23 A)
 &rst
  ixpk= 6, nxpk= 10, iat= 618, 635, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   38 LEU  HB+          38 LEU  HN          3.50    (#      7:10  Unique         2.10, 2.77 A)
 &rst
  ixpk= 7, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 639, 640,
 &end
#
#   38 LEU  HB-          38 LEU  HN          3.50    (#      8:10  Unique         2.10, 2.77 A)
 &rst
  ixpk= 8, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 639, 640,
 &end
#
#    0 AMB  10-2:9       38 LEU  HN          3.50    (#      9:10  Single Ambig)
 &rst
  ixpk= 9, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 924, 925, 926, 644, 645, 646, 648, 649, 650,
 &end
#
#   37 ILE  QG2          38 LEU  HN          3.50    (#     10:10  Unique         2.42, 3.19 A)
 &rst
  ixpk= 10, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 622, 623, 624,
 &end
#
#    0 AMB  10-2:11      81 ILE  HN          4.50    (#     11:10  Single Ambig)
 &rst
  ixpk= 11, nxpk= 10, iat=  -1,1331, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1344,1345,1346, 181, 182,
 &end
#
#   82 ALA  HN           10 TYR  HN          4.50    (#     12:10  Unique         2.66, 2.87 A)
 &rst
  ixpk= 12, nxpk= 10, iat=1350, 150, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:14      10 TYR  HN          2.80    (#     14:10  Single Ambig)
 &rst
  ixpk= 14, nxpk= 10, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 154, 155, 154, 155,
 &end
#
#    9 ILE  HB           10 TYR  HN          3.50    (#     15:10  Unique         2.17, 2.50 A)
 &rst
  ixpk= 15, nxpk= 10, iat= 135, 150, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:16      10 TYR  HN          3.50    (#     16:10  Single Ambig)
 &rst
  ixpk= 16, nxpk= 10, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 137, 138, 139, 181, 182,
 &end
#
#    9 ILE  HA           10 TYR  HN          2.80    (#     17:10  Unique         2.04, 2.31 A)
 &rst
  ixpk= 17, nxpk= 10, iat= 133, 150, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:18      10 TYR  HN          5.50    (#     18:10  Single Ambig)
 &rst
  ixpk= 18, nxpk= 10, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 158, 167, 160, 165,
 &end
#
#   22 GLU  HN           21 GLU  HN          5.50    (#     19:10  Unique         2.73, 2.82 A)
 &rst
  ixpk= 19, nxpk= 10, iat= 366, 351, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   21 GLU  HA           21 GLU  HN          3.50    (#     21:10  Unique         2.79, 2.83 A)
 &rst
  ixpk= 21, nxpk= 10, iat= 353, 351, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:22      21 GLU  HN          2.80    (#     22:10  Single Ambig)
 &rst
  ixpk= 22, nxpk= 10, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 355, 356, 355, 356, 311, 312,
 &end
#
#    0 AMB  10-2:23      21 GLU  HN          4.50    (#     23:10  Single Ambig)
 &rst
  ixpk= 23, nxpk= 10, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 333, 334, 311, 312,
 &end
#
#   21 GLU  HG+          21 GLU  HN          5.50    (#     24:10  Unique         4.22, 4.41 A)
 &rst
  ixpk= 24, nxpk= 10, iat=  -1, 351, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 358, 359,
 &end
#
#   14 LEU  HG           15 ASN  HN          5.50    (#     25:10  Unique         3.27, 3.78 A)
 &rst
  ixpk= 25, nxpk= 10, iat= 225, 237, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   14 LEU  HB-          15 ASN  HN          5.50    (#     26:10  Unique         2.59, 3.72 A)
 &rst
  ixpk= 26, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 222, 223,
 &end
#
#   15 ASN  HB+          15 ASN  HN          3.50    (#     27:10  Unique         2.25, 2.65 A)
 &rst
  ixpk= 27, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 241, 242,
 &end
#
#   15 ASN  HB-          15 ASN  HN          3.50    (#     28:10  Unique         2.25, 2.65 A)
 &rst
  ixpk= 28, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 241, 242,
 &end
#
#   15 ASN  HA           15 ASN  HN          3.50    (#     29:10  Unique         2.85, 2.93 A)
 &rst
  ixpk= 29, nxpk= 10, iat= 239, 237, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   14 LEU  HA           15 ASN  HN          2.80    (#     30:10  Unique         2.05, 2.37 A)
 &rst
  ixpk= 30, nxpk= 10, iat= 220, 237, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:31      15 ASN  HN          5.50    (#     31:10  Single Ambig)
 &rst
  ixpk= 31, nxpk= 10, iat=  -1, 237, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 279, 280, 279, 280,
 &end
#
#   16 GLU  HB+          16 GLU  HN          3.50    (#     32:10  Unique         2.28, 2.98 A)
 &rst
  ixpk= 32, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 255, 256,
 &end
#
#    0 AMB  10-2:33      16 GLU  HN          3.50    (#     33:10  Single Ambig)
 &rst
  ixpk= 33, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 258, 259, 255, 256,
 &end
#
#   16 GLU  HG+          16 GLU  HN          4.50    (#     34:10  Unique         2.08, 3.20 A)
 &rst
  ixpk= 34, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 258, 259,
 &end
#
#    0 AMB  10-2:35      16 GLU  HN          4.50    (#     35:10  Single Ambig)
 &rst
  ixpk= 35, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 253, 850, 851,
 &end
#
#   15 ASN  HA           16 GLU  HN          2.80    (#     36:10  Unique         1.85, 2.10 A)
 &rst
  ixpk= 36, nxpk= 10, iat= 239, 251, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:37      16 GLU  HN          5.50    (#     37:10  Single Ambig)
 &rst
  ixpk= 37, nxpk= 10, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 220, 826,
 &end
#
#   17 LYS  HN           16 GLU  HN          4.50    (#     38:10  Unique         3.03, 3.29 A)
 &rst
  ixpk= 38, nxpk= 10, iat= 266, 251, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   75 TYR  HA           75 TYR  HN          4.50    (#     39:10  Unique         2.80, 2.91 A)
 &rst
  ixpk= 39, nxpk= 10, iat=1230,1228, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:40      75 TYR  HN          3.50    (#     40:10  Single Ambig)
 &rst
  ixpk= 40, nxpk= 10, iat=  -1,1228, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1210,1293,
 &end
#
#    0 AMB  10-2:41      75 TYR  HN          5.50    (#     41:10  Single Ambig)
 &rst
  ixpk= 41, nxpk= 10, iat=  -1,1228, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1308,1309,1310,1290,1291,
 &end
#
#   77 LYS  HB-          75 TYR  HN          5.50    (#     42:10  Unique         2.89, 4.87 A)
 &rst
  ixpk= 42, nxpk= 10, iat=  -1,1228, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1265,1266,
 &end
#
#   79 MET  HB+          75 TYR  HN          7.00    (#     43:10  Unique         6.27, 7.11 A)
 &rst
  ixpk= 43, nxpk= 10, iat=  -1,1228, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1301,1302,
 &end
#
#   49 ARG  HA           50 GLY  HN          4.50    (#     44:10  Unique         3.47, 3.57 A)
 &rst
  ixpk= 44, nxpk= 10, iat= 826, 848, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   50 GLY  HA+          50 GLY  HN          4.50    (#     46:10  Unique         2.07, 2.68 A)
 &rst
  ixpk= 46, nxpk= 10, iat=  -1, 848, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 850, 851,
 &end
#
#    0 AMB  10-2:47      82 ALA  HN          3.50    (#     47:10  Single Ambig)
 &rst
  ixpk= 47, nxpk= 10, iat=  -1,1350, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1352, 173,
 &end
#
#   81 ILE  HA           82 ALA  HN          2.80    (#     48:10  Unique         1.95, 2.26 A)
 &rst
  ixpk= 48, nxpk= 10, iat=1333,1350, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   82 ALA  QB           82 ALA  HN          3.50    (#     49:10  Unique         2.74, 3.43 A)
 &rst
  ixpk= 49, nxpk= 10, iat=  -1,1350, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1354,1355,1356,
 &end
#
#   81 ILE  QG2          82 ALA  HN          3.50    (#     50:10  Unique         1.83, 2.94 A)
 &rst
  ixpk= 50, nxpk= 10, iat=  -1,1350, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1337,1338,1339,
 &end
#
#    0 AMB  10-2:51      82 ALA  HN          4.50    (#     51:10  Single Ambig)
 &rst
  ixpk= 51, nxpk= 10, iat=  -1,1350, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1344,1345,1346, 137, 138, 139,
 &end
#
#   10 TYR  HN           82 ALA  HN          4.50    (#     52:10  Unique         2.66, 2.87 A)
 &rst
  ixpk= 52, nxpk= 10, iat= 150,1350, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:53      27 LEU  HN          3.50    (#     53:10  Single Ambig)
 &rst
  ixpk= 53, nxpk= 10, iat=  -1, 455, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 464, 465, 466, 468, 469, 470,
 &end
#
#   27 LEU  HB-          27 LEU  HN          5.50    (#     54:10  Unique         2.22, 2.94 A)
 &rst
  ixpk= 54, nxpk= 10, iat=  -1, 455, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 459, 460,
 &end
#
#   27 LEU  HG           27 LEU  HN          3.50    (#     55:10  Unique         2.47, 2.66 A)
 &rst
  ixpk= 55, nxpk= 10, iat= 462, 455, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   27 LEU  HB+          27 LEU  HN          3.50    (#     56:10  Unique         2.22, 2.94 A)
 &rst
  ixpk= 56, nxpk= 10, iat=  -1, 455, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 459, 460,
 &end
#
#    0 AMB  10-2:57      27 LEU  HN          5.50    (#     57:10  Single Ambig)
 &rst
  ixpk= 57, nxpk= 10, iat=  -1, 455, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 402, 476,
 &end
#
#    0 AMB  10-2:58      27 LEU  HN          4.50    (#     58:10  Single Ambig)
 &rst
  ixpk= 58, nxpk= 10, iat=  -1, 455, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 457, 424,
 &end
#
#   26 SER  HA           27 LEU  HN          3.50    (#     59:10  Unique         3.56, 3.58 A)
 &rst
  ixpk= 59, nxpk= 10, iat= 446, 455, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   26 SER  HN           27 LEU  HN          3.50    (#     60:10  Unique         2.53, 2.77 A)
 &rst
  ixpk= 60, nxpk= 10, iat= 444, 455, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   19 LYS  HA           20 LYS  HN          3.50    (#     62:10  Unique         2.00, 2.36 A)
 &rst
  ixpk= 62, nxpk= 10, iat= 309, 329, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:63      20 LYS  HN          4.50    (#     63:10  Single Ambig)
 &rst
  ixpk= 63, nxpk= 10, iat=  -1, 329, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 311, 312, 333, 334,
 &end
#
#   19 LYS  HG-          20 LYS  HN          4.50    (#     64:10  Unique         2.20, 3.00 A)
 &rst
  ixpk= 64, nxpk= 10, iat=  -1, 329, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 314, 315,
 &end
#
#   20 LYS  HB+          20 LYS  HN          5.50    (#     65:10  Unique         2.25, 2.55 A)
 &rst
  ixpk= 65, nxpk= 10, iat=  -1, 329, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 333, 334,
 &end
#
#   37 ILE  QD1          37 ILE  HN          5.50    (#     66:10  Unique         2.88, 4.17 A)
 &rst
  ixpk= 66, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 629, 630, 631,
 &end
#
#   37 ILE  HB           37 ILE  HN          3.50    (#     67:10  Unique         2.17, 2.35 A)
 &rst
  ixpk= 67, nxpk= 10, iat= 620, 616, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   36 GLN  HB+          37 ILE  HN          5.50    (#     68:10  Unique         4.15, 4.34 A)
 &rst
  ixpk= 68, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 603, 604,
 &end
#
#   36 GLN  HG-          37 ILE  HN          4.50    (#     69:10  Unique         3.46, 4.28 A)
 &rst
  ixpk= 69, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 606, 607,
 &end
#
#   37 ILE  HA           37 ILE  HN          4.50    (#     71:10  Unique         2.56, 2.83 A)
 &rst
  ixpk= 71, nxpk= 10, iat= 618, 616, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   36 GLN  HN           37 ILE  HN          4.50    (#     72:10  Unique         3.58, 4.14 A)
 &rst
  ixpk= 72, nxpk= 10, iat= 599, 616, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   36 GLN  HA           37 ILE  HN          2.80    (#     73:10  Unique         2.01, 2.08 A)
 &rst
  ixpk= 73, nxpk= 10, iat= 601, 616, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   36 GLN  HB-          37 ILE  HN          5.50    (#     74:10  Unique         4.15, 4.34 A)
 &rst
  ixpk= 74, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 603, 604,
 &end
#
#    0 AMB  10-2:76       0 AMB  10-1:76     5.50    (#     76:10  Double Ambig)
 &rst
  ixpk= 76, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 872, 131, 902,
 igr2= 171, 937,
 &end
#
#   56 PHE  QD           56 PHE  HN          3.50    (#     77:10  Unique         2.30, 3.90 A)
 &rst
  ixpk= 77, nxpk= 10, iat=  -1, 937, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 945, 953,
 &end
#
#   10 TYR  HA           11 ILE  HN          2.80    (#     78:10  Unique         2.00, 2.18 A)
 &rst
  ixpk= 78, nxpk= 10, iat= 152, 171, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   56 PHE  HA           56 PHE  HN          4.50    (#     79:10  Unique         2.80, 2.99 A)
 &rst
  ixpk= 79, nxpk= 10, iat= 939, 937, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   55 ILE  HA           56 PHE  HN          2.80    (#     80:10  Unique         2.16, 2.28 A)
 &rst
  ixpk= 80, nxpk= 10, iat= 920, 937, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   56 PHE  HB-          56 PHE  HN          3.50    (#     81:10  Unique         2.22, 3.12 A)
 &rst
  ixpk= 81, nxpk= 10, iat=  -1, 937, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 941, 942,
 &end
#
#   56 PHE  HB+          56 PHE  HN          3.50    (#     82:10  Unique         2.22, 3.12 A)
 &rst
  ixpk= 82, nxpk= 10, iat=  -1, 937, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 941, 942,
 &end
#
#   11 ILE  HB           11 ILE  HN          3.50    (#     83:10  Unique         2.23, 2.37 A)
 &rst
  ixpk= 83, nxpk= 10, iat= 175, 171, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:84      11 ILE  HN          3.50    (#     84:10  Single Ambig)
 &rst
  ixpk= 84, nxpk= 10, iat=  -1, 171, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 181, 182, 141, 142,
 &end
#
#    0 AMB  10-2:85       0 AMB  10-1:85     3.50    (#     85:10  Double Ambig)
 &rst
  ixpk= 85, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 181, 182, 924, 925, 926,
 igr2= 171, 937,
 &end
#
#   60 GLY  HA+          60 GLY  HN          4.50    (#     86:10  Unique         1.85, 2.58 A)
 &rst
  ixpk= 86, nxpk= 10, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1015,1016,
 &end
#
#   60 GLY  HA-          60 GLY  HN          3.50    (#     87:10  Unique         1.85, 2.58 A)
 &rst
  ixpk= 87, nxpk= 10, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1015,1016,
 &end
#
#    0 AMB  10-2:89      60 GLY  HN          4.50    (#     89:10  Single Ambig)
 &rst
  ixpk= 89, nxpk= 10, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 998,1035,1036,1037,
 &end
#
#   61 SER  HN           60 GLY  HN          4.50    (#     90:10  Unique         2.23, 2.58 A)
 &rst
  ixpk= 90, nxpk= 10, iat=1020,1013, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   58 GLU  HB+          60 GLY  HN          5.50    (#     91:10  Unique         2.35, 3.58 A)
 &rst
  ixpk= 91, nxpk= 10, iat=  -1,1013, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 983, 984,
 &end
#
#   27 LEU  HN           26 SER  HN          3.50    (#     92:10  Unique         2.53, 2.77 A)
 &rst
  ixpk= 92, nxpk= 10, iat= 455, 444, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:93      26 SER  HN          3.50    (#     93:10  Single Ambig)
 &rst
  ixpk= 93, nxpk= 10, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 426, 427, 426, 427,
 &end
#
#   26 SER  HA           26 SER  HN          3.50    (#     94:10  Unique         2.81, 2.84 A)
 &rst
  ixpk= 94, nxpk= 10, iat= 446, 444, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   23 LEU  QD1          26 SER  HN          5.50    (#     95:10  Unique         5.32, 6.40 A)
 &rst
  ixpk= 95, nxpk= 10, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 390, 391, 392,
 &end
#
#   25 LYS  HN           26 SER  HN          4.50    (#     96:10  Unique         2.78, 2.85 A)
 &rst
  ixpk= 96, nxpk= 10, iat= 422, 444, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:97      26 SER  HN          5.50    (#     97:10  Single Ambig)
 &rst
  ixpk= 97, nxpk= 10, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 424, 368, 457,
 &end
#
#   11 ILE  HA           12 ASN  HN          3.50    (#     98:10  Unique         2.16, 2.23 A)
 &rst
  ixpk= 98, nxpk= 10, iat= 173, 190, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   11 ILE  QG2          12 ASN  HN          5.50    (#     99:10  Unique         2.25, 3.54 A)
 &rst
  ixpk= 99, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 177, 178, 179,
 &end
#
#   11 ILE  HN           53 PHE  HN          5.50    (#    100:10  Unique         4.77, 5.02 A)
 &rst
  ixpk= 100, nxpk= 10, iat= 171, 882, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   53 PHE  QD           53 PHE  HN          3.50    (#    101:10  Unique         3.24, 4.10 A)
 &rst
  ixpk= 101, nxpk= 10, iat=  -1, 882, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 890, 898,
 &end
#
#   52 ALA  HA           53 PHE  HN          2.80    (#    102:10  Unique         2.01, 2.31 A)
 &rst
  ixpk= 102, nxpk= 10, iat= 874, 882, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:104     53 PHE  HN          3.50    (#    104:10  Single Ambig)
 &rst
  ixpk= 104, nxpk= 10, iat=  -1, 882, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 886, 887, 886, 887,
 &end
#
#   41 VAL  HB           53 PHE  HN          3.50    (#    105:10  Unique         2.85, 3.15 A)
 &rst
  ixpk= 105, nxpk= 10, iat= 689, 882, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   52 ALA  QB           53 PHE  HN          2.80    (#    106:10  Unique         2.56, 3.52 A)
 &rst
  ixpk= 106, nxpk= 10, iat=  -1, 882, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 876, 877, 878,
 &end
#
#   53 PHE  HA           53 PHE  HN          5.50    (#    107:10  Unique         2.91, 2.98 A)
 &rst
  ixpk= 107, nxpk= 10, iat= 884, 882, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   58 GLU  HA           59 ILE  HN          2.80    (#    109:10  Unique         2.22, 2.36 A)
 &rst
  ixpk= 109, nxpk= 10, iat= 981, 994, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   59 ILE  HA           59 ILE  HN          3.50    (#    110:10  Unique         2.81, 2.84 A)
 &rst
  ixpk= 110, nxpk= 10, iat= 996, 994, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:111     59 ILE  HN          3.50    (#    111:10  Single Ambig)
 &rst
  ixpk= 111, nxpk= 10, iat=  -1, 994, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 986, 987, 983, 984,
 &end
#
#    0 AMB  10-2:112     59 ILE  HN          5.50    (#    112:10  Single Ambig)
 &rst
  ixpk= 112, nxpk= 10, iat=  -1, 994, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 983, 984, 104, 105,
 &end
#
#   59 ILE  HG1+         59 ILE  HN          2.80    (#    113:10  Unique         1.67, 2.82 A)
 &rst
  ixpk= 113, nxpk= 10, iat=  -1, 994, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1004,1005,
 &end
#
#   59 ILE  HG1-         59 ILE  HN          3.50    (#    114:10  Unique         1.67, 2.82 A)
 &rst
  ixpk= 114, nxpk= 10, iat=  -1, 994, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1004,1005,
 &end
#
#    0 AMB  10-2:115     26 SER  HN          5.50    (#    115:10  Single Ambig)
 &rst
  ixpk= 115, nxpk= 10, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 448, 449, 448, 449,
 &end
#
#   19 LYS  HA           19 LYS  HN          3.50    (#    117:10  Unique         2.86, 2.89 A)
 &rst
  ixpk= 117, nxpk= 10, iat= 309, 307, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   18 ILE  HA           19 LYS  HN          2.80    (#    118:10  Unique         1.94, 2.17 A)
 &rst
  ixpk= 118, nxpk= 10, iat= 290, 307, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   19 LYS  HB+          19 LYS  HN          3.50    (#    119:10  Unique         2.36, 2.59 A)
 &rst
  ixpk= 119, nxpk= 10, iat=  -1, 307, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 311, 312,
 &end
#
#   19 LYS  HB-          19 LYS  HN          3.50    (#    120:10  Unique         2.36, 2.59 A)
 &rst
  ixpk= 120, nxpk= 10, iat=  -1, 307, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 311, 312,
 &end
#
#   19 LYS  HG+          19 LYS  HN          4.50    (#    121:10  Unique         2.35, 4.22 A)
 &rst
  ixpk= 121, nxpk= 10, iat=  -1, 307, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 314, 315,
 &end
#
#   18 ILE  HB           19 LYS  HN          7.00    (#    122:10  Unique         4.02, 4.31 A)
 &rst
  ixpk= 122, nxpk= 10, iat= 292, 307, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   18 ILE  QG2          19 LYS  HN          4.50    (#    123:10  Unique         3.00, 3.72 A)
 &rst
  ixpk= 123, nxpk= 10, iat=  -1, 307, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 294, 295, 296,
 &end
#
#   18 ILE  QD1          19 LYS  HN          5.50    (#    124:10  Unique         3.66, 4.86 A)
 &rst
  ixpk= 124, nxpk= 10, iat=  -1, 307, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 301, 302, 303,
 &end
#
#   40 ILE  HA           41 VAL  HN          3.50    (#    125:10  Unique         2.01, 2.28 A)
 &rst
  ixpk= 125, nxpk= 10, iat= 668, 685, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:126     41 VAL  HN          5.50    (#    126:10  Single Ambig)
 &rst
  ixpk= 126, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 687, 904,
 &end
#
#    0 AMB  10-2:127     41 VAL  HN          3.50    (#    127:10  Single Ambig)
 &rst
  ixpk= 127, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 689, 670, 676, 677, 676, 677,
 &end
#
#    0 AMB  10-2:128     41 VAL  HN          2.80    (#    128:10  Single Ambig)
 &rst
  ixpk= 128, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 691, 692, 693, 695, 696, 697, 672, 673, 674,
 &end
#
#    9 ILE  QD1           9 ILE  HN          4.50    (#    129:10  Unique         4.34, 4.88 A)
 &rst
  ixpk= 129, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 144, 145, 146,
 &end
#
#    9 ILE  QG2           9 ILE  HN          3.50    (#    130:10  Unique         2.50, 3.62 A)
 &rst
  ixpk= 130, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 137, 138, 139,
 &end
#
#    8 THR  QG2           9 ILE  HN          3.50    (#    131:10  Unique         2.43, 3.34 A)
 &rst
  ixpk= 131, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 123, 124, 125,
 &end
#
#    9 ILE  HG1-          9 ILE  HN          3.50    (#    132:10  Unique         2.32, 3.06 A)
 &rst
  ixpk= 132, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 141, 142,
 &end
#
#    9 ILE  HG1+          9 ILE  HN          3.50    (#    133:10  Unique         2.32, 3.06 A)
 &rst
  ixpk= 133, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 141, 142,
 &end
#
#    8 THR  HA            9 ILE  HN          2.80    (#    134:10  Unique         2.12, 2.26 A)
 &rst
  ixpk= 134, nxpk= 10, iat= 119, 131, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   56 PHE  QD            9 ILE  HN          5.50    (#    135:10  Unique         3.37, 5.92 A)
 &rst
  ixpk= 135, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 945, 953,
 &end
#
#   55 ILE  HA            9 ILE  HN          4.50    (#    136:10  Unique         3.55, 3.77 A)
 &rst
  ixpk= 136, nxpk= 10, iat= 920, 131, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:138      9 ILE  HN          5.50    (#    138:10  Single Ambig)
 &rst
  ixpk= 138, nxpk= 10, iat=  -1, 131, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 937, 171,
 &end
#
#   54 VAL  HB           54 VAL  HN          4.50    (#    139:10  Unique         3.32, 3.56 A)
 &rst
  ixpk= 139, nxpk= 10, iat= 906, 902, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:140     54 VAL  HN          3.50    (#    140:10  Single Ambig)
 &rst
  ixpk= 140, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 886, 887, 886, 887,
 &end
#
#   53 PHE  HA           54 VAL  HN          2.80    (#    141:10  Unique         2.09, 2.24 A)
 &rst
  ixpk= 141, nxpk= 10, iat= 884, 902, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   53 PHE  QD           54 VAL  HN          5.50    (#    142:10  Unique         3.54, 5.08 A)
 &rst
  ixpk= 142, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 890, 898,
 &end
#
#   54 VAL  QG-          54 VAL  HN          3.50    (#    143:10  Unique         2.45, 4.03 A)
 &rst
  ixpk= 143, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 908, 909, 910, 912, 913, 914,
 &end
#
#   54 VAL  HA           54 VAL  HN          5.50    (#    144:10  Unique         2.90, 2.94 A)
 &rst
  ixpk= 144, nxpk= 10, iat= 904, 902, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 ILE  HN           52 ALA  HN          3.50    (#    145:10  Unique         2.78, 3.08 A)
 &rst
  ixpk= 145, nxpk= 10, iat= 171, 872, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   51 GLN  HA           52 ALA  HN          2.80    (#    147:10  Unique         2.31, 2.48 A)
 &rst
  ixpk= 147, nxpk= 10, iat= 857, 872, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   52 ALA  HA           52 ALA  HN          4.50    (#    148:10  Unique         2.72, 2.91 A)
 &rst
  ixpk= 148, nxpk= 10, iat= 874, 872, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   12 ASN  HA           52 ALA  HN          4.50    (#    149:10  Unique         3.78, 4.01 A)
 &rst
  ixpk= 149, nxpk= 10, iat= 192, 872, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:150     52 ALA  HN          4.50    (#    150:10  Single Ambig)
 &rst
  ixpk= 150, nxpk= 10, iat=  -1, 872, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 862, 863, 859, 860, 859, 860,
 &end
#
#   48 MET  QE           52 ALA  HN          3.50    (#    151:10  Unique         3.36, 4.31 A)
 &rst
  ixpk= 151, nxpk= 10, iat=  -1, 872, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 818, 819, 820,
 &end
#
#   11 ILE  HB           52 ALA  HN          4.50    (#    153:10  Unique         2.56, 2.77 A)
 &rst
  ixpk= 153, nxpk= 10, iat= 175, 872, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   52 ALA  QB           52 ALA  HN          3.50    (#    154:10  Unique         2.41, 3.48 A)
 &rst
  ixpk= 154, nxpk= 10, iat=  -1, 872, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 876, 877, 878,
 &end
#
#    0 AMB  10-2:155     52 ALA  HN          3.50    (#    155:10  Single Ambig)
 &rst
  ixpk= 155, nxpk= 10, iat=  -1, 872, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   53 PHE  HN           42 ALA  HN          5.50    (#    156:10  Unique         4.99, 5.05 A)
 &rst
  ixpk= 156, nxpk= 10, iat= 882, 701, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   41 VAL  HA           42 ALA  HN          2.80    (#    158:10  Unique         2.00, 2.13 A)
 &rst
  ixpk= 158, nxpk= 10, iat= 687, 701, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   42 ALA  QB           42 ALA  HN          3.50    (#    159:10  Unique         2.65, 3.39 A)
 &rst
  ixpk= 159, nxpk= 10, iat=  -1, 701, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 705, 706, 707,
 &end
#
#    0 AMB  10-2:160     42 ALA  HN          3.50    (#    160:10  Single Ambig)
 &rst
  ixpk= 160, nxpk= 10, iat=  -1, 701, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 691, 692, 693, 695, 696, 697, 390, 391, 392,
 &end
#
#    0 AMB  10-2:161     42 ALA  HN          4.50    (#    161:10  Single Ambig)
 &rst
  ixpk= 161, nxpk= 10, iat=  -1, 701, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 691, 692, 693, 695, 696, 697, 672, 673, 674,
 &end
#
#    0 AMB  10-2:162     42 ALA  HN          5.50    (#    162:10  Single Ambig)
 &rst
  ixpk= 162, nxpk= 10, iat=  -1, 701, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 339, 340, 715, 716,
 &end
#
#    0 AMB  10-2:163     79 MET  HN          3.50    (#    163:10  Single Ambig)
 &rst
  ixpk= 163, nxpk= 10, iat=  -1,1297, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1293,1169,1170,
 &end
#
#   79 MET  HB+          79 MET  HN          5.50    (#    164:10  Unique         1.97, 2.96 A)
 &rst
  ixpk= 164, nxpk= 10, iat=  -1,1297, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1301,1302,
 &end
#
#   79 MET  HB-          79 MET  HN          5.50    (#    165:10  Unique         1.97, 2.96 A)
 &rst
  ixpk= 165, nxpk= 10, iat=  -1,1297, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1301,1302,
 &end
#
#   71 GLY  HA-          71 GLY  HN          3.50    (#    167:10  Unique         2.26, 2.59 A)
 &rst
  ixpk= 167, nxpk= 10, iat=  -1,1167, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1169,1170,
 &end
#
#   70 GLN  HA           71 GLY  HN          3.50    (#    168:10  Unique         1.97, 2.19 A)
 &rst
  ixpk= 168, nxpk= 10, iat=1152,1167, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   71 GLY  HA+          71 GLY  HN          3.50    (#    169:10  Unique         2.26, 2.59 A)
 &rst
  ixpk= 169, nxpk= 10, iat=  -1,1167, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1169,1170,
 &end
#
#    0 AMB  10-2:170     71 GLY  HN          4.50    (#    170:10  Single Ambig)
 &rst
  ixpk= 170, nxpk= 10, iat=  -1,1167, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1154,1155,1290,1291,
 &end
#
#   14 LEU  HN           13 ASN  HN          3.50    (#    171:10  Unique         2.25, 2.69 A)
 &rst
  ixpk= 171, nxpk= 10, iat= 218, 204, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   12 ASN  HA           13 ASN  HN          3.50    (#    172:10  Unique         2.45, 2.96 A)
 &rst
  ixpk= 172, nxpk= 10, iat= 192, 204, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   51 GLN  HA           13 ASN  HN          5.50    (#    174:10  Unique         3.84, 4.17 A)
 &rst
  ixpk= 174, nxpk= 10, iat= 857, 204, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   13 ASN  HA           13 ASN  HN          2.80    (#    175:10  Unique         2.21, 2.68 A)
 &rst
  ixpk= 175, nxpk= 10, iat= 206, 204, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   12 ASN  HB+          13 ASN  HN          4.50    (#    176:10  Unique         2.19, 3.98 A)
 &rst
  ixpk= 176, nxpk= 10, iat=  -1, 204, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 194, 195,
 &end
#
#    0 AMB  10-2:177     13 ASN  HN          4.50    (#    177:10  Single Ambig)
 &rst
  ixpk= 177, nxpk= 10, iat=  -1, 204, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 862, 863, 859, 860, 859, 860,1321,1322,
 &end
#
#   57 LYS  HN           58 GLU  HN          3.50    (#    178:10  Unique         2.64, 2.90 A)
 &rst
  ixpk= 178, nxpk= 10, iat= 957, 979, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   58 GLU  HA           58 GLU  HN          3.50    (#    180:10  Unique         2.76, 2.93 A)
 &rst
  ixpk= 180, nxpk= 10, iat= 981, 979, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   57 LYS  HA           58 GLU  HN          4.50    (#    181:10  Unique         3.38, 3.54 A)
 &rst
  ixpk= 181, nxpk= 10, iat= 959, 979, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   56 PHE  HB-          58 GLU  HN          3.50    (#    182:10  Unique         2.79, 3.11 A)
 &rst
  ixpk= 182, nxpk= 10, iat=  -1, 979, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 941, 942,
 &end
#
#   56 PHE  HB+          58 GLU  HN          4.50    (#    183:10  Unique         2.79, 3.11 A)
 &rst
  ixpk= 183, nxpk= 10, iat=  -1, 979, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 941, 942,
 &end
#
#    0 AMB  10-2:184     58 GLU  HN          2.80    (#    184:10  Single Ambig)
 &rst
  ixpk= 184, nxpk= 10, iat=  -1, 979, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 983, 984, 986, 987,
 &end
#
#    0 AMB  10-2:185     58 GLU  HN          2.80    (#    185:10  Single Ambig)
 &rst
  ixpk= 185, nxpk= 10, iat=  -1, 979, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 983, 984, 104, 105,
 &end
#
#   57 LYS  HB-          58 GLU  HN          4.50    (#    186:10  Unique         3.09, 4.09 A)
 &rst
  ixpk= 186, nxpk= 10, iat=  -1, 979, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 961, 962,
 &end
#
#    0 AMB  10-2:188     28 TYR  HN          5.50    (#    188:10  Single Ambig)
 &rst
  ixpk= 188, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 457, 424,
 &end
#
#   28 TYR  HB-          28 TYR  HN          4.50    (#    189:10  Unique         1.94, 2.73 A)
 &rst
  ixpk= 189, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 478, 479,
 &end
#
#   27 LEU  HB+          28 TYR  HN          5.50    (#    190:10  Unique         2.51, 2.97 A)
 &rst
  ixpk= 190, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 459, 460,
 &end
#
#    0 AMB  10-2:191     40 ILE  HN          2.80    (#    191:10  Single Ambig)
 &rst
  ixpk= 191, nxpk= 10, iat=  -1, 666, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 656, 668,
 &end
#
#   39 ASP  HB+          40 ILE  HN          5.50    (#    192:10  Unique         3.08, 3.71 A)
 &rst
  ixpk= 192, nxpk= 10, iat=  -1, 666, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 658, 659,
 &end
#
#   39 ASP  HB-          40 ILE  HN          4.50    (#    193:10  Unique         3.08, 3.71 A)
 &rst
  ixpk= 193, nxpk= 10, iat=  -1, 666, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 658, 659,
 &end
#
#    0 AMB  10-2:194     40 ILE  HN          3.50    (#    194:10  Single Ambig)
 &rst
  ixpk= 194, nxpk= 10, iat=  -1, 666, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 670, 676, 677, 676, 677,
 &end
#
#    0 AMB  10-2:195     40 ILE  HN          3.50    (#    195:10  Single Ambig)
 &rst
  ixpk= 195, nxpk= 10, iat=  -1, 666, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 691, 692, 693, 695, 696, 697, 672, 673, 674, 679,
       680, 681,
 &end
#
#    3 MET  HA            3 MET  HN          3.50    (#    197:10  Unique         2.07, 2.81 A)
 &rst
  ixpk= 197, nxpk= 10, iat=  38,  36, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   82 ALA  HA            3 MET  HN          7.00    (#    198:10  Unique         5.58, 6.69 A)
 &rst
  ixpk= 198, nxpk= 10, iat=1352,  36, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    2 GLU  HA            3 MET  HN          3.50    (#    199:10  Unique         2.18, 2.54 A)
 &rst
  ixpk= 199, nxpk= 10, iat=  23,  36, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:200      3 MET  HN          3.50    (#    200:10  Single Ambig)
 &rst
  ixpk= 200, nxpk= 10, iat=  -1,  36, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  40,  41,  40,  41,
 &end
#
#    7 GLN  HG-           7 GLN  HN          5.50    (#    201:10  Unique         2.67, 4.41 A)
 &rst
  ixpk= 201, nxpk= 10, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 107, 108,
 &end
#
#    0 AMB  10-2:202      7 GLN  HN          3.50    (#    202:10  Single Ambig)
 &rst
  ixpk= 202, nxpk= 10, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  90,  91,  90,  91,
 &end
#
#    7 GLN  HG+           7 GLN  HN          5.50    (#    203:10  Unique         2.67, 4.41 A)
 &rst
  ixpk= 203, nxpk= 10, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 107, 108,
 &end
#
#    7 GLN  HA            7 GLN  HN          4.50    (#    204:10  Unique         2.20, 2.80 A)
 &rst
  ixpk= 204, nxpk= 10, iat= 102, 100, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   22 GLU  HN           23 LEU  HN          3.50    (#    206:10  Unique         2.54, 2.62 A)
 &rst
  ixpk= 206, nxpk= 10, iat= 366, 381, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   22 GLU  HA           23 LEU  HN          5.50    (#    207:10  Unique         3.56, 3.58 A)
 &rst
  ixpk= 207, nxpk= 10, iat= 368, 381, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 LEU  HA           23 LEU  HN          3.50    (#    208:10  Unique         2.83, 2.85 A)
 &rst
  ixpk= 208, nxpk= 10, iat= 383, 381, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:209     23 LEU  HN          3.50    (#    209:10  Single Ambig)
 &rst
  ixpk= 209, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 331, 290,
 &end
#
#    0 AMB  10-2:210     23 LEU  HN          3.50    (#    210:10  Single Ambig)
 &rst
  ixpk= 210, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 370, 371, 311, 312,
 &end
#
#   23 LEU  HB+          23 LEU  HN          3.50    (#    211:10  Unique         1.86, 2.40 A)
 &rst
  ixpk= 211, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 385, 386,
 &end
#
#   23 LEU  HB-          23 LEU  HN          2.80    (#    212:10  Unique         1.86, 2.40 A)
 &rst
  ixpk= 212, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 385, 386,
 &end
#
#   18 ILE  QG2          23 LEU  HN          3.50    (#    213:10  Unique         2.58, 3.42 A)
 &rst
  ixpk= 213, nxpk= 10, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 294, 295, 296,
 &end
#
#    0 AMB  10-2:214     84 SER  HN          5.50    (#    214:10  Single Ambig)
 &rst
  ixpk= 214, nxpk= 10, iat=  -1,1381, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1368,1377, 892, 896,
 &end
#
#    9 ILE  HA           84 SER  HN          4.50    (#    215:10  Unique         2.18, 2.56 A)
 &rst
  ixpk= 215, nxpk= 10, iat= 133,1381, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   84 SER  HA           84 SER  HN          3.50    (#    217:10  Unique         2.80, 2.87 A)
 &rst
  ixpk= 217, nxpk= 10, iat=1383,1381, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   84 SER  HB+          84 SER  HN          3.50    (#    218:10  Unique         2.04, 3.06 A)
 &rst
  ixpk= 218, nxpk= 10, iat=  -1,1381, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1385,1386,
 &end
#
#   83 TYR  HB+          84 SER  HN          5.50    (#    219:10  Unique         2.62, 3.50 A)
 &rst
  ixpk= 219, nxpk= 10, iat=  -1,1381, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1364,1365,
 &end
#
#    0 AMB  10-2:220     84 SER  HN          4.50    (#    220:10  Single Ambig)
 &rst
  ixpk= 220, nxpk= 10, iat=  -1,1381, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1364,1365, 154, 155, 154, 155,
 &end
#
#    9 ILE  QG2          84 SER  HN          5.50    (#    221:10  Unique         3.61, 5.17 A)
 &rst
  ixpk= 221, nxpk= 10, iat=  -1,1381, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 137, 138, 139,
 &end
#
#  101 ARG  HA          103 LYS  HN          5.50    (#    228:10  Unique         3.36, 4.35 A)
 &rst
  ixpk= 228, nxpk= 10, iat=1648,1684, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  102 PRO  HA          103 LYS  HN          3.50    (#    229:10  Unique         2.17, 3.27 A)
 &rst
  ixpk= 229, nxpk= 10, iat=1680,1684, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  101 ARG  HB-         103 LYS  HN          4.50    (#    230:10  Unique         2.29, 4.03 A)
 &rst
  ixpk= 230, nxpk= 10, iat=  -1,1684, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1650,1651,
 &end
#
#    0 AMB  10-2:231     31 PHE  HN          5.50    (#    231:10  Single Ambig)
 &rst
  ixpk= 231, nxpk= 10, iat=  -1, 524, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 580, 588, 572, 592,
 &end
#
#   31 PHE  HB-          31 PHE  HN          3.50    (#    232:10  Unique         2.02, 2.95 A)
 &rst
  ixpk= 232, nxpk= 10, iat=  -1, 524, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 528, 529,
 &end
#
#   31 PHE  HB+          31 PHE  HN          3.50    (#    233:10  Unique         2.02, 2.95 A)
 &rst
  ixpk= 233, nxpk= 10, iat=  -1, 524, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 528, 529,
 &end
#
#   30 ILE  HB           31 PHE  HN          3.50    (#    234:10  Unique         2.35, 3.42 A)
 &rst
  ixpk= 234, nxpk= 10, iat= 509, 524, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   37 ILE  QD1          31 PHE  HN          4.50    (#    235:10  Unique         3.94, 5.01 A)
 &rst
  ixpk= 235, nxpk= 10, iat=  -1, 524, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 629, 630, 631,
 &end
#
#   31 PHE  QD           31 PHE  HN          5.50    (#    236:10  Unique         2.02, 3.92 A)
 &rst
  ixpk= 236, nxpk= 10, iat=  -1, 524, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 532, 540,
 &end
#
#   31 PHE  HA           31 PHE  HN          5.50    (#    237:10  Unique         2.80, 2.88 A)
 &rst
  ixpk= 237, nxpk= 10, iat= 526, 524, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   30 ILE  HG1-         31 PHE  HN          5.50    (#    238:10  Unique         2.14, 3.51 A)
 &rst
  ixpk= 238, nxpk= 10, iat=  -1, 524, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 515, 516,
 &end
#
#   30 ILE  HG1+         31 PHE  HN          5.50    (#    239:10  Unique         2.14, 3.51 A)
 &rst
  ixpk= 239, nxpk= 10, iat=  -1, 524, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 515, 516,
 &end
#
#    0 AMB  10-2:240     72 PHE  HN          3.50    (#    240:10  Single Ambig)
 &rst
  ixpk= 240, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1167,1297,
 &end
#
#   72 PHE  QD           72 PHE  HN          4.50    (#    241:10  Unique         3.43, 4.70 A)
 &rst
  ixpk= 241, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1182,1190,
 &end
#
#   72 PHE  HA           72 PHE  HN          3.50    (#    242:10  Unique         2.85, 2.87 A)
 &rst
  ixpk= 242, nxpk= 10, iat=1176,1174, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:243     72 PHE  HN          3.50    (#    243:10  Single Ambig)
 &rst
  ixpk= 243, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1169,1170,1293,
 &end
#
#    0 AMB  10-2:244     72 PHE  HN          3.50    (#    244:10  Single Ambig)
 &rst
  ixpk= 244, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1152,1204,
 &end
#
#    0 AMB  10-2:245     72 PHE  HN          3.50    (#    245:10  Single Ambig)
 &rst
  ixpk= 245, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1169,1170,1195,1196,
 &end
#
#   72 PHE  HB-          72 PHE  HN          2.80    (#    246:10  Unique         2.14, 2.50 A)
 &rst
  ixpk= 246, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1178,1179,
 &end
#
#   72 PHE  HB+          72 PHE  HN          2.80    (#    247:10  Unique         2.14, 2.50 A)
 &rst
  ixpk= 247, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1178,1179,
 &end
#
#   79 MET  HB+          72 PHE  HN          4.50    (#    248:10  Unique         2.15, 3.44 A)
 &rst
  ixpk= 248, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1301,1302,
 &end
#
#    0 AMB  10-2:249     72 PHE  HN          5.50    (#    249:10  Single Ambig)
 &rst
  ixpk= 249, nxpk= 10, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=1290,1291,1154,1155,1308,1309,1310,
 &end
#
#    0 AMB  10-2:250     17 LYS  HN          3.50    (#    250:10  Single Ambig)
 &rst
  ixpk= 250, nxpk= 10, iat=  -1, 266, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 251, 237,
 &end
#
#   83 TYR  QD           83 TYR  HN          3.50    (#    251:10  Unique         1.92, 3.28 A)
 &rst
  ixpk= 251, nxpk= 10, iat=  -1,1360, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1368,1377,
 &end
#
#   18 ILE  HN           17 LYS  HN          2.80    (#    252:10  Unique         1.79, 2.30 A)
 &rst
  ixpk= 252, nxpk= 10, iat= 288, 266, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   17 LYS  HA           17 LYS  HN          2.80    (#    253:10  Unique         2.79, 2.90 A)
 &rst
  ixpk= 253, nxpk= 10, iat= 268, 266, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   17 LYS  HB-          17 LYS  HN          3.50    (#    255:10  Unique         2.05, 3.35 A)
 &rst
  ixpk= 255, nxpk= 10, iat=  -1, 266, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 270, 271,
 &end
#
#    0 AMB  10-2:256      0 AMB  10-1:256    2.80    (#    256:10  Double Ambig)
 &rst
  ixpk= 256, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1=1354,1355,1356, 273, 274,
 igr2=1360, 266,
 &end
#
#   17 LYS  HG-          17 LYS  HN          3.50    (#    257:10  Unique         2.29, 3.30 A)
 &rst
  ixpk= 257, nxpk= 10, iat=  -1, 266, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 273, 274,
 &end
#
#    0 AMB  10-2:258     17 LYS  HN          4.50    (#    258:10  Single Ambig)
 &rst
  ixpk= 258, nxpk= 10, iat=  -1, 266, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 255, 256, 258, 259,
 &end
#
#    0 AMB  10-2:268      0 AMB  10-1:268    3.50    (#    268:10  Double Ambig)
 &rst
  ixpk= 268, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 154, 155, 154, 155, 241, 242,  43,  44,
 igr2=1360, 266,
 &end
#
#   83 TYR  HB+          83 TYR  HN          3.50    (#    269:10  Unique         2.64, 3.28 A)
 &rst
  ixpk= 269, nxpk= 10, iat=  -1,1360, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1364,1365,
 &end
#
#   66 LEU  MDX          83 TYR  HN          4.50    (#    270:10  Unique         2.81, 5.03 A)
 &rst
  ixpk= 270, nxpk= 10, iat=  -1,1360, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#   83 TYR  HA           83 TYR  HN          4.50    (#    271:10  Unique         2.87, 2.95 A)
 &rst
  ixpk= 271, nxpk= 10, iat=1362,1360, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   82 ALA  HA           83 TYR  HN          2.80    (#    272:10  Unique         2.54, 2.65 A)
 &rst
  ixpk= 272, nxpk= 10, iat=1352,1360, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   83 TYR  QD           83 TYR  HN          3.50    (#    273:10  Unique         1.92, 3.28 A)
 &rst
  ixpk= 273, nxpk= 10, iat=  -1,1360, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1368,1377,
 &end
#
#   17 LYS  HA           17 LYS  HN          3.50    (#    274:10  Unique         2.79, 2.90 A)
 &rst
  ixpk= 274, nxpk= 10, iat= 268, 266, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:275      0 AMB  10-1:275    3.50    (#    275:10  Double Ambig)
 &rst
  ixpk= 275, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 592, 422,
 igr2= 599, 400, 544,
 &end
#
#   35 GLY  HA+          36 GLN  HN          3.50    (#    277:10  Unique         2.18, 3.02 A)
 &rst
  ixpk= 277, nxpk= 10, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 594, 595,
 &end
#
#   36 GLN  HA            0 AMB  10-1:278    3.50    (#    278:10  Single Ambig)
 &rst
  ixpk= 278, nxpk= 10, iat= 601,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 599, 544,
 &end
#
#    0 AMB  10-2:279      0 AMB  10-1:279    2.80    (#    279:10  Double Ambig)
 &rst
  ixpk= 279, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 594, 595, 383,
 igr2= 599, 400,
 &end
#
#    0 AMB  10-2:280      0 AMB  10-1:280    3.50    (#    280:10  Double Ambig)
 &rst
  ixpk= 280, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 402, 476, 331,
 igr2= 400, 544,
 &end
#
#   36 GLN  HB-          36 GLN  HN          3.50    (#    281:10  Unique         2.24, 2.81 A)
 &rst
  ixpk= 281, nxpk= 10, iat=  -1, 599, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 603, 604,
 &end
#
#    0 AMB  10-2:282      0 AMB  10-1:282    2.80    (#    282:10  Double Ambig)
 &rst
  ixpk= 282, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 603, 604, 404, 405,
 igr2= 599, 400,
 &end
#
#    0 AMB  10-2:283      0 AMB  10-1:283    4.50    (#    283:10  Double Ambig)
 &rst
  ixpk= 283, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 572, 580, 588,
 igr2= 599, 544,
 &end
#
#   32 SER  HA            0 AMB  10-1:284    3.50    (#    284:10  Single Ambig)
 &rst
  ixpk= 284, nxpk= 10, iat= 546,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 544, 599,
 &end
#
#    0 AMB  10-2:285      0 AMB  10-1:285    3.50    (#    285:10  Double Ambig)
 &rst
  ixpk= 285, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 548, 549, 548, 549,
 igr2= 544, 599,
 &end
#
#   32 SER  HB-          32 SER  HN          3.50    (#    286:10  Unique         2.12, 3.07 A)
 &rst
  ixpk= 286, nxpk= 10, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 548, 549,
 &end
#
#   31 PHE  HB-          32 SER  HN          5.50    (#    287:10  Unique         1.87, 3.25 A)
 &rst
  ixpk= 287, nxpk= 10, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 528, 529,
 &end
#
#   31 PHE  HB+          32 SER  HN          5.50    (#    288:10  Unique         1.87, 3.25 A)
 &rst
  ixpk= 288, nxpk= 10, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 528, 529,
 &end
#
#    0 AMB  10-2:290     74 PHE  HN          5.50    (#    290:10  Single Ambig)
 &rst
  ixpk= 290, nxpk= 10, iat=  -1,1208, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1210,1293,
 &end
#
#   73 PRO  HA           74 PHE  HN          2.80    (#    291:10  Unique         2.29, 2.39 A)
 &rst
  ixpk= 291, nxpk= 10, iat=1204,1208, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   74 PHE  HB+          74 PHE  HN          3.50    (#    292:10  Unique         2.29, 2.54 A)
 &rst
  ixpk= 292, nxpk= 10, iat=  -1,1208, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1212,1213,
 &end
#
#   74 PHE  HB-          74 PHE  HN          3.50    (#    293:10  Unique         2.29, 2.54 A)
 &rst
  ixpk= 293, nxpk= 10, iat=  -1,1208, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1212,1213,
 &end
#
#    0 AMB  10-2:295     74 PHE  HN          5.50    (#    295:10  Single Ambig)
 &rst
  ixpk= 295, nxpk= 10, iat=  -1,1208, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1201,1202,1144,1145,1146,
 &end
#
#   64 ASN  HN           63 SER  HN          3.50    (#    296:10  Unique         2.68, 2.82 A)
 &rst
  ixpk= 296, nxpk= 10, iat=1052,1041, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 ALA  HN           63 SER  HN          3.50    (#    297:10  Unique         2.79, 2.87 A)
 &rst
  ixpk= 297, nxpk= 10, iat=1031,1041, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   63 SER  HA           63 SER  HN          3.50    (#    298:10  Unique         2.80, 2.82 A)
 &rst
  ixpk= 298, nxpk= 10, iat=1043,1041, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:299     63 SER  HN          2.80    (#    299:10  Single Ambig)
 &rst
  ixpk= 299, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1045,1046,1045,1046,
 &end
#
#   60 GLY  HA-          63 SER  HN          5.50    (#    300:10  Unique         3.33, 4.06 A)
 &rst
  ixpk= 300, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1015,1016,
 &end
#
#   62 ALA  QB           63 SER  HN          3.50    (#    301:10  Unique         2.33, 3.28 A)
 &rst
  ixpk= 301, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1035,1036,1037,
 &end
#
#    0 AMB  10-2:302     63 SER  HN          5.50    (#    302:10  Single Ambig)
 &rst
  ixpk= 302, nxpk= 10, iat=  -1,1041, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1022, 102,
 &end
#
#    0 AMB  10-2:304     55 ILE  HN          5.50    (#    304:10  Single Ambig)
 &rst
  ixpk= 304, nxpk= 10, iat=  -1, 918, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 685, 131, 882,
 &end
#
#   54 VAL  HA           55 ILE  HN          2.80    (#    305:10  Unique         1.84, 2.07 A)
 &rst
  ixpk= 305, nxpk= 10, iat= 904, 918, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   55 ILE  HB           55 ILE  HN          3.50    (#    306:10  Unique         2.20, 2.47 A)
 &rst
  ixpk= 306, nxpk= 10, iat= 922, 918, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:307     55 ILE  HN          3.50    (#    307:10  Single Ambig)
 &rst
  ixpk= 307, nxpk= 10, iat=  -1, 918, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 928, 929, 906,
 &end
#
#   55 ILE  QD1          55 ILE  HN          3.50    (#    308:10  Unique         2.41, 3.17 A)
 &rst
  ixpk= 308, nxpk= 10, iat=  -1, 918, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 931, 932, 933,
 &end
#
#   54 VAL  QG+          55 ILE  HN          3.50    (#    309:10  Unique         1.98, 4.15 A)
 &rst
  ixpk= 309, nxpk= 10, iat=  -1, 918, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 908, 909, 910, 912, 913, 914,
 &end
#
#   94 ILE  HA           95 LYS  HN          3.50    (#    313:10  Unique         3.47, 3.56 A)
 &rst
  ixpk= 313, nxpk= 10, iat=1529,1546, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   94 ILE  QD1          95 LYS  HN          5.50    (#    318:10  Unique         2.56, 4.98 A)
 &rst
  ixpk= 318, nxpk= 10, iat=  -1,1546, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1540,1541,1542,
 &end
#
#   76 ASP  HA           76 ASP  HN          2.80    (#    319:10  Unique         2.20, 2.71 A)
 &rst
  ixpk= 319, nxpk= 10, iat=1251,1249, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   75 TYR  HA           76 ASP  HN          3.50    (#    320:10  Unique         2.18, 2.81 A)
 &rst
  ixpk= 320, nxpk= 10, iat=1230,1249, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    3 MET  HA            4 LEU  HN          2.80    (#    322:10  Unique         2.19, 2.33 A)
 &rst
  ixpk= 322, nxpk= 10, iat=  38,  53, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:323      4 LEU  HN          3.50    (#    323:10  Single Ambig)
 &rst
  ixpk= 323, nxpk= 10, iat=  -1,  53, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  40,  41,  40,  41,
 &end
#
#    4 LEU  HB+           4 LEU  HN          2.80    (#    324:10  Unique         2.19, 3.05 A)
 &rst
  ixpk= 324, nxpk= 10, iat=  -1,  53, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=  57,  58,
 &end
#
#    0 AMB  10-2:325      4 LEU  HN          3.50    (#    325:10  Single Ambig)
 &rst
  ixpk= 325, nxpk= 10, iat=  -1,  53, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  62,  63,  64,  66,  67,  68,  62,  63,  64,  66,
        67,  68,
 &end
#
#  100 GLU  HB+         100 GLU  HN          5.50    (#    333:10  Unique         2.05, 3.01 A)
 &rst
  ixpk= 333, nxpk= 10, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1635,1636,
 &end
#
#  100 GLU  HB-         100 GLU  HN          3.50    (#    336:10  Unique         2.05, 3.01 A)
 &rst
  ixpk= 336, nxpk= 10, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1635,1636,
 &end
#
#   13 ASN  HN           14 LEU  HN          3.50    (#    337:10  Unique         2.25, 2.69 A)
 &rst
  ixpk= 337, nxpk= 10, iat= 204, 218, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   13 ASN  HA           14 LEU  HN          3.50    (#    338:10  Unique         2.44, 2.64 A)
 &rst
  ixpk= 338, nxpk= 10, iat= 206, 218, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   14 LEU  HA           14 LEU  HN          3.50    (#    339:10  Unique         2.85, 2.94 A)
 &rst
  ixpk= 339, nxpk= 10, iat= 220, 218, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   50 GLY  HA+          14 LEU  HN          5.50    (#    340:10  Unique         2.92, 3.83 A)
 &rst
  ixpk= 340, nxpk= 10, iat=  -1, 218, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 850, 851,
 &end
#
#   50 GLY  HA-          14 LEU  HN          5.50    (#    341:10  Unique         2.92, 3.83 A)
 &rst
  ixpk= 341, nxpk= 10, iat=  -1, 218, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 850, 851,
 &end
#
#   14 LEU  HB+          14 LEU  HN          2.80    (#    342:10  Unique         2.06, 2.64 A)
 &rst
  ixpk= 342, nxpk= 10, iat=  -1, 218, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 222, 223,
 &end
#
#   14 LEU  HB-          14 LEU  HN          3.50    (#    343:10  Unique         2.06, 2.64 A)
 &rst
  ixpk= 343, nxpk= 10, iat=  -1, 218, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 222, 223,
 &end
#
#   14 LEU  HG           14 LEU  HN          4.50    (#    344:10  Unique         3.03, 3.93 A)
 &rst
  ixpk= 344, nxpk= 10, iat= 225, 218, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:345     14 LEU  HN          4.50    (#    345:10  Single Ambig)
 &rst
  ixpk= 345, nxpk= 10, iat=  -1, 218, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 227, 228, 229, 231, 232, 233, 227, 228, 229, 231,
       232, 233,
 &end
#
#   58 GLU  HN           57 LYS  HN          3.50    (#    347:10  Unique         2.64, 2.90 A)
 &rst
  ixpk= 347, nxpk= 10, iat= 979, 957, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   56 PHE  HA           57 LYS  HN          3.50    (#    348:10  Unique         2.12, 2.44 A)
 &rst
  ixpk= 348, nxpk= 10, iat= 939, 957, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   37 ILE  HA           57 LYS  HN          4.50    (#    349:10  Unique         3.22, 3.93 A)
 &rst
  ixpk= 349, nxpk= 10, iat= 618, 957, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   57 LYS  HA           57 LYS  HN          3.50    (#    350:10  Unique         2.55, 2.81 A)
 &rst
  ixpk= 350, nxpk= 10, iat= 959, 957, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   56 PHE  HB-          57 LYS  HN          3.50    (#    351:10  Unique         2.21, 3.00 A)
 &rst
  ixpk= 351, nxpk= 10, iat=  -1, 957, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 941, 942,
 &end
#
#   56 PHE  HB+          57 LYS  HN          4.50    (#    352:10  Unique         2.21, 3.00 A)
 &rst
  ixpk= 352, nxpk= 10, iat=  -1, 957, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 941, 942,
 &end
#
#   57 LYS  HB+          57 LYS  HN          3.50    (#    353:10  Unique         2.41, 3.08 A)
 &rst
  ixpk= 353, nxpk= 10, iat=  -1, 957, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 961, 962,
 &end
#
#   57 LYS  HB-          57 LYS  HN          3.50    (#    354:10  Unique         2.41, 3.08 A)
 &rst
  ixpk= 354, nxpk= 10, iat=  -1, 957, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 961, 962,
 &end
#
#    0 AMB  10-2:355     57 LYS  HN          5.50    (#    355:10  Single Ambig)
 &rst
  ixpk= 355, nxpk= 10, iat=  -1, 957, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 639, 640, 642,
 &end
#
#   64 ASN  HN           65 ALA  HN          2.80    (#    356:10  Unique         2.27, 2.74 A)
 &rst
  ixpk= 356, nxpk= 10, iat=1052,1066, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:357     65 ALA  HN          4.50    (#    357:10  Single Ambig)
 &rst
  ixpk= 357, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1033, 576, 577,
 &end
#
#    0 AMB  10-2:358     65 ALA  HN          3.50    (#    358:10  Single Ambig)
 &rst
  ixpk= 358, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1054, 574,
 &end
#
#    0 AMB  10-2:359     65 ALA  HN          2.80    (#    359:10  Single Ambig)
 &rst
  ixpk= 359, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1056,1057,1056,1057,
 &end
#
#   69 MET  HG-          65 ALA  HN          5.50    (#    360:10  Unique         5.16, 6.26 A)
 &rst
  ixpk= 360, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1140,1141,
 &end
#
#   65 ALA  QB           65 ALA  HN          2.80    (#    361:10  Unique         2.40, 2.90 A)
 &rst
  ixpk= 361, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1070,1071,1072,
 &end
#
#   66 LEU  HB-          65 ALA  HN          5.50    (#    362:10  Unique         4.64, 4.96 A)
 &rst
  ixpk= 362, nxpk= 10, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1080,1081,
 &end
#
#   67 ARG  HN           66 LEU  HN          3.50    (#    363:10  Unique         2.81, 2.96 A)
 &rst
  ixpk= 363, nxpk= 10, iat=1095,1076, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 LEU  HA           66 LEU  HN          3.50    (#    364:10  Unique         2.59, 2.78 A)
 &rst
  ixpk= 364, nxpk= 10, iat=1078,1076, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 LEU  HB+          66 LEU  HN          3.50    (#    365:10  Unique         2.03, 2.46 A)
 &rst
  ixpk= 365, nxpk= 10, iat=  -1,1076, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1080,1081,
 &end
#
#   66 LEU  HB-          66 LEU  HN          2.80    (#    366:10  Unique         2.03, 2.46 A)
 &rst
  ixpk= 366, nxpk= 10, iat=  -1,1076, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1080,1081,
 &end
#
#   65 ALA  QB           66 LEU  HN          3.50    (#    367:10  Unique         2.36, 3.26 A)
 &rst
  ixpk= 367, nxpk= 10, iat=  -1,1076, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1070,1071,1072,
 &end
#
#    9 ILE  QG2          66 LEU  HN          4.50    (#    368:10  Unique         2.84, 4.47 A)
 &rst
  ixpk= 368, nxpk= 10, iat=  -1,1076, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 137, 138, 139,
 &end
#
#   91 VAL  HN           92 ALA  HN          3.50    (#    370:10  Unique         2.81, 2.93 A)
 &rst
  ixpk= 370, nxpk= 10, iat=1479,1495, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 VAL  HA           92 ALA  HN          4.50    (#    373:10  Unique         3.59, 3.63 A)
 &rst
  ixpk= 373, nxpk= 10, iat=1481,1495, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   91 VAL  HB           92 ALA  HN          3.50    (#    374:10  Unique         2.46, 2.70 A)
 &rst
  ixpk= 374, nxpk= 10, iat=1483,1495, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 VAL  QG-          92 ALA  HN          3.50    (#    376:10  Unique         3.39, 4.59 A)
 &rst
  ixpk= 376, nxpk= 10, iat=  -1,1495, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1485,1486,1487,1489,1490,1491,
 &end
#
#   87 ASP  HA           88 SER  HN          4.50    (#    379:10  Unique         2.31, 3.37 A)
 &rst
  ixpk= 379, nxpk= 10, iat=1427,1437, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 TYR  HN           29 ALA  HN          3.50    (#    381:10  Unique         2.69, 2.76 A)
 &rst
  ixpk= 381, nxpk= 10, iat= 474, 495, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:382     29 ALA  HN          5.50    (#    382:10  Single Ambig)
 &rst
  ixpk= 382, nxpk= 10, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 532, 540, 422,
 &end
#
#   26 SER  HA           29 ALA  HN          5.50    (#    383:10  Unique         3.05, 3.37 A)
 &rst
  ixpk= 383, nxpk= 10, iat= 446, 495, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:384     29 ALA  HN          4.50    (#    384:10  Single Ambig)
 &rst
  ixpk= 384, nxpk= 10, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 424, 457,
 &end
#
#   28 TYR  HA           29 ALA  HN          4.50    (#    385:10  Unique         3.38, 3.56 A)
 &rst
  ixpk= 385, nxpk= 10, iat= 476, 495, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 TYR  HB+          29 ALA  HN          3.50    (#    386:10  Unique         2.66, 3.37 A)
 &rst
  ixpk= 386, nxpk= 10, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 478, 479,
 &end
#
#   29 ALA  QB           29 ALA  HN          2.80    (#    387:10  Unique         2.49, 2.92 A)
 &rst
  ixpk= 387, nxpk= 10, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 499, 500, 501,
 &end
#
#   40 ILE  QD1          29 ALA  HN          5.50    (#    388:10  Unique         5.70, 6.57 A)
 &rst
  ixpk= 388, nxpk= 10, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 679, 680, 681,
 &end
#
#   98 PHE  HA           99 LYS  HN          3.50    (#    389:10  Unique         3.02, 3.43 A)
 &rst
  ixpk= 389, nxpk= 10, iat=1591,1609, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   92 ALA  HN           93 LYS  HN          3.50    (#    398:10  Unique         2.48, 2.82 A)
 &rst
  ixpk= 398, nxpk= 10, iat=1495,1505, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   98 PHE  HA           98 PHE  HN          4.50    (#    407:10  Unique         2.16, 2.67 A)
 &rst
  ixpk= 407, nxpk= 10, iat=1591,1589, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   97 THR  HA           98 PHE  HN          5.50    (#    409:10  Unique         2.24, 3.04 A)
 &rst
  ixpk= 409, nxpk= 10, iat=1577,1589, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 PHE  HB+          98 PHE  HN          5.50    (#    411:10  Unique         2.01, 3.12 A)
 &rst
  ixpk= 411, nxpk= 10, iat=  -1,1589, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1593,1594,
 &end
#
#   70 GLN  HN           69 MET  HN          2.80    (#    412:10  Unique         2.47, 2.58 A)
 &rst
  ixpk= 412, nxpk= 10, iat=1150,1133, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   69 MET  HA           69 MET  HN          3.50    (#    413:10  Unique         2.79, 2.93 A)
 &rst
  ixpk= 413, nxpk= 10, iat=1135,1133, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:414     69 MET  HN          3.50    (#    414:10  Single Ambig)
 &rst
  ixpk= 414, nxpk= 10, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1121,1152,
 &end
#
#   68 THR  HB           69 MET  HN          3.50    (#    415:10  Unique         2.68, 2.81 A)
 &rst
  ixpk= 415, nxpk= 10, iat=1123,1133, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   69 MET  HG+          69 MET  HN          2.80    (#    416:10  Unique         2.06, 3.13 A)
 &rst
  ixpk= 416, nxpk= 10, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1140,1141,
 &end
#
#   69 MET  HB+          69 MET  HN          2.80    (#    417:10  Unique         2.25, 3.02 A)
 &rst
  ixpk= 417, nxpk= 10, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1137,1138,
 &end
#
#   81 ILE  QD1          69 MET  HN          5.50    (#    418:10  Unique         3.72, 4.64 A)
 &rst
  ixpk= 418, nxpk= 10, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1344,1345,1346,
 &end
#
#   68 THR  QG2          69 MET  HN          4.50    (#    419:10  Unique         3.92, 4.71 A)
 &rst
  ixpk= 419, nxpk= 10, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1125,1126,1127,
 &end
#
#  103 LYS  HA          104 LYS  HN          2.80    (#    421:10  Unique         2.19, 2.77 A)
 &rst
  ixpk= 421, nxpk= 10, iat=1686,1706, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  104 LYS  HA          104 LYS  HN          3.50    (#    422:10  Unique         2.28, 2.86 A)
 &rst
  ixpk= 422, nxpk= 10, iat=1708,1706, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  101 ARG  HB-         104 LYS  HN          4.50    (#    423:10  Unique         2.20, 4.53 A)
 &rst
  ixpk= 423, nxpk= 10, iat=  -1,1706, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1650,1651,
 &end
#
#   94 ILE  HA           94 ILE  HN          3.50    (#    428:10  Unique         2.80, 2.91 A)
 &rst
  ixpk= 428, nxpk= 10, iat=1529,1527, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 VAL  HA           94 ILE  HN          5.50    (#    429:10  Unique         3.35, 3.57 A)
 &rst
  ixpk= 429, nxpk= 10, iat=1481,1527, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 ILE  HG1+         94 ILE  HN          3.50    (#    432:10  Unique         2.08, 2.81 A)
 &rst
  ixpk= 432, nxpk= 10, iat=  -1,1527, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1537,1538,
 &end
#
#   50 GLY  HA+          51 GLN  HN          3.50    (#    435:10  Unique         2.59, 3.31 A)
 &rst
  ixpk= 435, nxpk= 10, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 850, 851,
 &end
#
#   50 GLY  HA-          51 GLN  HN          3.50    (#    436:10  Unique         2.59, 3.31 A)
 &rst
  ixpk= 436, nxpk= 10, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 850, 851,
 &end
#
#    0 AMB  10-2:437     51 GLN  HN          3.50    (#    437:10  Single Ambig)
 &rst
  ixpk= 437, nxpk= 10, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 859, 860, 859, 860, 862, 863,
 &end
#
#   48 MET  QE           51 GLN  HN          4.50    (#    438:10  Unique         3.84, 5.19 A)
 &rst
  ixpk= 438, nxpk= 10, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 818, 819, 820,
 &end
#
#    0 AMB  10-2:439     51 GLN  HN          4.50    (#    439:10  Single Ambig)
 &rst
  ixpk= 439, nxpk= 10, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 789, 790, 828, 829, 828, 829,
 &end
#
#    0 AMB  10-2:440     51 GLN  HN          5.50    (#    440:10  Single Ambig)
 &rst
  ixpk= 440, nxpk= 10, iat=  -1, 855, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 218, 711,
 &end
#
#   50 GLY  HN           51 GLN  HN          5.50    (#    441:10  Unique         2.01, 2.34 A)
 &rst
  ixpk= 441, nxpk= 10, iat= 848, 855, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:442     80 GLN  HN          5.50    (#    442:10  Single Ambig)
 &rst
  ixpk= 442, nxpk= 10, iat=  -1,1314, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 204,1167,1297,
 &end
#
#   80 GLN  HA           80 GLN  HN          3.50    (#    443:10  Unique         2.86, 2.95 A)
 &rst
  ixpk= 443, nxpk= 10, iat=1316,1314, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   79 MET  HA           80 GLN  HN          2.80    (#    444:10  Unique         2.22, 2.27 A)
 &rst
  ixpk= 444, nxpk= 10, iat=1299,1314, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:445     80 GLN  HN          5.50    (#    445:10  Single Ambig)
 &rst
  ixpk= 445, nxpk= 10, iat=  -1,1314, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 194, 195,1304,1305,
 &end
#
#    0 AMB  10-2:446     80 GLN  HN          3.50    (#    446:10  Single Ambig)
 &rst
  ixpk= 446, nxpk= 10, iat=  -1,1314, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1321,1322,1321,1322,
 &end
#
#   80 GLN  HB+          80 GLN  HN          3.50    (#    447:10  Unique         2.61, 3.26 A)
 &rst
  ixpk= 447, nxpk= 10, iat=  -1,1314, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1318,1319,
 &end
#
#    0 AMB  10-2:448     80 GLN  HN          2.80    (#    448:10  Single Ambig)
 &rst
  ixpk= 448, nxpk= 10, iat=  -1,1314, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1301,1302,1318,1319,
 &end
#
#   11 ILE  QG2          80 GLN  HN          3.50    (#    449:10  Unique         3.42, 4.51 A)
 &rst
  ixpk= 449, nxpk= 10, iat=  -1,1314, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 177, 178, 179,
 &end
#
#   91 VAL  HN           90 ILE  HN          3.50    (#    450:10  Unique         2.51, 2.66 A)
 &rst
  ixpk= 450, nxpk= 10, iat=1479,1460, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   89 ASP  HA           90 ILE  HN          3.50    (#    452:10  Unique         3.45, 3.60 A)
 &rst
  ixpk= 452, nxpk= 10, iat=1450,1460, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   88 SER  HB+          90 ILE  HN          5.50    (#    453:10  Unique         4.56, 5.67 A)
 &rst
  ixpk= 453, nxpk= 10, iat=  -1,1460, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1441,1442,
 &end
#
#   90 ILE  HG1-         90 ILE  HN          3.50    (#    457:10  Unique         2.05, 2.78 A)
 &rst
  ixpk= 457, nxpk= 10, iat=  -1,1460, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1470,1471,
 &end
#
#   90 ILE  HG1+         90 ILE  HN          3.50    (#    459:10  Unique         2.05, 2.78 A)
 &rst
  ixpk= 459, nxpk= 10, iat=  -1,1460, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1470,1471,
 &end
#
#   67 ARG  HN           64 ASN  HN          7.00    (#    460:10  Unique         4.69, 4.82 A)
 &rst
  ixpk= 460, nxpk= 10, iat=1095,1052, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   64 ASN  HD2+         64 ASN  HN          7.00    (#    461:10  Unique         4.69, 5.35 A)
 &rst
  ixpk= 461, nxpk= 10, iat=  -1,1052, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=1061,1062,
 &end
#
#   65 ALA  HN           64 ASN  HN          2.80    (#    462:10  Unique         2.27, 2.74 A)
 &rst
  ixpk= 462, nxpk= 10, iat=1066,1052, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   63 SER  HN           64 ASN  HN          3.50    (#    463:10  Unique         2.68, 2.82 A)
 &rst
  ixpk= 463, nxpk= 10, iat=1041,1052, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   63 SER  HA           64 ASN  HN          3.50    (#    465:10  Unique         3.37, 3.56 A)
 &rst
  ixpk= 465, nxpk= 10, iat=1043,1052, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   64 ASN  HA           64 ASN  HN          3.50    (#    466:10  Unique         2.83, 2.86 A)
 &rst
  ixpk= 466, nxpk= 10, iat=1054,1052, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 SER  HA           64 ASN  HN          4.50    (#    467:10  Unique         2.70, 3.37 A)
 &rst
  ixpk= 467, nxpk= 10, iat=1022,1052, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:469     64 ASN  HN          2.80    (#    469:10  Single Ambig)
 &rst
  ixpk= 469, nxpk= 10, iat=  -1,1052, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1045,1046,1045,1046,
 &end
#
#   60 GLY  HA-          64 ASN  HN          5.50    (#    470:10  Unique         3.86, 4.49 A)
 &rst
  ixpk= 470, nxpk= 10, iat=  -1,1052, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1015,1016,
 &end
#
#    0 AMB  10-2:471     64 ASN  HN          2.80    (#    471:10  Single Ambig)
 &rst
  ixpk= 471, nxpk= 10, iat=  -1,1052, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1056,1057,1056,1057,
 &end
#
#   65 ALA  QB           64 ASN  HN          5.50    (#    472:10  Unique         4.46, 5.44 A)
 &rst
  ixpk= 472, nxpk= 10, iat=  -1,1052, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1070,1071,1072,
 &end
#
#    0 AMB  10-2:473     64 ASN  HN          5.50    (#    473:10  Single Ambig)
 &rst
  ixpk= 473, nxpk= 10, iat=  -1,1052, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1035,1036,1037, 998,
 &end
#
#   74 PHE  HN           77 LYS  HN          4.50    (#    474:10  Unique         2.87, 4.25 A)
 &rst
  ixpk= 474, nxpk= 10, iat=1208,1261, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   77 LYS  HA           77 LYS  HN          4.50    (#    475:10  Unique         2.85, 2.93 A)
 &rst
  ixpk= 475, nxpk= 10, iat=1263,1261, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:476     77 LYS  HN          5.50    (#    476:10  Single Ambig)
 &rst
  ixpk= 476, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1251,1204,
 &end
#
#   48 MET  HA           49 ARG  HN          3.50    (#    479:10  Unique         2.12, 3.36 A)
 &rst
  ixpk= 479, nxpk= 10, iat= 809, 824, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   49 ARG  HA           49 ARG  HN          3.50    (#    480:10  Unique         2.30, 2.88 A)
 &rst
  ixpk= 480, nxpk= 10, iat= 826, 824, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:481     49 ARG  HN          2.80    (#    481:10  Single Ambig)
 &rst
  ixpk= 481, nxpk= 10, iat=  -1, 824, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 828, 829, 828, 829,
 &end
#
#   49 ARG  HG+          49 ARG  HN          4.50    (#    482:10  Unique         2.70, 3.92 A)
 &rst
  ixpk= 482, nxpk= 10, iat=  -1, 824, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 831, 832,
 &end
#
#    0 AMB  10-2:483     49 ARG  HN          5.50    (#    483:10  Single Ambig)
 &rst
  ixpk= 483, nxpk= 10, iat=  -1, 824, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 773, 715, 716, 770, 771,
 &end
#
#   48 MET  HA           48 MET  HN          3.50    (#    485:10  Unique         2.80, 2.91 A)
 &rst
  ixpk= 485, nxpk= 10, iat= 809, 807, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:486     48 MET  HN          3.50    (#    486:10  Single Ambig)
 &rst
  ixpk= 486, nxpk= 10, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 787, 768,
 &end
#
#   48 MET  HG-          48 MET  HN          5.50    (#    487:10  Unique         2.16, 3.10 A)
 &rst
  ixpk= 487, nxpk= 10, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 814, 815,
 &end
#
#    0 AMB  10-2:488     48 MET  HN          3.50    (#    488:10  Single Ambig)
 &rst
  ixpk= 488, nxpk= 10, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 811, 812, 811, 812,
 &end
#
#    0 AMB  10-2:489     48 MET  HN          4.50    (#    489:10  Single Ambig)
 &rst
  ixpk= 489, nxpk= 10, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 715, 716, 718,
 &end
#
#    0 AMB  10-2:490     48 MET  HN          4.50    (#    490:10  Single Ambig)
 &rst
  ixpk= 490, nxpk= 10, iat=  -1, 807, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 859, 860, 859, 860, 862, 863,
 &end
#
#   33 GLN  HN           34 PHE  HN          3.50    (#    491:10  Unique         1.78, 2.63 A)
 &rst
  ixpk= 491, nxpk= 10, iat= 555, 572, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   34 PHE  HA           34 PHE  HN          4.50    (#    492:10  Unique         2.84, 2.97 A)
 &rst
  ixpk= 492, nxpk= 10, iat= 574, 572, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   34 PHE  HB+          34 PHE  HN          4.50    (#    493:10  Unique         2.26, 3.20 A)
 &rst
  ixpk= 493, nxpk= 10, iat=  -1, 572, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 576, 577,
 &end
#
#   34 PHE  HB-          34 PHE  HN          3.50    (#    494:10  Unique         2.26, 3.20 A)
 &rst
  ixpk= 494, nxpk= 10, iat=  -1, 572, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 576, 577,
 &end
#
#    0 AMB  10-2:495      0 AMB  10-1:495    5.50    (#    495:10  Double Ambig)
 &rst
  ixpk= 495, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 559, 560, 559, 560, 795, 796, 795, 796,
 igr2= 572, 807,
 &end
#
#    0 AMB  10-2:496     67 ARG  HN          3.50    (#    496:10  Single Ambig)
 &rst
  ixpk= 496, nxpk= 10, iat=  -1,1095, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1076,1066,
 &end
#
#   68 THR  HN           67 ARG  HN          3.50    (#    497:10  Unique         2.57, 2.82 A)
 &rst
  ixpk= 497, nxpk= 10, iat=1119,1095, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   64 ASN  HA           67 ARG  HN          5.50    (#    498:10  Unique         3.41, 3.64 A)
 &rst
  ixpk= 498, nxpk= 10, iat=1054,1095, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:499     67 ARG  HN          3.50    (#    499:10  Single Ambig)
 &rst
  ixpk= 499, nxpk= 10, iat=  -1,1095, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1097,1045,1046,
 &end
#
#   67 ARG  HB+          67 ARG  HN          2.80    (#    500:10  Unique         2.21, 2.69 A)
 &rst
  ixpk= 500, nxpk= 10, iat=  -1,1095, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1099,1100,
 &end
#
#   67 ARG  HB-          67 ARG  HN          2.80    (#    501:10  Unique         2.21, 2.69 A)
 &rst
  ixpk= 501, nxpk= 10, iat=  -1,1095, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1099,1100,
 &end
#
#   66 LEU  HB+          67 ARG  HN          3.50    (#    502:10  Unique         2.18, 2.90 A)
 &rst
  ixpk= 502, nxpk= 10, iat=  -1,1095, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1080,1081,
 &end
#
#   66 LEU  HB-          67 ARG  HN          4.50    (#    503:10  Unique         2.18, 2.90 A)
 &rst
  ixpk= 503, nxpk= 10, iat=  -1,1095, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1080,1081,
 &end
#
#   66 LEU  MDY          67 ARG  HN          5.50    (#    504:10  Unique         3.32, 4.81 A)
 &rst
  ixpk= 504, nxpk= 10, iat=  -1,1095, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1085,1086,1087,1089,1090,1091,
 &end
#
#   36 GLN  HN           35 GLY  HN          5.50    (#    505:10  Unique         1.76, 2.90 A)
 &rst
  ixpk= 505, nxpk= 10, iat= 599, 592, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   35 GLY  HA+          35 GLY  HN          3.50    (#    506:10  Unique         2.59, 2.82 A)
 &rst
  ixpk= 506, nxpk= 10, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 594, 595,
 &end
#
#   34 PHE  HA           35 GLY  HN          3.50    (#    507:10  Unique         2.91, 3.33 A)
 &rst
  ixpk= 507, nxpk= 10, iat= 574, 592, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   35 GLY  HA-          35 GLY  HN          3.50    (#    508:10  Unique         2.59, 2.82 A)
 &rst
  ixpk= 508, nxpk= 10, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 594, 595,
 &end
#
#    0 AMB  10-2:509     25 LYS  HN          3.50    (#    509:10  Single Ambig)
 &rst
  ixpk= 509, nxpk= 10, iat=  -1, 422, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 424, 368,
 &end
#
#    0 AMB  10-2:510     25 LYS  HN          2.80    (#    510:10  Single Ambig)
 &rst
  ixpk= 510, nxpk= 10, iat=  -1, 422, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 426, 427, 426, 427,
 &end
#
#   24 LYS  HB-          25 LYS  HN          3.50    (#    511:10  Unique         2.43, 3.08 A)
 &rst
  ixpk= 511, nxpk= 10, iat=  -1, 422, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 404, 405,
 &end
#
#   25 LYS  HG-          25 LYS  HN          5.50    (#    513:10  Unique         2.45, 4.06 A)
 &rst
  ixpk= 513, nxpk= 10, iat=  -1, 422, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 429, 430,
 &end
#
#   26 SER  HN           25 LYS  HN          3.50    (#    514:10  Unique         2.78, 2.85 A)
 &rst
  ixpk= 514, nxpk= 10, iat= 444, 422, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   55 ILE  HN           39 ASP  HN          4.50    (#    515:10  Unique         2.83, 2.92 A)
 &rst
  ixpk= 515, nxpk= 10, iat= 918, 654, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   38 LEU  HN           39 ASP  HN          3.50    (#    516:10  Unique         1.90, 2.00 A)
 &rst
  ixpk= 516, nxpk= 10, iat= 635, 654, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   39 ASP  HA           39 ASP  HN          3.50    (#    517:10  Unique         2.88, 2.90 A)
 &rst
  ixpk= 517, nxpk= 10, iat= 656, 654, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   39 ASP  HB+          39 ASP  HN          5.50    (#    518:10  Unique         2.94, 3.25 A)
 &rst
  ixpk= 518, nxpk= 10, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 658, 659,
 &end
#
#   39 ASP  HB-          39 ASP  HN          5.50    (#    519:10  Unique         2.94, 3.25 A)
 &rst
  ixpk= 519, nxpk= 10, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 658, 659,
 &end
#
#   55 ILE  HB           39 ASP  HN          3.50    (#    520:10  Unique         2.31, 2.48 A)
 &rst
  ixpk= 520, nxpk= 10, iat= 922, 654, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   38 LEU  HB+          39 ASP  HN          3.50    (#    521:10  Unique         2.59, 3.41 A)
 &rst
  ixpk= 521, nxpk= 10, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 639, 640,
 &end
#
#    0 AMB  10-2:522     39 ASP  HN          3.50    (#    522:10  Single Ambig)
 &rst
  ixpk= 522, nxpk= 10, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 639, 640, 642,
 &end
#
#    0 AMB  10-2:523     39 ASP  HN          3.50    (#    523:10  Single Ambig)
 &rst
  ixpk= 523, nxpk= 10, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 644, 645, 646, 648, 649, 650, 931, 932, 933,
 &end
#
#   37 ILE  QG2          39 ASP  HN          3.50    (#    524:10  Unique         2.51, 3.35 A)
 &rst
  ixpk= 524, nxpk= 10, iat=  -1, 654, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 622, 623, 624,
 &end
#
#   90 ILE  HN           91 VAL  HN          3.50    (#    525:10  Unique         2.51, 2.66 A)
 &rst
  ixpk= 525, nxpk= 10, iat=1460,1479, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 VAL  HB           91 VAL  HN          3.50    (#    528:10  Unique         2.34, 2.45 A)
 &rst
  ixpk= 528, nxpk= 10, iat=1483,1479, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:531     33 GLN  HN          4.50    (#    531:10  Single Ambig)
 &rst
  ixpk= 531, nxpk= 10, iat=  -1, 555, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 572, 592,
 &end
#
#   31 PHE  HN           33 GLN  HN          5.50    (#    532:10  Unique         2.40, 4.21 A)
 &rst
  ixpk= 532, nxpk= 10, iat= 524, 555, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:534     33 GLN  HN          3.50    (#    534:10  Single Ambig)
 &rst
  ixpk= 534, nxpk= 10, iat=  -1, 555, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 557, 507,
 &end
#
#   37 ILE  HG1+         33 GLN  HN          5.50    (#    535:10  Unique         5.35, 6.35 A)
 &rst
  ixpk= 535, nxpk= 10, iat=  -1, 555, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 627,
 &end
#
#    0 AMB  10-2:536     33 GLN  HN          3.50    (#    536:10  Single Ambig)
 &rst
  ixpk= 536, nxpk= 10, iat=  -1, 555, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 559, 560, 559, 560,
 &end
#
#   69 MET  HN           70 GLN  HN          2.80    (#    538:10  Unique         2.47, 2.58 A)
 &rst
  ixpk= 538, nxpk= 10, iat=1133,1150, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:539     70 GLN  HN          3.50    (#    539:10  Single Ambig)
 &rst
  ixpk= 539, nxpk= 10, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1152,1121,
 &end
#
#   69 MET  HA           70 GLN  HN          5.50    (#    540:10  Unique         3.24, 3.47 A)
 &rst
  ixpk= 540, nxpk= 10, iat=1135,1150, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   70 GLN  HB+          70 GLN  HN          2.80    (#    542:10  Unique         2.06, 2.83 A)
 &rst
  ixpk= 542, nxpk= 10, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1154,1155,
 &end
#
#   70 GLN  HB-          70 GLN  HN          2.80    (#    543:10  Unique         2.06, 2.83 A)
 &rst
  ixpk= 543, nxpk= 10, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1154,1155,
 &end
#
#   70 GLN  HG-          70 GLN  HN          4.50    (#    544:10  Unique         2.12, 3.33 A)
 &rst
  ixpk= 544, nxpk= 10, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1157,1158,
 &end
#
#   81 ILE  QD1          70 GLN  HN          3.50    (#    545:10  Unique         2.80, 3.97 A)
 &rst
  ixpk= 545, nxpk= 10, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1344,1345,1346,
 &end
#
#    0 AMB  10-2:546     70 GLN  HN          4.50    (#    546:10  Single Ambig)
 &rst
  ixpk= 546, nxpk= 10, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1162,1163,1119,
 &end
#
#   23 LEU  HN           22 GLU  HN          2.80    (#    547:10  Unique         2.54, 2.62 A)
 &rst
  ixpk= 547, nxpk= 10, iat= 381, 366, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:548     22 GLU  HN          3.50    (#    548:10  Single Ambig)
 &rst
  ixpk= 548, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 368, 309,
 &end
#
#   22 GLU  HG+          22 GLU  HN          5.50    (#    549:10  Unique         1.89, 2.96 A)
 &rst
  ixpk= 549, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 373, 374,
 &end
#
#   22 GLU  HG-          22 GLU  HN          3.50    (#    550:10  Unique         1.89, 2.96 A)
 &rst
  ixpk= 550, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 373, 374,
 &end
#
#    0 AMB  10-2:551     22 GLU  HN          2.80    (#    551:10  Single Ambig)
 &rst
  ixpk= 551, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 311, 312, 370, 371, 355, 356,
 &end
#
#   19 LYS  HB-          22 GLU  HN          4.50    (#    552:10  Unique         2.04, 3.24 A)
 &rst
  ixpk= 552, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 311, 312,
 &end
#
#    0 AMB  10-2:553     22 GLU  HN          4.50    (#    553:10  Single Ambig)
 &rst
  ixpk= 553, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 314, 315, 407, 408,
 &end
#
#   18 ILE  QG2          22 GLU  HN          5.50    (#    554:10  Unique         4.15, 4.92 A)
 &rst
  ixpk= 554, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 294, 295, 296,
 &end
#
#   62 ALA  HN           61 SER  HN          2.80    (#    555:10  Unique         2.51, 2.61 A)
 &rst
  ixpk= 555, nxpk= 10, iat=1031,1020, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   60 GLY  HN           61 SER  HN          3.50    (#    556:10  Unique         2.23, 2.58 A)
 &rst
  ixpk= 556, nxpk= 10, iat=1013,1020, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 SER  HA           61 SER  HN          3.50    (#    558:10  Unique         2.83, 2.88 A)
 &rst
  ixpk= 558, nxpk= 10, iat=1022,1020, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   60 GLY  HA+          61 SER  HN          4.50    (#    559:10  Unique         2.51, 3.22 A)
 &rst
  ixpk= 559, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1015,1016,
 &end
#
#   60 GLY  HA-          61 SER  HN          2.80    (#    560:10  Unique         2.51, 3.22 A)
 &rst
  ixpk= 560, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1015,1016,
 &end
#
#   61 SER  HB+          61 SER  HN          2.80    (#    561:10  Unique         2.52, 3.10 A)
 &rst
  ixpk= 561, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1024,1025,
 &end
#
#    0 AMB  10-2:562     61 SER  HN          4.50    (#    562:10  Single Ambig)
 &rst
  ixpk= 562, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 996, 941, 942,
 &end
#
#   61 SER  HB-          61 SER  HN          3.50    (#    563:10  Unique         2.52, 3.10 A)
 &rst
  ixpk= 563, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1024,1025,
 &end
#
#    0 AMB  10-2:564     61 SER  HN          3.50    (#    564:10  Single Ambig)
 &rst
  ixpk= 564, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 983, 984, 986, 987,
 &end
#
#   58 GLU  HB-          61 SER  HN          3.50    (#    565:10  Unique         2.22, 3.24 A)
 &rst
  ixpk= 565, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 983, 984,
 &end
#
#    0 AMB  10-2:566     61 SER  HN          4.50    (#    566:10  Single Ambig)
 &rst
  ixpk= 566, nxpk= 10, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1035,1036,1037, 998, 967, 968, 967, 968,
 &end
#
#   83 TYR  HB+           6 ASN  HN          5.50    (#    569:10  Unique         3.84, 4.88 A)
 &rst
  ixpk= 569, nxpk= 10, iat=  -1,  86, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1364,1365,
 &end
#
#   61 SER  HN           62 ALA  HN          3.50    (#    571:10  Unique         2.51, 2.61 A)
 &rst
  ixpk= 571, nxpk= 10, iat=1020,1031, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   63 SER  HN           62 ALA  HN          3.50    (#    572:10  Unique         2.79, 2.87 A)
 &rst
  ixpk= 572, nxpk= 10, iat=1041,1031, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 SER  HB+          62 ALA  HN          3.50    (#    573:10  Unique         2.50, 3.20 A)
 &rst
  ixpk= 573, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1024,1025,
 &end
#
#   62 ALA  HA           62 ALA  HN          3.50    (#    574:10  Unique         2.82, 2.84 A)
 &rst
  ixpk= 574, nxpk= 10, iat=1033,1031, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 ALA  QB           62 ALA  HN          2.80    (#    575:10  Unique         2.41, 2.88 A)
 &rst
  ixpk= 575, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1035,1036,1037,
 &end
#
#   61 SER  HB-          62 ALA  HN          5.50    (#    576:10  Unique         2.50, 3.20 A)
 &rst
  ixpk= 576, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1024,1025,
 &end
#
#    7 GLN  HA           62 ALA  HN          5.50    (#    577:10  Unique         3.59, 4.47 A)
 &rst
  ixpk= 577, nxpk= 10, iat= 102,1031, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 LYS  HN           18 ILE  HN          3.50    (#    578:10  Unique         1.79, 2.30 A)
 &rst
  ixpk= 578, nxpk= 10, iat= 266, 288, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 LYS  HA           18 ILE  HN          3.50    (#    580:10  Unique         3.25, 3.36 A)
 &rst
  ixpk= 580, nxpk= 10, iat= 268, 288, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   18 ILE  HA           18 ILE  HN          3.50    (#    581:10  Unique         2.69, 2.86 A)
 &rst
  ixpk= 581, nxpk= 10, iat= 290, 288, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   23 LEU  HB+          18 ILE  HN          7.00    (#    582:10  Unique         5.75, 6.73 A)
 &rst
  ixpk= 582, nxpk= 10, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 385, 386,
 &end
#
#   18 ILE  HB           18 ILE  HN          3.50    (#    583:10  Unique         2.29, 2.44 A)
 &rst
  ixpk= 583, nxpk= 10, iat= 292, 288, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:584     18 ILE  HN          2.80    (#    584:10  Single Ambig)
 &rst
  ixpk= 584, nxpk= 10, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 298, 299, 298, 299,
 &end
#
#   18 ILE  QG2          18 ILE  HN          5.50    (#    585:10  Unique         4.31, 4.54 A)
 &rst
  ixpk= 585, nxpk= 10, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 294, 295, 296,
 &end
#
#   18 ILE  QD1          18 ILE  HN          3.50    (#    587:10  Unique         3.32, 4.18 A)
 &rst
  ixpk= 587, nxpk= 10, iat=  -1, 288, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 301, 302, 303,
 &end
#
#    0 AMB  10-2:589     47 LYS  HN          4.50    (#    589:10  Single Ambig)
 &rst
  ixpk= 589, nxpk= 10, iat=  -1, 785, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 787, 768,
 &end
#
#   47 LYS  HG-          47 LYS  HN          5.50    (#    591:10  Unique         2.00, 2.90 A)
 &rst
  ixpk= 591, nxpk= 10, iat=  -1, 785, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 792, 793,
 &end
#
#    0 AMB  10-2:592      0 AMB  10-1:592    3.50    (#    592:10  Double Ambig)
 &rst
  ixpk= 592, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 872, 131, 902,
 igr2= 171, 937,
 &end
#
#   11 ILE  HB           11 ILE  HN          3.50    (#    595:10  Unique         2.23, 2.37 A)
 &rst
  ixpk= 595, nxpk= 10, iat= 175, 171, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:596      0 AMB  10-1:596    3.50    (#    596:10  Double Ambig)
 &rst
  ixpk= 596, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 181, 182, 924, 925, 926,
 igr2= 171, 937,
 &end
#
#    8 THR  HA           56 PHE  HN          4.50    (#    597:10  Unique         2.95, 3.66 A)
 &rst
  ixpk= 597, nxpk= 10, iat= 119, 937, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    8 THR  HB            8 THR  HN          3.50    (#    603:10  Unique         2.54, 2.69 A)
 &rst
  ixpk= 603, nxpk= 10, iat= 121, 117, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    7 GLN  HG-           8 THR  HN          5.50    (#    604:10  Unique         3.62, 4.85 A)
 &rst
  ixpk= 604, nxpk= 10, iat=  -1, 117, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 107, 108,
 &end
#
#   67 ARG  HN           68 THR  HN          3.50    (#    606:10  Unique         2.57, 2.82 A)
 &rst
  ixpk= 606, nxpk= 10, iat=1095,1119, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   68 THR  HA           68 THR  HN          3.50    (#    608:10  Unique         2.80, 2.87 A)
 &rst
  ixpk= 608, nxpk= 10, iat=1121,1119, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   68 THR  HB           68 THR  HN          2.80    (#    609:10  Unique         2.53, 2.58 A)
 &rst
  ixpk= 609, nxpk= 10, iat=1123,1119, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   69 MET  HB+          68 THR  HN          5.50    (#    610:10  Unique         4.72, 5.59 A)
 &rst
  ixpk= 610, nxpk= 10, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1137,1138,
 &end
#
#   67 ARG  HB-          68 THR  HN          3.50    (#    611:10  Unique         1.98, 3.21 A)
 &rst
  ixpk= 611, nxpk= 10, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1099,1100,
 &end
#
#   68 THR  QG2          68 THR  HN          4.50    (#    612:10  Unique         4.41, 4.54 A)
 &rst
  ixpk= 612, nxpk= 10, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1125,1126,1127,
 &end
#
#    0 AMB  10-2:613     68 THR  HN          5.50    (#    613:10  Single Ambig)
 &rst
  ixpk= 613, nxpk= 10, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 576, 577,1056,1057,1056,1057,
 &end
#
#    0 AMB  10-2:614     68 THR  HN          4.50    (#    614:10  Single Ambig)
 &rst
  ixpk= 614, nxpk= 10, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1150,1061,1062,
 &end
#
#    0 AMB  10-2:615     68 THR  HN          5.50    (#    615:10  Single Ambig)
 &rst
  ixpk= 615, nxpk= 10, iat=  -1,1119, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1076,1066,
 &end
#
#    0 AMB  10-2:616     43 LEU  HN          3.50    (#    616:10  Single Ambig)
 &rst
  ixpk= 616, nxpk= 10, iat=  -1, 711, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 715, 716, 718,
 &end
#
#    0 AMB  10-2:617     43 LEU  HN          5.50    (#    617:10  Single Ambig)
 &rst
  ixpk= 617, nxpk= 10, iat=  -1, 711, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 720, 721, 722, 724, 725, 726, 720, 721, 722, 724,
       725, 726,
 &end
#
#   55 ILE  HA           55 ILE  HN          4.50    (#    619:10  Unique         2.85, 2.95 A)
 &rst
  ixpk= 619, nxpk= 10, iat= 920, 918, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   39 ASP  HN           55 ILE  HN          4.50    (#    620:10  Unique         2.83, 2.92 A)
 &rst
  ixpk= 620, nxpk= 10, iat= 654, 918, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   21 GLU  HN           22 GLU  HN          4.50    (#    621:10  Unique         2.73, 2.82 A)
 &rst
  ixpk= 621, nxpk= 10, iat= 351, 366, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   51 GLN  HA           51 GLN  HN          3.50    (#    622:10  Unique         2.80, 2.93 A)
 &rst
  ixpk= 622, nxpk= 10, iat= 857, 855, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   37 ILE  QD1          32 SER  HN          4.50    (#    623:10  Unique         2.51, 3.97 A)
 &rst
  ixpk= 623, nxpk= 10, iat=  -1, 544, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 629, 630, 631,
 &end
#
#    0 AMB  10-2:628      0 AMB  10-1:628    3.50    (#    628:10  Double Ambig)
 &rst
  ixpk= 628, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 208, 209,1284,1285,
 igr2= 213, 214, 213, 214,
 &end
#
#    0 AMB  10-2:629     13 ASN  HD2-        2.80    (#    629:10  Single Ambig)
 &rst
  ixpk= 629, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 208, 209,1284,1285,
 igr2= 213, 214,
 &end
#
#   13 ASN  HB-          13 ASN  HD2-        3.50    (#    630:10  Unique         2.00, 3.22 A)
 &rst
  ixpk= 630, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 208, 209,
 igr2= 213, 214,
 &end
#
#    0 AMB  10-2:631      0 AMB  10-1:631    4.50    (#    631:10  Double Ambig)
 &rst
  ixpk= 631, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1265,1266,1318,1319,
 igr2= 213, 214, 213, 214,
 &end
#
#   13 ASN  HB-          13 ASN  HD2+        3.50    (#    632:10  Unique         2.00, 3.22 A)
 &rst
  ixpk= 632, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 208, 209,
 igr2= 213, 214,
 &end
#
#    0 AMB  10-2:633     13 ASN  HD2-        4.50    (#    633:10  Single Ambig)
 &rst
  ixpk= 633, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1287,1288,1290,1291,
 igr2= 213, 214,
 &end
#
#    0 AMB  10-2:634      0 AMB  10-1:634    5.50    (#    634:10  Double Ambig)
 &rst
  ixpk= 634, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.25, r4=10.75,
 igr1=1287,1288,1290,1291,1308,1309,1310,
 igr2= 213, 214, 213, 214, 213, 214,
 &end
#
#    0 AMB  10-2:635      0 AMB  10-1:635    2.80    (#    635:10  Double Ambig)
 &rst
  ixpk= 635, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=  90,  91,  90,  91,
 igr2=  95,  96,  95,  96,
 &end
#
#    0 AMB  10-2:636      6 ASN  HD2-        3.50    (#    636:10  Single Ambig)
 &rst
  ixpk= 636, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=  90,  91,  90,  91,
 igr2=  95,  96,
 &end
#
#   15 ASN  HB+          15 ASN  HD2-        3.50    (#    649:10  Unique         2.15, 3.23 A)
 &rst
  ixpk= 649, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 241, 242,
 igr2= 246, 247,
 &end
#
#   15 ASN  HB-          15 ASN  HD2-        3.50    (#    650:10  Unique         2.15, 3.23 A)
 &rst
  ixpk= 650, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 241, 242,
 igr2= 246, 247,
 &end
#
#    0 AMB  10-2:651     15 ASN  HD2-        3.50    (#    651:10  Single Ambig)
 &rst
  ixpk= 651, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1232,1233, 279, 280, 279, 280,
 igr2= 246, 247,
 &end
#
#    0 AMB  10-2:652      0 AMB  10-1:652    4.50    (#    652:10  Double Ambig)
 &rst
  ixpk= 652, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 279, 280, 279, 280,
 igr2= 246, 247, 246, 247,
 &end
#
#   15 ASN  HB+          15 ASN  HD2+        4.50    (#    653:10  Unique         2.15, 3.23 A)
 &rst
  ixpk= 653, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 241, 242,
 igr2= 246, 247,
 &end
#
#    0 AMB  10-2:660      0 AMB  10-1:660    5.50    (#    660:10  Double Ambig)
 &rst
  ixpk= 660, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 574,1054,
 igr2=1061,1062,1061,1062,
 &end
#
#    0 AMB  10-2:661     64 ASN  HD2-        5.50    (#    661:10  Single Ambig)
 &rst
  ixpk= 661, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 574,1054,
 igr2=1061,1062,
 &end
#
#    0 AMB  10-2:662     64 ASN  HD2-        3.50    (#    662:10  Single Ambig)
 &rst
  ixpk= 662, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1056,1057,1056,1057, 576, 577,
 igr2=1061,1062,
 &end
#
#    0 AMB  10-2:663      0 AMB  10-1:663    2.80    (#    663:10  Double Ambig)
 &rst
  ixpk= 663, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1056,1057,1056,1057, 576, 577,
 igr2=1061,1062,1061,1062,1061,1062,
 &end
#
#    0 AMB  10-2:670     13 ASN  HD2-        3.50    (#    670:10  Single Ambig)
 &rst
  ixpk= 670, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1265,1266,1318,1319,
 igr2= 213, 214,
 &end
#
#   36 GLN  HG+          36 GLN  HE2+        3.50    (#    671:10  Unique         2.15, 3.33 A)
 &rst
  ixpk= 671, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 606, 607,
 igr2= 611, 612,
 &end
#
#   36 GLN  HG-          36 GLN  HE2+        5.50    (#    672:10  Unique         2.15, 3.33 A)
 &rst
  ixpk= 672, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 606, 607,
 igr2= 611, 612,
 &end
#
#   36 GLN  HG+          36 GLN  HE2-        5.50    (#    673:10  Unique         2.15, 3.33 A)
 &rst
  ixpk= 673, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 606, 607,
 igr2= 611, 612,
 &end
#
#    0 AMB  10-2:679     51 GLN  HE2-        3.50    (#    679:10  Single Ambig)
 &rst
  ixpk= 679, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 859, 860, 859, 860, 862, 863,
 igr2= 867, 868,
 &end
#
#    0 AMB  10-2:680      0 AMB  10-1:680    3.50    (#    680:10  Double Ambig)
 &rst
  ixpk= 680, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 859, 860, 859, 860, 862, 863,
 igr2= 867, 868, 867, 868, 867, 868,
 &end
#
#    0 AMB  10-2:687     80 GLN  HE2-        3.50    (#    687:10  Single Ambig)
 &rst
  ixpk= 687, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1321,1322,1321,1322,
 igr2=1326,1327,
 &end
#
#    0 AMB  10-2:688      0 AMB  10-1:688    3.50    (#    688:10  Double Ambig)
 &rst
  ixpk= 688, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1321,1322,1321,1322,
 igr2=1326,1327,1326,1327,
 &end
#
#   38 LEU  QD+           7 GLN  HE2-        3.50    (#    697:10  Unique         2.55, 4.83 A)
 &rst
  ixpk= 697, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 644, 645, 646, 648, 649, 650,
 igr2= 112, 113,
 &end
#
#    7 GLN  HG-           7 GLN  HE2-        5.50    (#    698:10  Unique         2.25, 3.13 A)
 &rst
  ixpk= 698, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 107, 108,
 igr2= 112, 113,
 &end
#
#    7 GLN  HG+           7 GLN  HE2-        3.50    (#    699:10  Unique         2.25, 3.13 A)
 &rst
  ixpk= 699, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 107, 108,
 igr2= 112, 113,
 &end
#
#   57 LYS  HA            7 GLN  HE2-        3.50    (#    700:10  Unique         2.64, 3.67 A)
 &rst
  ixpk= 700, nxpk= 10, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 112, 113,
 &end
#
#   57 LYS  HA            7 GLN  HE2+        3.50    (#    701:10  Unique         2.64, 3.67 A)
 &rst
  ixpk= 701, nxpk= 10, iat= 959,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 112, 113,
 &end
#
#   38 LEU  QD+           7 GLN  HE2+        3.50    (#    702:10  Unique         2.55, 4.83 A)
 &rst
  ixpk= 702, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 644, 645, 646, 648, 649, 650,
 igr2= 112, 113,
 &end
#
#    7 GLN  HG-           7 GLN  HE2+        3.50    (#    703:10  Unique         2.25, 3.13 A)
 &rst
  ixpk= 703, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 107, 108,
 igr2= 112, 113,
 &end
#
#    7 GLN  HG+           7 GLN  HE2+        3.50    (#    704:10  Unique         2.25, 3.13 A)
 &rst
  ixpk= 704, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 107, 108,
 igr2= 112, 113,
 &end
#
#   12 ASN  HB-          12 ASN  HD2-        3.50    (#    711:10  Unique         2.26, 3.41 A)
 &rst
  ixpk= 711, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 194, 195,
 igr2= 199, 200,
 &end
#
#   12 ASN  HB-          12 ASN  HD2+        3.50    (#    712:10  Unique         2.26, 3.41 A)
 &rst
  ixpk= 712, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 194, 195,
 igr2= 199, 200,
 &end
#
#   12 ASN  HB+          12 ASN  HD2+        3.50    (#    713:10  Unique         2.26, 3.41 A)
 &rst
  ixpk= 713, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 194, 195,
 igr2= 199, 200,
 &end
#
#   12 ASN  HB+          12 ASN  HD2-        5.50    (#    714:10  Unique         2.26, 3.41 A)
 &rst
  ixpk= 714, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 194, 195,
 igr2= 199, 200,
 &end
#
#    0 AMB  10-2:719     70 GLN  HE2-        3.50    (#    719:10  Single Ambig)
 &rst
  ixpk= 719, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1157,1158,  43,  44,
 igr2=1162,1163,
 &end
#
#   70 GLN  HB+          70 GLN  HE2-        3.50    (#    720:10  Unique         1.95, 3.97 A)
 &rst
  ixpk= 720, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1154,1155,
 igr2=1162,1163,
 &end
#
#   70 GLN  HB+          70 GLN  HE2+        5.50    (#    721:10  Unique         1.95, 3.97 A)
 &rst
  ixpk= 721, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1154,1155,
 igr2=1162,1163,
 &end
#
#    0 AMB  10-2:722      0 AMB  10-1:722    3.50    (#    722:10  Double Ambig)
 &rst
  ixpk= 722, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1157,1158,  43,  44,
 igr2=1162,1163,1162,1163,
 &end
#
#   70 GLN  HG-          70 GLN  HE2-        3.50    (#    723:10  Unique         2.26, 3.34 A)
 &rst
  ixpk= 723, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1157,1158,
 igr2=1162,1163,
 &end
#
#   70 GLN  HG-          70 GLN  HE2+        4.50    (#    724:10  Unique         2.26, 3.34 A)
 &rst
  ixpk= 724, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1157,1158,
 igr2=1162,1163,
 &end
#
#   81 ILE  HB           70 GLN  HE2-        3.50    (#    725:10  Unique         3.15, 3.97 A)
 &rst
  ixpk= 725, nxpk= 10, iat=1335,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1162,1163,
 &end
#
#    0 AMB  10-2:726      0 AMB  10-1:726    4.50    (#    726:10  Double Ambig)
 &rst
  ixpk= 726, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1335,1080,1081,
 igr2=1162,1163,1162,1163,
 &end
#
#   66 LEU  MDY          70 GLN  HE2+        5.50    (#    727:10  Unique         1.99, 4.95 A)
 &rst
  ixpk= 727, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1162,1163,
 &end
#
#   66 LEU  MDY          70 GLN  HE2-        4.50    (#    728:10  Unique         1.99, 4.95 A)
 &rst
  ixpk= 728, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1162,1163,
 &end
#
#   66 LEU  MDX          70 GLN  HE2-        5.50    (#    729:10  Unique         1.99, 4.95 A)
 &rst
  ixpk= 729, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1162,1163,
 &end
#
#   66 LEU  MDX          70 GLN  HE2+        5.50    (#    730:10  Unique         1.99, 4.95 A)
 &rst
  ixpk= 730, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1085,1086,1087,1089,1090,1091,
 igr2=1162,1163,
 &end
#
#   35 GLY  HA+          35 GLY  HN          4.50    (#    731:10  Unique         2.59, 2.82 A)
 &rst
  ixpk= 731, nxpk= 10, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 594, 595,
 &end
#
#   34 PHE  HA           35 GLY  HN          4.50    (#    732:10  Unique         2.91, 3.33 A)
 &rst
  ixpk= 732, nxpk= 10, iat= 574, 592, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:733     35 GLY  HN          5.50    (#    733:10  Single Ambig)
 &rst
  ixpk= 733, nxpk= 10, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 557, 618,
 &end
#
#   35 GLY  HA-          35 GLY  HN          4.50    (#    734:10  Unique         2.59, 2.82 A)
 &rst
  ixpk= 734, nxpk= 10, iat=  -1, 592, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 594, 595,
 &end
#
#   77 LYS  HN           74 PHE  HN          5.50    (#    735:10  Unique         2.87, 4.25 A)
 &rst
  ixpk= 735, nxpk= 10, iat=1261,1208, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:736     11 ILE  HN          5.50    (#    736:10  Single Ambig)
 &rst
  ixpk= 736, nxpk= 10, iat=  -1, 171, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 154, 155, 154, 155,
 &end
#
#   79 MET  HB-          81 ILE  HN          5.50    (#    737:10  Unique         4.79, 5.40 A)
 &rst
  ixpk= 737, nxpk= 10, iat=  -1,1331, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1301,1302,
 &end
#
#   70 GLN  HE2-         81 ILE  HN          5.50    (#    738:10  Unique         2.13, 3.52 A)
 &rst
  ixpk= 738, nxpk= 10, iat=  -1,1331, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1162,1163,
 &end
#
#   12 ASN  HB+          12 ASN  HN          5.50    (#    739:10  Unique         2.46, 3.24 A)
 &rst
  ixpk= 739, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 194, 195,
 &end
#
#   28 TYR  HN           27 LEU  HN          4.50    (#    740:10  Unique         2.74, 2.83 A)
 &rst
  ixpk= 740, nxpk= 10, iat= 474, 455, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   42 ALA  QB           52 ALA  HN          5.50    (#    741:10  Unique         5.54, 6.68 A)
 &rst
  ixpk= 741, nxpk= 10, iat=  -1, 872, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 705, 706, 707,
 &end
#
#    0 AMB  10-2:742     54 VAL  HN          4.50    (#    742:10  Single Ambig)
 &rst
  ixpk= 742, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 141, 142, 181, 182,
 &end
#
#    8 THR  QG2          54 VAL  HN          5.50    (#    743:10  Unique         2.76, 3.69 A)
 &rst
  ixpk= 743, nxpk= 10, iat=  -1, 902, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 123, 124, 125,
 &end
#
#   56 PHE  QD           57 LYS  HN          5.50    (#    744:10  Unique         3.19, 4.68 A)
 &rst
  ixpk= 744, nxpk= 10, iat=  -1, 957, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 945, 953,
 &end
#
#   72 PHE  HN           71 GLY  HN          5.50    (#    745:10  Unique         2.55, 2.86 A)
 &rst
  ixpk= 745, nxpk= 10, iat=1174,1167, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:748     77 LYS  HN          4.50    (#    748:10  Single Ambig)
 &rst
  ixpk= 748, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1268,1269,1268,1269,
 &end
#
#   77 LYS  HB+          77 LYS  HN          3.50    (#    749:10  Unique         2.60, 3.36 A)
 &rst
  ixpk= 749, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1265,1266,
 &end
#
#   24 LYS  HN           25 LYS  HN          5.50    (#    750:10  Unique         2.81, 2.87 A)
 &rst
  ixpk= 750, nxpk= 10, iat= 400, 422, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    7 GLN  HG+           6 ASN  HN          7.00    (#    751:10  Unique         6.22, 7.04 A)
 &rst
  ixpk= 751, nxpk= 10, iat=  -1,  86, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 107, 108,
 &end
#
#   33 GLN  HN           32 SER  HN          4.50    (#    752:10  Unique         2.58, 2.91 A)
 &rst
  ixpk= 752, nxpk= 10, iat= 555, 544, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 LYS  HG+          24 LYS  HN          4.50    (#    753:10  Unique         2.49, 3.84 A)
 &rst
  ixpk= 753, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 407, 408,
 &end
#
#    0 AMB  10-2:754     24 LYS  HN          4.50    (#    754:10  Single Ambig)
 &rst
  ixpk= 754, nxpk= 10, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 410, 411, 333, 334,
 &end
#
#    0 AMB  10-2:755      7 GLN  HN          5.50    (#    755:10  Single Ambig)
 &rst
  ixpk= 755, nxpk= 10, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1=1004,1005, 137, 138, 139,1007,1008,1009, 924, 925,
       926,
 &end
#
#    6 ASN  HA            7 GLN  HN          4.50    (#    756:10  Unique         2.12, 2.49 A)
 &rst
  ixpk= 756, nxpk= 10, iat=  88, 100, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   61 SER  HA           64 ASN  HD2-        5.50    (#    760:10  Unique         4.26, 5.30 A)
 &rst
  ixpk= 760, nxpk= 10, iat=1022,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1061,1062,
 &end
#
#   80 GLN  HB-          80 GLN  HE2+        4.50    (#    761:10  Unique         2.53, 4.40 A)
 &rst
  ixpk= 761, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1318,1319,
 igr2=1326,1327,
 &end
#
#   80 GLN  HB-          80 GLN  HE2-        5.50    (#    762:10  Unique         2.53, 4.40 A)
 &rst
  ixpk= 762, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1318,1319,
 igr2=1326,1327,
 &end
#
#    0 AMB  10-2:764      0 AMB  10-1:764    5.50    (#    764:10  Double Ambig)
 &rst
  ixpk= 764, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 603, 604, 811, 812, 811, 812,
 igr2= 611, 612, 867, 868, 867, 868,
 &end
#
#    0 AMB  10-2:765     76 ASP  HN          5.50    (#    765:10  Single Ambig)
 &rst
  ixpk= 765, nxpk= 10, iat=  -1,1249, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 279, 280, 279, 280,
 &end
#
#   77 LYS  HN           76 ASP  HN          5.50    (#    766:10  Unique         2.83, 3.18 A)
 &rst
  ixpk= 766, nxpk= 10, iat=1261,1249, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 GLN  HN           52 ALA  HN          5.50    (#    767:10  Unique         4.30, 4.37 A)
 &rst
  ixpk= 767, nxpk= 10, iat= 855, 872, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:769     28 TYR  HN          5.50    (#    769:10  Single Ambig)
 &rst
  ixpk= 769, nxpk= 10, iat=  -1, 474, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 476, 402,
 &end
#
#    0 AMB  10-2:771     62 ALA  HN          5.50    (#    771:10  Single Ambig)
 &rst
  ixpk= 771, nxpk= 10, iat=  -1,1031, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 941, 942, 996,
 &end
#
#    0 AMB  10-2:772      8 THR  HN          5.50    (#    772:10  Single Ambig)
 &rst
  ixpk= 772, nxpk= 10, iat=  -1, 117, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  90,  91,  90,  91,
 &end
#
#    6 ASN  HA            6 ASN  HN          5.50    (#    773:10  Unique         2.63, 2.88 A)
 &rst
  ixpk= 773, nxpk= 10, iat=  88,  86, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   12 ASN  HB-          13 ASN  HN          5.50    (#    774:10  Unique         2.19, 3.98 A)
 &rst
  ixpk= 774, nxpk= 10, iat=  -1, 204, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 194, 195,
 &end
REMARK                                                              
ATOM      1  N   MET     1      -8.042   6.311 -16.874
ATOM      2  H1  MET     1      -8.395   6.479 -17.803
ATOM      3  H2  MET     1      -8.213   5.346 -16.641
ATOM      4  H3  MET     1      -8.539   6.902 -16.227
ATOM      5  CA  MET     1      -6.588   6.591 -16.827
ATOM      6  HA  MET     1      -6.437   7.633 -17.114
ATOM      7  CB  MET     1      -6.022   6.403 -15.402
ATOM      8 2HB  MET     1      -6.599   7.014 -14.704
ATOM      9 3HB  MET     1      -6.121   5.359 -15.103
ATOM     10  CG  MET     1      -4.547   6.823 -15.292
ATOM     11 2HG  MET     1      -3.943   6.216 -15.968
ATOM     12 3HG  MET     1      -4.463   7.863 -15.611
ATOM     13  SD  MET     1      -3.823   6.697 -13.629
ATOM     14  CE  MET     1      -3.700   4.894 -13.447
ATOM     15 1HE  MET     1      -3.105   4.481 -14.262
ATOM     16 2HE  MET     1      -3.219   4.657 -12.497
ATOM     17 3HE  MET     1      -4.695   4.448 -13.461
ATOM     18  C   MET     1      -5.856   5.698 -17.834
ATOM     19  O   MET     1      -6.044   4.480 -17.840
ATOM     20  N   GLU     2      -4.998   6.286 -18.672
ATOM     21  H   GLU     2      -4.843   7.287 -18.623
ATOM     22  CA  GLU     2      -4.113   5.578 -19.593
ATOM     23  HA  GLU     2      -3.943   4.560 -19.240
ATOM     24  CB  GLU     2      -4.713   5.549 -21.012
ATOM     25 2HB  GLU     2      -5.006   6.562 -21.292
ATOM     26 3HB  GLU     2      -3.942   5.229 -21.715
ATOM     27  CG  GLU     2      -5.932   4.625 -21.178
ATOM     28 2HG  GLU     2      -6.735   4.970 -20.525
ATOM     29 3HG  GLU     2      -6.288   4.721 -22.206
ATOM     30  CD  GLU     2      -5.641   3.137 -20.904
ATOM     31  OE1 GLU     2      -6.600   2.343 -20.772
ATOM     32  OE2 GLU     2      -4.463   2.719 -20.869
ATOM     33  C   GLU     2      -2.782   6.330 -19.601
ATOM     34  O   GLU     2      -2.767   7.564 -19.561
ATOM     35  N   MET     3      -1.669   5.594 -19.616
ATOM     36  H   MET     3      -1.729   4.581 -19.600
ATOM     37  CA  MET     3      -0.325   6.164 -19.618
ATOM     38  HA  MET     3      -0.280   6.947 -18.860
ATOM     39  CB  MET     3       0.697   5.072 -19.262
ATOM     40 2HB  MET     3       0.814   4.382 -20.099
ATOM     41 3HB  MET     3       1.661   5.546 -19.086
ATOM     42  CG  MET     3       0.296   4.279 -18.008
ATOM     43 2HG  MET     3       1.201   3.935 -17.519
ATOM     44 3HG  MET     3      -0.216   4.943 -17.310
ATOM     45  SD  MET     3      -0.756   2.832 -18.350
ATOM     46  CE  MET     3      -1.144   2.302 -16.663
ATOM     47 1HE  MET     3      -0.224   2.051 -16.136
ATOM     48 2HE  MET     3      -1.662   3.105 -16.138
ATOM     49 3HE  MET     3      -1.789   1.423 -16.698
ATOM     50  C   MET     3       0.001   6.791 -20.979
ATOM     51  O   MET     3      -0.644   6.478 -21.985
ATOM     52  N   LEU     4       1.032   7.643 -21.024
ATOM     53  H   LEU     4       1.579   7.810 -20.189
ATOM     54  CA  LEU     4       1.528   8.262 -22.254
ATOM     55  HA  LEU     4       0.882   7.984 -23.083
ATOM     56  CB  LEU     4       1.535   9.800 -22.152
ATOM     57 2HB  LEU     4       1.921  10.101 -21.179
ATOM     58 3HB  LEU     4       2.238  10.167 -22.902
ATOM     59  CG  LEU     4       0.182  10.491 -22.420
ATOM     60  HG  LEU     4      -0.205  10.137 -23.375
ATOM     61  CD1 LEU     4      -0.880  10.227 -21.347
ATOM     62 1HD1 LEU     4      -1.203   9.189 -21.389
ATOM     63 2HD1 LEU     4      -0.481  10.443 -20.356
ATOM     64 3HD1 LEU     4      -1.756  10.850 -21.525
ATOM     65  CD2 LEU     4       0.403  12.006 -22.524
ATOM     66 1HD2 LEU     4      -0.537  12.505 -22.763
ATOM     67 2HD2 LEU     4       0.789  12.396 -21.581
ATOM     68 3HD2 LEU     4       1.117  12.223 -23.319
ATOM     69  C   LEU     4       2.956   7.751 -22.501
ATOM     70  O   LEU     4       3.693   7.553 -21.533
ATOM     71  N   PRO     5       3.370   7.534 -23.763
ATOM     72  CD  PRO     5       2.553   7.584 -24.969
ATOM     73 2HD  PRO     5       2.443   8.620 -25.290
ATOM     74 3HD  PRO     5       1.577   7.124 -24.819
ATOM     75  CG  PRO     5       3.321   6.788 -26.021
ATOM     76 2HG  PRO     5       3.124   7.150 -27.030
ATOM     77 3HG  PRO     5       3.071   5.729 -25.933
ATOM     78  CB  PRO     5       4.773   6.998 -25.615
ATOM     79 2HB  PRO     5       5.135   7.936 -26.039
ATOM     80 3HB  PRO     5       5.390   6.163 -25.940
ATOM     81  CA  PRO     5       4.719   7.088 -24.087
ATOM     82  HA  PRO     5       4.857   6.091 -23.675
ATOM     83  C   PRO     5       5.824   8.002 -23.546
ATOM     84  O   PRO     5       5.764   9.228 -23.666
ATOM     85  N   ASN     6       6.865   7.373 -23.000
ATOM     86  H   ASN     6       6.831   6.362 -22.923
ATOM     87  CA  ASN     6       8.146   7.951 -22.605
ATOM     88  HA  ASN     6       8.454   8.697 -23.340
ATOM     89  CB  ASN     6       8.084   8.587 -21.205
ATOM     90 2HB  ASN     6       7.279   9.321 -21.162
ATOM     91 3HB  ASN     6       7.896   7.819 -20.455
ATOM     92  CG  ASN     6       9.404   9.274 -20.887
ATOM     93  OD1 ASN     6      10.321   8.672 -20.342
ATOM     94  ND2 ASN     6       9.563  10.520 -21.297
ATOM     95 1HD2 ASN     6      10.444  10.980 -21.145
ATOM     96 2HD2 ASN     6       8.808  11.016 -21.751
ATOM     97  C   ASN     6       9.125   6.775 -22.600
ATOM     98  O   ASN     6       8.700   5.654 -22.324
ATOM     99  N   GLN     7      10.408   6.979 -22.917
ATOM    100  H   GLN     7      10.743   7.912 -23.116
ATOM    101  CA  GLN     7      11.355   5.863 -23.010
ATOM    102  HA  GLN     7      10.874   5.086 -23.608
ATOM    103  CB  GLN     7      12.631   6.308 -23.751
ATOM    104 2HB  GLN     7      12.350   6.919 -24.609
ATOM    105 3HB  GLN     7      13.256   6.906 -23.085
ATOM    106  CG  GLN     7      13.428   5.096 -24.267
ATOM    107 2HG  GLN     7      13.791   4.519 -23.419
ATOM    108 3HG  GLN     7      12.762   4.456 -24.849
ATOM    109  CD  GLN     7      14.640   5.437 -25.134
ATOM    110  OE1 GLN     7      14.936   6.589 -25.446
ATOM    111  NE2 GLN     7      15.373   4.414 -25.540
ATOM    112 1HE2 GLN     7      16.186   4.557 -26.119
ATOM    113 2HE2 GLN     7      15.100   3.472 -25.256
ATOM    114  C   GLN     7      11.664   5.246 -21.634
ATOM    115  O   GLN     7      12.193   4.134 -21.571
ATOM    116  N   THR     8      11.325   5.928 -20.540
ATOM    117  H   THR     8      10.838   6.812 -20.624
ATOM    118  CA  THR     8      11.613   5.493 -19.184
ATOM    119  HA  THR     8      12.093   4.517 -19.213
ATOM    120  CB  THR     8      12.587   6.490 -18.525
ATOM    121  HB  THR     8      12.052   7.408 -18.294
ATOM    122  CG2 THR     8      13.220   5.952 -17.237
ATOM    123 1HG2 THR     8      13.739   5.019 -17.435
ATOM    124 2HG2 THR     8      13.924   6.683 -16.839
ATOM    125 3HG2 THR     8      12.453   5.771 -16.487
ATOM    126  OG1 THR     8      13.642   6.820 -19.415
ATOM    127 1HG  THR     8      13.274   7.369 -20.122
ATOM    128  C   THR     8      10.289   5.353 -18.431
ATOM    129  O   THR     8       9.318   6.077 -18.687
ATOM    130  N   ILE     9      10.255   4.402 -17.501
ATOM    131  H   ILE     9      11.092   3.853 -17.327
ATOM    132  CA  ILE     9       9.136   4.160 -16.608
ATOM    133  HA  ILE     9       8.445   5.000 -16.677
ATOM    134  CB  ILE     9       8.358   2.876 -17.009
ATOM    135  HB  ILE     9       7.445   2.847 -16.412
ATOM    136  CG2 ILE     9       7.951   2.924 -18.496
ATOM    137 1HG2 ILE     9       7.318   2.076 -18.750
ATOM    138 2HG2 ILE     9       7.410   3.847 -18.703
ATOM    139 3HG2 ILE     9       8.835   2.871 -19.131
ATOM    140  CG1 ILE     9       9.151   1.585 -16.719
ATOM    141 2HG1 ILE     9      10.060   1.590 -17.319
ATOM    142 3HG1 ILE     9       9.428   1.569 -15.665
ATOM    143  CD1 ILE     9       8.391   0.281 -17.004
ATOM    144 1HD1 ILE     9       7.416   0.303 -16.519
ATOM    145 2HD1 ILE     9       8.264   0.137 -18.077
ATOM    146 3HD1 ILE     9       8.964  -0.558 -16.609
ATOM    147  C   ILE     9       9.694   4.149 -15.181
ATOM    148  O   ILE     9      10.885   3.898 -14.961
ATOM    149  N   TYR    10       8.819   4.412 -14.219
ATOM    150  H   TYR    10       7.842   4.525 -14.475
ATOM    151  CA  TYR    10       9.123   4.588 -12.811
ATOM    152  HA  TYR    10      10.174   4.374 -12.614
ATOM    153  CB  TYR    10       8.812   6.036 -12.406
ATOM    154 2HB  TYR    10       9.538   6.696 -12.880
ATOM    155 3HB  TYR    10       7.829   6.302 -12.798
ATOM    156  CG  TYR    10       8.824   6.294 -10.909
ATOM    157  CD1 TYR    10       7.656   6.740 -10.259
ATOM    158  HD1 TYR    10       6.743   6.891 -10.819
ATOM    159  CE1 TYR    10       7.673   7.017  -8.881
ATOM    160  HE1 TYR    10       6.777   7.375  -8.393
ATOM    161  CZ  TYR    10       8.860   6.831  -8.136
ATOM    162  OH  TYR    10       8.864   7.101  -6.799
ATOM    163  HH  TYR    10       9.725   6.957  -6.379
ATOM    164  CE2 TYR    10      10.026   6.358  -8.783
ATOM    165  HE2 TYR    10      10.941   6.205  -8.230
ATOM    166  CD2 TYR    10      10.001   6.092 -10.163
ATOM    167  HD2 TYR    10      10.900   5.741 -10.651
ATOM    168  C   TYR    10       8.244   3.608 -12.054
ATOM    169  O   TYR    10       7.045   3.531 -12.315
ATOM    170  N   ILE    11       8.836   2.864 -11.129
ATOM    171  H   ILE    11       9.809   3.059 -10.905
ATOM    172  CA  ILE    11       8.217   1.797 -10.358
ATOM    173  HA  ILE    11       7.169   1.685 -10.639
ATOM    174  CB  ILE    11       8.974   0.472 -10.631
ATOM    175  HB  ILE    11      10.028   0.639 -10.404
ATOM    176  CG2 ILE    11       8.466  -0.655  -9.714
ATOM    177 1HG2 ILE    11       9.065  -1.552  -9.860
ATOM    178 2HG2 ILE    11       8.569  -0.372  -8.667
ATOM    179 3HG2 ILE    11       7.419  -0.875  -9.927
ATOM    180  CG1 ILE    11       8.860   0.039 -12.115
ATOM    181 2HG1 ILE    11       7.843  -0.297 -12.312
ATOM    182 3HG1 ILE    11       9.069   0.889 -12.765
ATOM    183  CD1 ILE    11       9.827  -1.076 -12.533
ATOM    184 1HD1 ILE    11       9.731  -1.246 -13.607
ATOM    185 2HD1 ILE    11      10.853  -0.781 -12.313
ATOM    186 3HD1 ILE    11       9.594  -2.004 -12.015
ATOM    187  C   ILE    11       8.325   2.259  -8.905
ATOM    188  O   ILE    11       9.369   2.784  -8.513
ATOM    189  N   ASN    12       7.264   2.086  -8.111
ATOM    190  H   ASN    12       6.420   1.676  -8.507
ATOM    191  CA  ASN    12       7.172   2.677  -6.771
ATOM    192  HA  ASN    12       8.186   2.803  -6.391
ATOM    193  CB  ASN    12       6.548   4.084  -6.859
ATOM    194 2HB  ASN    12       6.620   4.566  -5.883
ATOM    195 3HB  ASN    12       7.142   4.682  -7.547
ATOM    196  CG  ASN    12       5.087   4.090  -7.301
ATOM    197  OD1 ASN    12       4.170   3.938  -6.500
ATOM    198  ND2 ASN    12       4.833   4.289  -8.586
ATOM    199 1HD2 ASN    12       3.879   4.338  -8.908
ATOM    200 2HD2 ASN    12       5.589   4.422  -9.243
ATOM    201  C   ASN    12       6.457   1.791  -5.742
ATOM    202  O   ASN    12       6.057   2.295  -4.690
ATOM    203  N   ASN    13       6.309   0.481  -5.997
ATOM    204  H   ASN    13       6.697   0.093  -6.841
ATOM    205  CA  ASN    13       5.811  -0.463  -4.991
ATOM    206  HA  ASN    13       6.081  -0.045  -4.024
ATOM    207  CB  ASN    13       4.277  -0.582  -5.037
ATOM    208 2HB  ASN    13       3.839   0.413  -5.111
ATOM    209 3HB  ASN    13       3.983  -1.158  -5.915
ATOM    210  CG  ASN    13       3.727  -1.231  -3.764
ATOM    211  OD1 ASN    13       4.155  -0.921  -2.656
ATOM    212  ND2 ASN    13       2.748  -2.112  -3.875
ATOM    213 1HD2 ASN    13       2.337  -2.516  -3.049
ATOM    214 2HD2 ASN    13       2.450  -2.438  -4.796
ATOM    215  C   ASN    13       6.514  -1.825  -5.058
ATOM    216  O   ASN    13       5.870  -2.872  -4.963
ATOM    217  N   LEU    14       7.835  -1.827  -5.281
ATOM    218  H   LEU    14       8.324  -0.937  -5.289
ATOM    219  CA  LEU    14       8.634  -3.049  -5.134
ATOM    220  HA  LEU    14       8.216  -3.840  -5.757
ATOM    221  CB  LEU    14      10.113  -2.806  -5.501
ATOM    222 2HB  LEU    14      10.433  -1.887  -5.017
ATOM    223 3HB  LEU    14      10.722  -3.609  -5.081
ATOM    224  CG  LEU    14      10.422  -2.710  -7.001
ATOM    225  HG  LEU    14       9.689  -2.072  -7.478
ATOM    226  CD1 LEU    14      11.793  -2.061  -7.205
ATOM    227 1HD1 LEU    14      11.969  -1.914  -8.269
ATOM    228 2HD1 LEU    14      11.819  -1.083  -6.723
ATOM    229 3HD1 LEU    14      12.578  -2.687  -6.781
ATOM    230  CD2 LEU    14      10.370  -4.079  -7.684
ATOM    231 1HD2 LEU    14      10.570  -3.961  -8.749
ATOM    232 2HD2 LEU    14      11.110  -4.752  -7.249
ATOM    233 3HD2 LEU    14       9.378  -4.512  -7.570
ATOM    234  C   LEU    14       8.574  -3.481  -3.667
ATOM    235  O   LEU    14       8.426  -2.637  -2.778
ATOM    236  N   ASN    15       8.725  -4.782  -3.399
ATOM    237  H   ASN    15       8.898  -5.432  -4.152
ATOM    238  CA  ASN    15       8.915  -5.243  -2.028
ATOM    239  HA  ASN    15       8.189  -4.755  -1.377
ATOM    240  CB  ASN    15       8.732  -6.763  -1.901
ATOM    241 2HB  ASN    15       7.756  -7.029  -2.311
ATOM    242 3HB  ASN    15       9.496  -7.284  -2.479
ATOM    243  CG  ASN    15       8.816  -7.216  -0.442
ATOM    244  OD1 ASN    15       9.704  -6.821   0.306
ATOM    245  ND2 ASN    15       7.892  -8.049   0.006
ATOM    246 1HD2 ASN    15       7.915  -8.342   0.972
ATOM    247 2HD2 ASN    15       7.152  -8.380  -0.595
ATOM    248  C   ASN    15      10.321  -4.802  -1.627
ATOM    249  O   ASN    15      11.299  -5.173  -2.274
ATOM    250  N   GLU    16      10.426  -3.993  -0.580
ATOM    251  H   GLU    16       9.578  -3.741  -0.078
ATOM    252  CA  GLU    16      11.662  -3.367  -0.142
ATOM    253  HA  GLU    16      12.043  -2.805  -0.994
ATOM    254  CB  GLU    16      11.377  -2.357   0.987
ATOM    255 2HB  GLU    16      12.333  -1.961   1.333
ATOM    256 3HB  GLU    16      10.814  -1.517   0.578
ATOM    257  CG  GLU    16      10.619  -2.927   2.203
ATOM    258 2HG  GLU    16      10.842  -3.989   2.319
ATOM    259 3HG  GLU    16      10.994  -2.421   3.095
ATOM    260  CD  GLU    16       9.093  -2.718   2.121
ATOM    261  OE1 GLU    16       8.533  -1.993   2.975
ATOM    262  OE2 GLU    16       8.437  -3.285   1.217
ATOM    263  C   GLU    16      12.766  -4.365   0.242
ATOM    264  O   GLU    16      13.935  -3.979   0.286
ATOM    265  N   LYS    17      12.458  -5.645   0.491
ATOM    266  H   LYS    17      11.489  -5.947   0.458
ATOM    267  CA  LYS    17      13.496  -6.641   0.762
ATOM    268  HA  LYS    17      14.096  -6.250   1.578
ATOM    269  CB  LYS    17      12.880  -7.951   1.272
ATOM    270 2HB  LYS    17      13.657  -8.507   1.798
ATOM    271 3HB  LYS    17      12.100  -7.709   1.997
ATOM    272  CG  LYS    17      12.306  -8.861   0.176
ATOM    273 2HG  LYS    17      11.648  -8.295  -0.483
ATOM    274 3HG  LYS    17      13.123  -9.278  -0.414
ATOM    275  CD  LYS    17      11.527 -10.005   0.828
ATOM    276 2HD  LYS    17      12.203 -10.544   1.494
ATOM    277 3HD  LYS    17      10.711  -9.581   1.416
ATOM    278  CE  LYS    17      10.968 -10.957  -0.238
ATOM    279 2HE  LYS    17      10.286 -10.401  -0.885
ATOM    280 3HE  LYS    17      11.795 -11.323  -0.851
ATOM    281  NZ  LYS    17      10.253 -12.112   0.363
ATOM    282 1HZ  LYS    17       9.894 -12.725  -0.355
ATOM    283 2HZ  LYS    17      10.868 -12.659   0.947
ATOM    284 3HZ  LYS    17       9.471 -11.811   0.926
ATOM    285  C   LYS    17      14.419  -6.861  -0.442
ATOM    286  O   LYS    17      15.583  -7.216  -0.252
ATOM    287  N   ILE    18      13.914  -6.654  -1.660
ATOM    288  H   ILE    18      12.982  -6.263  -1.739
ATOM    289  CA  ILE    18      14.599  -6.967  -2.907
ATOM    290  HA  ILE    18      14.938  -8.001  -2.861
ATOM    291  CB  ILE    18      13.581  -6.824  -4.066
ATOM    292  HB  ILE    18      13.196  -5.803  -4.049
ATOM    293  CG2 ILE    18      14.189  -7.031  -5.459
ATOM    294 1HG2 ILE    18      15.002  -6.326  -5.622
ATOM    295 2HG2 ILE    18      14.558  -8.047  -5.565
ATOM    296 3HG2 ILE    18      13.431  -6.854  -6.224
ATOM    297  CG1 ILE    18      12.377  -7.786  -3.901
ATOM    298 2HG1 ILE    18      11.798  -7.494  -3.029
ATOM    299 3HG1 ILE    18      11.721  -7.672  -4.764
ATOM    300  CD1 ILE    18      12.720  -9.274  -3.730
ATOM    301 1HD1 ILE    18      13.274  -9.644  -4.591
ATOM    302 2HD1 ILE    18      13.306  -9.435  -2.827
ATOM    303 3HD1 ILE    18      11.796  -9.842  -3.631
ATOM    304  C   ILE    18      15.841  -6.076  -3.035
ATOM    305  O   ILE    18      15.745  -4.847  -2.970
ATOM    306  N   LYS    19      17.013  -6.701  -3.189
ATOM    307  H   LYS    19      17.018  -7.722  -3.209
ATOM    308  CA  LYS    19      18.286  -6.014  -3.427
ATOM    309  HA  LYS    19      18.393  -5.212  -2.694
ATOM    310  CB  LYS    19      19.451  -7.011  -3.275
ATOM    311 2HB  LYS    19      19.306  -7.835  -3.973
ATOM    312 3HB  LYS    19      20.387  -6.512  -3.533
ATOM    313  CG  LYS    19      19.585  -7.569  -1.849
ATOM    314 2HG  LYS    19      19.814  -6.751  -1.166
ATOM    315 3HG  LYS    19      18.647  -8.031  -1.543
ATOM    316  CD  LYS    19      20.702  -8.621  -1.778
ATOM    317 2HD  LYS    19      20.480  -9.425  -2.483
ATOM    318 3HD  LYS    19      21.652  -8.158  -2.051
ATOM    319  CE  LYS    19      20.798  -9.200  -0.359
ATOM    320 2HE  LYS    19      21.018  -8.389   0.339
ATOM    321 3HE  LYS    19      19.829  -9.627  -0.088
ATOM    322  NZ  LYS    19      21.845 -10.246  -0.249
ATOM    323 1HZ  LYS    19      22.758  -9.879  -0.473
ATOM    324 2HZ  LYS    19      21.887 -10.609   0.693
ATOM    325 3HZ  LYS    19      21.656 -11.023  -0.864
ATOM    326  C   LYS    19      18.298  -5.399  -4.829
ATOM    327  O   LYS    19      17.520  -5.802  -5.695
ATOM    328  N   LYS    20      19.253  -4.499  -5.096
ATOM    329  H   LYS    20      19.894  -4.241  -4.360
ATOM    330  CA  LYS    20      19.454  -3.920  -6.430
ATOM    331  HA  LYS    20      18.551  -3.372  -6.706
ATOM    332  CB  LYS    20      20.654  -2.953  -6.410
ATOM    333 2HB  LYS    20      20.491  -2.193  -5.645
ATOM    334 3HB  LYS    20      21.556  -3.516  -6.157
ATOM    335  CG  LYS    20      20.863  -2.256  -7.767
ATOM    336 2HG  LYS    20      20.949  -3.002  -8.557
ATOM    337 3HG  LYS    20      19.997  -1.628  -7.984
ATOM    338  CD  LYS    20      22.142  -1.407  -7.771
ATOM    339 2HD  LYS    20      22.060  -0.620  -7.021
ATOM    340 3HD  LYS    20      22.994  -2.044  -7.526
ATOM    341  CE  LYS    20      22.357  -0.784  -9.159
ATOM    342 2HE  LYS    20      22.403  -1.585  -9.901
ATOM    343 3HE  LYS    20      21.497  -0.152  -9.395
ATOM    344  NZ  LYS    20      23.599   0.027  -9.231
ATOM    345 1HZ  LYS    20      23.723   0.407 -10.158
ATOM    346 2HZ  LYS    20      23.570   0.802  -8.586
ATOM    347 3HZ  LYS    20      24.415  -0.531  -9.022
ATOM    348  C   LYS    20      19.672  -5.024  -7.460
ATOM    349  O   LYS    20      19.070  -4.988  -8.528
ATOM    350  N   GLU    21      20.520  -6.002  -7.139
ATOM    351  H   GLU    21      21.014  -5.953  -6.260
ATOM    352  CA  GLU    21      20.842  -7.103  -8.039
ATOM    353  HA  GLU    21      21.230  -6.694  -8.973
ATOM    354  CB  GLU    21      21.936  -7.956  -7.380
ATOM    355 2HB  GLU    21      22.832  -7.340  -7.292
ATOM    356 3HB  GLU    21      21.617  -8.239  -6.376
ATOM    357  CG  GLU    21      22.269  -9.229  -8.170
ATOM    358 2HG  GLU    21      21.406  -9.901  -8.142
ATOM    359 3HG  GLU    21      22.460  -8.964  -9.213
ATOM    360  CD  GLU    21      23.495  -9.952  -7.584
ATOM    361  OE1 GLU    21      24.636  -9.679  -8.023
ATOM    362  OE2 GLU    21      23.332 -10.814  -6.691
ATOM    363  C   GLU    21      19.586  -7.916  -8.356
ATOM    364  O   GLU    21      19.362  -8.287  -9.507
ATOM    365  N   GLU    22      18.745  -8.167  -7.352
ATOM    366  H   GLU    22      18.939  -7.790  -6.436
ATOM    367  CA  GLU    22      17.537  -8.960  -7.523
ATOM    368  HA  GLU    22      17.798  -9.881  -8.042
ATOM    369  CB  GLU    22      16.952  -9.318  -6.153
ATOM    370 2HB  GLU    22      16.796  -8.399  -5.591
ATOM    371 3HB  GLU    22      15.991  -9.814  -6.297
ATOM    372  CG  GLU    22      17.862 -10.252  -5.344
ATOM    373 2HG  GLU    22      17.994 -11.182  -5.902
ATOM    374 3HG  GLU    22      18.848  -9.798  -5.224
ATOM    375  CD  GLU    22      17.266 -10.543  -3.956
ATOM    376  OE1 GLU    22      17.085 -11.735  -3.611
ATOM    377  OE2 GLU    22      16.991  -9.581  -3.204
ATOM    378  C   GLU    22      16.522  -8.197  -8.380
ATOM    379  O   GLU    22      15.921  -8.780  -9.282
ATOM    380  N   LEU    23      16.374  -6.886  -8.161
ATOM    381  H   LEU    23      16.893  -6.465  -7.396
ATOM    382  CA  LEU    23      15.578  -5.998  -9.008
ATOM    383  HA  LEU    23      14.554  -6.377  -9.040
ATOM    384  CB  LEU    23      15.580  -4.583  -8.367
ATOM    385 2HB  LEU    23      14.914  -4.623  -7.500
ATOM    386 3HB  LEU    23      16.577  -4.366  -7.988
ATOM    387  CG  LEU    23      15.135  -3.356  -9.190
ATOM    388  HG  LEU    23      15.089  -2.512  -8.499
ATOM    389  CD1 LEU    23      16.123  -2.924 -10.278
ATOM    390 1HD1 LEU    23      16.107  -3.605 -11.118
ATOM    391 2HD1 LEU    23      15.851  -1.933 -10.643
ATOM    392 3HD1 LEU    23      17.135  -2.887  -9.873
ATOM    393  CD2 LEU    23      13.737  -3.568  -9.770
ATOM    394 1HD2 LEU    23      13.371  -2.641 -10.212
ATOM    395 2HD2 LEU    23      13.759  -4.345 -10.528
ATOM    396 3HD2 LEU    23      13.059  -3.885  -8.979
ATOM    397  C   LEU    23      16.105  -6.050 -10.444
ATOM    398  O   LEU    23      15.324  -6.235 -11.378
ATOM    399  N   LYS    24      17.423  -5.940 -10.641
ATOM    400  H   LYS    24      18.025  -5.787  -9.837
ATOM    401  CA  LYS    24      18.021  -5.946 -11.973
ATOM    402  HA  LYS    24      17.565  -5.140 -12.547
ATOM    403  CB  LYS    24      19.534  -5.683 -11.860
ATOM    404 2HB  LYS    24      19.695  -4.804 -11.235
ATOM    405 3HB  LYS    24      20.016  -6.537 -11.384
ATOM    406  CG  LYS    24      20.169  -5.422 -13.235
ATOM    407 2HG  LYS    24      19.999  -6.276 -13.893
ATOM    408 3HG  LYS    24      19.687  -4.548 -13.675
ATOM    409  CD  LYS    24      21.679  -5.145 -13.160
ATOM    410 2HD  LYS    24      22.015  -4.833 -14.150
ATOM    411 3HD  LYS    24      21.860  -4.326 -12.461
ATOM    412  CE  LYS    24      22.476  -6.387 -12.729
ATOM    413 2HE  LYS    24      22.166  -6.683 -11.725
ATOM    414 3HE  LYS    24      22.241  -7.208 -13.411
ATOM    415  NZ  LYS    24      23.942  -6.145 -12.742
ATOM    416 1HZ  LYS    24      24.264  -5.897 -13.666
ATOM    417 2HZ  LYS    24      24.199  -5.403 -12.109
ATOM    418 3HZ  LYS    24      24.444  -6.974 -12.460
ATOM    419  C   LYS    24      17.706  -7.261 -12.682
ATOM    420  O   LYS    24      17.224  -7.245 -13.818
ATOM    421  N   LYS    25      17.933  -8.398 -12.016
ATOM    422  H   LYS    25      18.329  -8.356 -11.080
ATOM    423  CA  LYS    25      17.659  -9.702 -12.608
ATOM    424  HA  LYS    25      18.173  -9.754 -13.569
ATOM    425  CB  LYS    25      18.164 -10.847 -11.718
ATOM    426 2HB  LYS    25      17.845 -10.692 -10.686
ATOM    427 3HB  LYS    25      17.709 -11.769 -12.080
ATOM    428  CG  LYS    25      19.695 -10.985 -11.782
ATOM    429 2HG  LYS    25      20.022 -10.962 -12.822
ATOM    430 3HG  LYS    25      20.151 -10.139 -11.267
ATOM    431  CD  LYS    25      20.197 -12.286 -11.139
ATOM    432 2HD  LYS    25      21.286 -12.241 -11.086
ATOM    433 3HD  LYS    25      19.803 -12.364 -10.124
ATOM    434  CE  LYS    25      19.784 -13.520 -11.964
ATOM    435 2HE  LYS    25      18.694 -13.580 -12.006
ATOM    436 3HE  LYS    25      20.145 -13.396 -12.988
ATOM    437  NZ  LYS    25      20.326 -14.781 -11.397
ATOM    438 1HZ  LYS    25      19.991 -14.935 -10.458
ATOM    439 2HZ  LYS    25      20.043 -15.573 -11.955
ATOM    440 3HZ  LYS    25      21.335 -14.770 -11.376
ATOM    441  C   LYS    25      16.175  -9.870 -12.892
ATOM    442  O   LYS    25      15.842 -10.327 -13.979
ATOM    443  N   SER    26      15.282  -9.517 -11.968
ATOM    444  H   SER    26      15.601  -9.151 -11.079
ATOM    445  CA  SER    26      13.851  -9.739 -12.167
ATOM    446  HA  SER    26      13.728 -10.777 -12.444
ATOM    447  CB  SER    26      13.072  -9.564 -10.860
ATOM    448 2HB  SER    26      12.004  -9.548 -11.075
ATOM    449 3HB  SER    26      13.273 -10.434 -10.234
ATOM    450  OG  SER    26      13.436  -8.401 -10.139
ATOM    451  HG  SER    26      14.363  -8.504  -9.844
ATOM    452  C   SER    26      13.305  -8.903 -13.329
ATOM    453  O   SER    26      12.502  -9.391 -14.130
ATOM    454  N   LEU    27      13.789  -7.668 -13.476
ATOM    455  H   LEU    27      14.422  -7.311 -12.766
ATOM    456  CA  LEU    27      13.459  -6.815 -14.612
ATOM    457  HA  LEU    27      12.376  -6.725 -14.677
ATOM    458  CB  LEU    27      14.089  -5.426 -14.429
ATOM    459 2HB  LEU    27      15.087  -5.555 -14.012
ATOM    460 3HB  LEU    27      14.207  -4.968 -15.406
ATOM    461  CG  LEU    27      13.294  -4.453 -13.545
ATOM    462  HG  LEU    27      13.140  -4.899 -12.565
ATOM    463  CD1 LEU    27      14.085  -3.154 -13.400
ATOM    464 1HD1 LEU    27      15.064  -3.386 -12.996
ATOM    465 2HD1 LEU    27      14.207  -2.677 -14.371
ATOM    466 3HD1 LEU    27      13.574  -2.472 -12.720
ATOM    467  CD2 LEU    27      11.934  -4.088 -14.134
ATOM    468 1HD2 LEU    27      12.050  -3.759 -15.167
ATOM    469 2HD2 LEU    27      11.278  -4.950 -14.085
ATOM    470 3HD2 LEU    27      11.478  -3.291 -13.550
ATOM    471  C   LEU    27      13.952  -7.449 -15.911
ATOM    472  O   LEU    27      13.176  -7.581 -16.858
ATOM    473  N   TYR    28      15.215  -7.878 -15.964
ATOM    474  H   TYR    28      15.829  -7.737 -15.167
ATOM    475  CA  TYR    28      15.753  -8.537 -17.149
ATOM    476  HA  TYR    28      15.653  -7.853 -17.992
ATOM    477  CB  TYR    28      17.245  -8.825 -16.941
ATOM    478 2HB  TYR    28      17.753  -7.891 -16.694
ATOM    479 3HB  TYR    28      17.366  -9.498 -16.091
ATOM    480  CG  TYR    28      17.923  -9.429 -18.156
ATOM    481  CD1 TYR    28      18.223  -8.618 -19.268
ATOM    482  HD1 TYR    28      17.981  -7.563 -19.253
ATOM    483  CE1 TYR    28      18.835  -9.174 -20.406
ATOM    484  HE1 TYR    28      19.064  -8.544 -21.255
ATOM    485  CZ  TYR    28      19.150 -10.552 -20.438
ATOM    486  OH  TYR    28      19.743 -11.079 -21.547
ATOM    487  HH  TYR    28      19.919 -12.032 -21.472
ATOM    488  CE2 TYR    28      18.846 -11.366 -19.321
ATOM    489  HE2 TYR    28      19.080 -12.422 -19.332
ATOM    490  CD2 TYR    28      18.235 -10.803 -18.187
ATOM    491  HD2 TYR    28      18.002 -11.434 -17.339
ATOM    492  C   TYR    28      14.968  -9.818 -17.473
ATOM    493  O   TYR    28      14.700 -10.104 -18.641
ATOM    494  N   ALA    29      14.572 -10.576 -16.446
ATOM    495  H   ALA    29      14.852 -10.303 -15.511
ATOM    496  CA  ALA    29      13.888 -11.849 -16.592
ATOM    497  HA  ALA    29      14.473 -12.470 -17.273
ATOM    498  CB  ALA    29      13.834 -12.569 -15.240
ATOM    499 1HB  ALA    29      13.285 -11.973 -14.513
ATOM    500 2HB  ALA    29      13.331 -13.530 -15.361
ATOM    501 3HB  ALA    29      14.846 -12.747 -14.874
ATOM    502  C   ALA    29      12.473 -11.681 -17.156
ATOM    503  O   ALA    29      12.088 -12.473 -18.017
ATOM    504  N   ILE    30      11.708 -10.672 -16.705
ATOM    505  H   ILE    30      12.084 -10.070 -15.977
ATOM    506  CA  ILE    30      10.276 -10.569 -17.017
ATOM    507  HA  ILE    30       9.989 -11.418 -17.638
ATOM    508  CB  ILE    30       9.406 -10.644 -15.733
ATOM    509  HB  ILE    30       9.504  -9.693 -15.211
ATOM    510  CG2 ILE    30       7.918 -10.788 -16.105
ATOM    511 1HG2 ILE    30       7.746 -11.732 -16.623
ATOM    512 2HG2 ILE    30       7.292 -10.744 -15.214
ATOM    513 3HG2 ILE    30       7.614  -9.962 -16.746
ATOM    514  CG1 ILE    30       9.851 -11.794 -14.792
ATOM    515 2HG1 ILE    30       9.846 -12.733 -15.348
ATOM    516 3HG1 ILE    30      10.870 -11.606 -14.458
ATOM    517  CD1 ILE    30       9.004 -11.977 -13.526
ATOM    518 1HD1 ILE    30       8.012 -12.350 -13.778
ATOM    519 2HD1 ILE    30       9.489 -12.704 -12.873
ATOM    520 3HD1 ILE    30       8.918 -11.030 -12.995
ATOM    521  C   ILE    30       9.968  -9.300 -17.812
ATOM    522  O   ILE    30       9.345  -9.393 -18.866
ATOM    523  N   PHE    31      10.391  -8.119 -17.356
ATOM    524  H   PHE    31      11.030  -8.078 -16.574
ATOM    525  CA  PHE    31      10.005  -6.863 -18.002
ATOM    526  HA  PHE    31       8.917  -6.840 -18.075
ATOM    527  CB  PHE    31      10.441  -5.657 -17.158
ATOM    528 2HB  PHE    31      11.346  -5.897 -16.607
ATOM    529 3HB  PHE    31      10.706  -4.845 -17.827
ATOM    530  CG  PHE    31       9.408  -5.140 -16.175
ATOM    531  CD1 PHE    31       9.030  -5.917 -15.064
ATOM    532  HD1 PHE    31       9.443  -6.905 -14.922
ATOM    533  CE1 PHE    31       8.143  -5.393 -14.108
ATOM    534  HE1 PHE    31       7.871  -5.987 -13.248
ATOM    535  CZ  PHE    31       7.613  -4.101 -14.270
ATOM    536  HZ  PHE    31       6.923  -3.703 -13.542
ATOM    537  CE2 PHE    31       7.971  -3.331 -15.388
ATOM    538  HE2 PHE    31       7.562  -2.339 -15.514
ATOM    539  CD2 PHE    31       8.870  -3.847 -16.336
ATOM    540  HD2 PHE    31       9.156  -3.236 -17.179
ATOM    541  C   PHE    31      10.543  -6.777 -19.434
ATOM    542  O   PHE    31       9.841  -6.270 -20.310
ATOM    543  N   SER    32      11.731  -7.326 -19.718
ATOM    544  H   SER    32      12.296  -7.711 -18.969
ATOM    545  CA  SER    32      12.220  -7.382 -21.095
ATOM    546  HA  SER    32      12.187  -6.366 -21.488
ATOM    547  CB  SER    32      13.673  -7.850 -21.153
ATOM    548 2HB  SER    32      13.796  -8.782 -20.603
ATOM    549 3HB  SER    32      13.956  -8.015 -22.193
ATOM    550  OG  SER    32      14.493  -6.832 -20.616
ATOM    551  HG  SER    32      14.437  -6.875 -19.651
ATOM    552  C   SER    32      11.335  -8.242 -22.004
ATOM    553  O   SER    32      11.243  -7.931 -23.192
ATOM    554  N   GLN    33      10.612  -9.241 -21.482
ATOM    555  H   GLN    33      10.607  -9.388 -20.480
ATOM    556  CA  GLN    33       9.676 -10.033 -22.287
ATOM    557  HA  GLN    33      10.221 -10.411 -23.153
ATOM    558  CB  GLN    33       9.117 -11.236 -21.499
ATOM    559 2HB  GLN    33       8.364 -10.874 -20.799
ATOM    560 3HB  GLN    33       8.609 -11.900 -22.200
ATOM    561  CG  GLN    33      10.141 -12.063 -20.702
ATOM    562 2HG  GLN    33      10.567 -11.430 -19.926
ATOM    563 3HG  GLN    33       9.614 -12.875 -20.197
ATOM    564  CD  GLN    33      11.287 -12.664 -21.518
ATOM    565  OE1 GLN    33      11.212 -12.851 -22.730
ATOM    566  NE2 GLN    33      12.384 -12.986 -20.852
ATOM    567 1HE2 GLN    33      13.177 -13.390 -21.328
ATOM    568 2HE2 GLN    33      12.408 -12.847 -19.842
ATOM    569  C   GLN    33       8.509  -9.174 -22.804
ATOM    570  O   GLN    33       7.796  -9.598 -23.715
ATOM    571  N   PHE    34       8.322  -7.969 -22.250
ATOM    572  H   PHE    34       8.934  -7.681 -21.495
ATOM    573  CA  PHE    34       7.220  -7.069 -22.549
ATOM    574  HA  PHE    34       6.555  -7.553 -23.265
ATOM    575  CB  PHE    34       6.416  -6.830 -21.255
ATOM    576 2HB  PHE    34       7.068  -6.398 -20.495
ATOM    577 3HB  PHE    34       5.627  -6.105 -21.460
ATOM    578  CG  PHE    34       5.749  -8.085 -20.712
ATOM    579  CD1 PHE    34       6.190  -8.698 -19.518
ATOM    580  HD1 PHE    34       7.013  -8.288 -18.943
ATOM    581  CE1 PHE    34       5.556  -9.868 -19.058
ATOM    582  HE1 PHE    34       5.886 -10.337 -18.144
ATOM    583  CZ  PHE    34       4.491 -10.433 -19.779
ATOM    584  HZ  PHE    34       4.009 -11.332 -19.419
ATOM    585  CE2 PHE    34       4.053  -9.826 -20.968
ATOM    586  HE2 PHE    34       3.232 -10.258 -21.525
ATOM    587  CD2 PHE    34       4.679  -8.656 -21.430
ATOM    588  HD2 PHE    34       4.332  -8.195 -22.344
ATOM    589  C   PHE    34       7.704  -5.775 -23.222
ATOM    590  O   PHE    34       6.912  -4.839 -23.346
ATOM    591  N   GLY    35       8.958  -5.707 -23.701
ATOM    592  H   GLY    35       9.558  -6.518 -23.620
ATOM    593  CA  GLY    35       9.392  -4.584 -24.537
ATOM    594 2HA  GLY    35       8.908  -4.684 -25.508
ATOM    595 3HA  GLY    35       9.040  -3.662 -24.073
ATOM    596  C   GLY    35      10.897  -4.430 -24.775
ATOM    597  O   GLY    35      11.286  -3.507 -25.485
ATOM    598  N   GLN    36      11.728  -5.313 -24.218
ATOM    599  H   GLN    36      11.315  -6.106 -23.748
ATOM    600  CA  GLN    36      13.188  -5.232 -24.146
ATOM    601  HA  GLN    36      13.478  -6.073 -23.518
ATOM    602  CB  GLN    36      13.842  -5.482 -25.519
ATOM    603 2HB  GLN    36      13.450  -6.414 -25.929
ATOM    604 3HB  GLN    36      13.583  -4.674 -26.203
ATOM    605  CG  GLN    36      15.377  -5.589 -25.448
ATOM    606 2HG  GLN    36      15.758  -5.860 -26.434
ATOM    607 3HG  GLN    36      15.791  -4.610 -25.201
ATOM    608  CD  GLN    36      15.852  -6.631 -24.429
ATOM    609  OE1 GLN    36      15.637  -7.829 -24.595
ATOM    610  NE2 GLN    36      16.456  -6.201 -23.333
ATOM    611 1HE2 GLN    36      16.705  -6.848 -22.598
ATOM    612 2HE2 GLN    36      16.652  -5.206 -23.212
ATOM    613  C   GLN    36      13.684  -3.957 -23.443
ATOM    614  O   GLN    36      13.580  -2.837 -23.944
ATOM    615  N   ILE    37      14.264  -4.146 -22.260
ATOM    616  H   ILE    37      14.357  -5.088 -21.893
ATOM    617  CA  ILE    37      14.919  -3.089 -21.502
ATOM    618  HA  ILE    37      14.233  -2.245 -21.418
ATOM    619  CB  ILE    37      15.206  -3.632 -20.085
ATOM    620  HB  ILE    37      15.642  -4.626 -20.176
ATOM    621  CG2 ILE    37      16.214  -2.795 -19.283
ATOM    622 1HG2 ILE    37      15.843  -1.781 -19.143
ATOM    623 2HG2 ILE    37      16.385  -3.259 -18.320
ATOM    624 3HG2 ILE    37      17.181  -2.773 -19.783
ATOM    625  CG1 ILE    37      13.846  -3.730 -19.358
ATOM    626 2HG1 ILE    37      13.422  -2.730 -19.265
ATOM    627 3HG1 ILE    37      13.151  -4.333 -19.943
ATOM    628  CD1 ILE    37      13.917  -4.357 -17.971
ATOM    629 1HD1 ILE    37      12.914  -4.389 -17.557
ATOM    630 2HD1 ILE    37      14.325  -5.364 -18.037
ATOM    631 3HD1 ILE    37      14.530  -3.749 -17.312
ATOM    632  C   ILE    37      16.175  -2.619 -22.246
ATOM    633  O   ILE    37      16.798  -3.387 -22.985
ATOM    634  N   LEU    38      16.568  -1.371 -21.985
ATOM    635  H   LEU    38      16.000  -0.818 -21.354
ATOM    636  CA  LEU    38      17.797  -0.744 -22.435
ATOM    637  HA  LEU    38      18.336  -1.442 -23.077
ATOM    638  CB  LEU    38      17.434   0.505 -23.257
ATOM    639 2HB  LEU    38      16.805   0.198 -24.094
ATOM    640 3HB  LEU    38      16.849   1.175 -22.625
ATOM    641  CG  LEU    38      18.642   1.289 -23.804
ATOM    642  HG  LEU    38      19.258   1.637 -22.975
ATOM    643  CD1 LEU    38      19.509   0.442 -24.745
ATOM    644 1HD1 LEU    38      19.974  -0.375 -24.196
ATOM    645 2HD1 LEU    38      18.900   0.033 -25.553
ATOM    646 3HD1 LEU    38      20.303   1.057 -25.170
ATOM    647  CD2 LEU    38      18.133   2.519 -24.562
ATOM    648 1HD2 LEU    38      17.545   3.146 -23.891
ATOM    649 2HD2 LEU    38      18.976   3.104 -24.930
ATOM    650 3HD2 LEU    38      17.511   2.213 -25.403
ATOM    651  C   LEU    38      18.691  -0.394 -21.236
ATOM    652  O   LEU    38      19.904  -0.571 -21.344
ATOM    653  N   ASP    39      18.140   0.050 -20.093
ATOM    654  H   ASP    39      17.129   0.153 -20.012
ATOM    655  CA  ASP    39      18.930   0.323 -18.875
ATOM    656  HA  ASP    39      19.689  -0.452 -18.778
ATOM    657  CB  ASP    39      19.644   1.684 -18.993
ATOM    658 2HB  ASP    39      20.226   1.708 -19.915
ATOM    659 3HB  ASP    39      18.900   2.477 -19.056
ATOM    660  CG  ASP    39      20.597   1.967 -17.818
ATOM    661  OD1 ASP    39      21.243   1.021 -17.315
ATOM    662  OD2 ASP    39      20.723   3.144 -17.416
ATOM    663  C   ASP    39      18.047   0.276 -17.618
ATOM    664  O   ASP    39      16.827   0.355 -17.736
ATOM    665  N   ILE    40      18.624   0.147 -16.419
ATOM    666  H   ILE    40      19.638   0.190 -16.366
ATOM    667  CA  ILE    40      17.928  -0.049 -15.142
ATOM    668  HA  ILE    40      16.893   0.281 -15.232
ATOM    669  CB  ILE    40      17.950  -1.554 -14.747
ATOM    670  HB  ILE    40      18.990  -1.884 -14.723
ATOM    671  CG2 ILE    40      17.360  -1.769 -13.339
ATOM    672 1HG2 ILE    40      17.954  -1.251 -12.586
ATOM    673 2HG2 ILE    40      16.333  -1.402 -13.303
ATOM    674 3HG2 ILE    40      17.386  -2.821 -13.070
ATOM    675  CG1 ILE    40      17.194  -2.418 -15.784
ATOM    676 2HG1 ILE    40      16.148  -2.115 -15.806
ATOM    677 3HG1 ILE    40      17.623  -2.233 -16.765
ATOM    678  CD1 ILE    40      17.263  -3.936 -15.568
ATOM    679 1HD1 ILE    40      16.785  -4.214 -14.633
ATOM    680 2HD1 ILE    40      16.739  -4.446 -16.377
ATOM    681 3HD1 ILE    40      18.302  -4.264 -15.566
ATOM    682  C   ILE    40      18.641   0.809 -14.087
ATOM    683  O   ILE    40      19.872   0.890 -14.091
ATOM    684  N   VAL    41      17.882   1.406 -13.160
ATOM    685  H   VAL    41      16.869   1.322 -13.214
ATOM    686  CA  VAL    41      18.397   2.229 -12.072
ATOM    687  HA  VAL    41      19.439   1.960 -11.888
ATOM    688  CB  VAL    41      18.353   3.729 -12.465
ATOM    689  HB  VAL    41      17.316   4.021 -12.614
ATOM    690  CG1 VAL    41      18.951   4.615 -11.359
ATOM    691 1HG1 VAL    41      19.991   4.342 -11.177
ATOM    692 2HG1 VAL    41      18.904   5.664 -11.656
ATOM    693 3HG1 VAL    41      18.384   4.503 -10.435
ATOM    694  CG2 VAL    41      19.100   4.043 -13.773
ATOM    695 1HG2 VAL    41      19.082   5.117 -13.964
ATOM    696 2HG2 VAL    41      20.136   3.710 -13.705
ATOM    697 3HG2 VAL    41      18.615   3.551 -14.615
ATOM    698  C   VAL    41      17.584   1.941 -10.797
ATOM    699  O   VAL    41      16.403   2.279 -10.703
ATOM    700  N   ALA    42      18.227   1.316  -9.811
ATOM    701  H   ALA    42      19.184   1.030  -9.954
ATOM    702  CA  ALA    42      17.763   1.128  -8.440
ATOM    703  HA  ALA    42      17.100   1.948  -8.163
ATOM    704  CB  ALA    42      17.008  -0.196  -8.299
ATOM    705 1HB  ALA    42      16.157  -0.202  -8.979
ATOM    706 2HB  ALA    42      17.672  -1.029  -8.532
ATOM    707 3HB  ALA    42      16.638  -0.307  -7.279
ATOM    708  C   ALA    42      19.012   1.170  -7.548
ATOM    709  O   ALA    42      20.132   1.225  -8.066
ATOM    710  N   LEU    43      18.852   1.136  -6.224
ATOM    711  H   LEU    43      17.933   0.980  -5.823
ATOM    712  CA  LEU    43      19.962   1.274  -5.279
ATOM    713  HA  LEU    43      20.867   0.884  -5.742
ATOM    714  CB  LEU    43      20.164   2.767  -4.923
ATOM    715 2HB  LEU    43      19.609   3.387  -5.630
ATOM    716 3HB  LEU    43      19.723   2.953  -3.946
ATOM    717  CG  LEU    43      21.611   3.303  -4.904
ATOM    718  HG  LEU    43      21.561   4.341  -4.575
ATOM    719  CD1 LEU    43      22.538   2.563  -3.933
ATOM    720 1HD1 LEU    43      22.756   1.557  -4.288
ATOM    721 2HD1 LEU    43      23.481   3.106  -3.856
ATOM    722 3HD1 LEU    43      22.089   2.534  -2.941
ATOM    723  CD2 LEU    43      22.232   3.299  -6.306
ATOM    724 1HD2 LEU    43      23.208   3.785  -6.278
ATOM    725 2HD2 LEU    43      22.351   2.282  -6.676
ATOM    726 3HD2 LEU    43      21.590   3.851  -6.994
ATOM    727  C   LEU    43      19.652   0.442  -4.034
ATOM    728  O   LEU    43      18.490   0.212  -3.706
ATOM    729  N   LYS    44      20.694  -0.009  -3.332
ATOM    730  H   LYS    44      21.626   0.210  -3.652
ATOM    731  CA  LYS    44      20.574  -0.810  -2.112
ATOM    732  HA  LYS    44      19.850  -1.606  -2.299
ATOM    733  CB  LYS    44      21.954  -1.436  -1.833
ATOM    734 2HB  LYS    44      22.312  -1.890  -2.759
ATOM    735 3HB  LYS    44      22.656  -0.649  -1.549
ATOM    736  CG  LYS    44      21.956  -2.523  -0.747
ATOM    737 2HG  LYS    44      21.767  -2.066   0.224
ATOM    738 3HG  LYS    44      21.171  -3.249  -0.964
ATOM    739  CD  LYS    44      23.315  -3.243  -0.722
ATOM    740 2HD  LYS    44      23.477  -3.707  -1.697
ATOM    741 3HD  LYS    44      24.117  -2.522  -0.557
ATOM    742  CE  LYS    44      23.385  -4.351   0.340
ATOM    743 2HE  LYS    44      22.490  -4.973   0.262
ATOM    744 3HE  LYS    44      24.247  -4.983   0.113
ATOM    745  NZ  LYS    44      23.530  -3.824   1.723
ATOM    746 1HZ  LYS    44      22.755  -3.237   1.989
ATOM    747 2HZ  LYS    44      23.582  -4.583   2.388
ATOM    748 3HZ  LYS    44      24.380  -3.287   1.820
ATOM    749  C   LYS    44      20.044   0.008  -0.928
ATOM    750  O   LYS    44      19.595  -0.581   0.056
ATOM    751  N   THR    45      20.097   1.338  -0.991
ATOM    752  H   THR    45      20.410   1.799  -1.831
ATOM    753  CA  THR    45      19.548   2.218   0.028
ATOM    754  HA  THR    45      19.907   1.889   1.005
ATOM    755  CB  THR    45      20.055   3.649  -0.237
ATOM    756  HB  THR    45      19.452   4.357   0.330
ATOM    757  CG2 THR    45      21.519   3.801   0.185
ATOM    758 1HG2 THR    45      22.153   3.119  -0.382
ATOM    759 2HG2 THR    45      21.846   4.826   0.006
ATOM    760 3HG2 THR    45      21.621   3.585   1.249
ATOM    761  OG1 THR    45      19.988   3.957  -1.619
ATOM    762 1HG  THR    45      20.147   4.906  -1.728
ATOM    763  C   THR    45      18.015   2.125   0.021
ATOM    764  O   THR    45      17.394   1.918  -1.026
ATOM    765  N   LEU    46      17.386   2.301   1.191
ATOM    766  H   LEU    46      17.938   2.470   2.021
ATOM    767  CA  LEU    46      15.936   2.153   1.361
ATOM    768  HA  LEU    46      15.682   1.123   1.124
ATOM    769  CB  LEU    46      15.571   2.385   2.838
ATOM    770 2HB  LEU    46      16.168   1.678   3.418
ATOM    771 3HB  LEU    46      15.868   3.391   3.140
ATOM    772  CG  LEU    46      14.076   2.159   3.168
ATOM    773  HG  LEU    46      13.667   1.405   2.494
ATOM    774  CD1 LEU    46      13.932   1.631   4.601
ATOM    775 1HD1 LEU    46      14.460   0.682   4.701
ATOM    776 2HD1 LEU    46      14.347   2.347   5.312
ATOM    777 3HD1 LEU    46      12.880   1.462   4.833
ATOM    778  CD2 LEU    46      13.239   3.442   3.055
ATOM    779 1HD2 LEU    46      13.629   4.209   3.726
ATOM    780 2HD2 LEU    46      13.246   3.828   2.038
ATOM    781 3HD2 LEU    46      12.203   3.231   3.323
ATOM    782  C   LEU    46      15.150   3.048   0.401
ATOM    783  O   LEU    46      14.138   2.613  -0.146
ATOM    784  N   LYS    47      15.648   4.262   0.136
ATOM    785  H   LYS    47      16.487   4.545   0.622
ATOM    786  CA  LYS    47      15.031   5.228  -0.778
ATOM    787  HA  LYS    47      14.019   5.409  -0.410
ATOM    788  CB  LYS    47      15.791   6.567  -0.723
ATOM    789 2HB  LYS    47      15.266   7.290  -1.350
ATOM    790 3HB  LYS    47      15.765   6.938   0.302
ATOM    791  CG  LYS    47      17.255   6.470  -1.197
ATOM    792 2HG  LYS    47      17.815   5.827  -0.518
ATOM    793 3HG  LYS    47      17.284   6.020  -2.189
ATOM    794  CD  LYS    47      17.955   7.835  -1.278
ATOM    795 2HD  LYS    47      18.950   7.683  -1.700
ATOM    796 3HD  LYS    47      17.393   8.484  -1.952
ATOM    797  CE  LYS    47      18.090   8.509   0.098
ATOM    798 2HE  LYS    47      17.094   8.673   0.513
ATOM    799 3HE  LYS    47      18.631   7.836   0.768
ATOM    800  NZ  LYS    47      18.807   9.806   0.018
ATOM    801 1HZ  LYS    47      18.320  10.459  -0.578
ATOM    802 2HZ  LYS    47      18.883  10.229   0.932
ATOM    803 3HZ  LYS    47      19.743   9.689  -0.340
ATOM    804  C   LYS    47      14.877   4.732  -2.225
ATOM    805  O   LYS    47      14.193   5.402  -2.998
ATOM    806  N   MET    48      15.506   3.612  -2.602
ATOM    807  H   MET    48      16.084   3.125  -1.926
ATOM    808  CA  MET    48      15.393   2.985  -3.919
ATOM    809  HA  MET    48      14.477   3.324  -4.398
ATOM    810  CB  MET    48      16.579   3.405  -4.804
ATOM    811 2HB  MET    48      17.497   3.237  -4.246
ATOM    812 3HB  MET    48      16.608   2.787  -5.699
ATOM    813  CG  MET    48      16.528   4.873  -5.254
ATOM    814 2HG  MET    48      16.518   5.503  -4.367
ATOM    815 3HG  MET    48      17.446   5.092  -5.800
ATOM    816  SD  MET    48      15.119   5.366  -6.294
ATOM    817  CE  MET    48      15.393   4.363  -7.776
ATOM    818 1HE  MET    48      15.381   3.307  -7.511
ATOM    819 2HE  MET    48      14.592   4.554  -8.490
ATOM    820 3HE  MET    48      16.353   4.617  -8.227
ATOM    821  C   MET    48      15.268   1.456  -3.777
ATOM    822  O   MET    48      15.645   0.710  -4.683
ATOM    823  N   ARG    49      14.737   0.969  -2.646
ATOM    824  H   ARG    49      14.447   1.625  -1.926
ATOM    825  CA  ARG    49      14.414  -0.450  -2.460
ATOM    826  HA  ARG    49      15.026  -1.054  -3.133
ATOM    827  CB  ARG    49      14.706  -0.879  -1.015
ATOM    828 2HB  ARG    49      14.557  -0.043  -0.335
ATOM    829 3HB  ARG    49      14.006  -1.659  -0.729
ATOM    830  CG  ARG    49      16.123  -1.450  -0.876
ATOM    831 2HG  ARG    49      16.183  -2.366  -1.466
ATOM    832 3HG  ARG    49      16.854  -0.737  -1.256
ATOM    833  CD  ARG    49      16.446  -1.776   0.586
ATOM    834 2HD  ARG    49      16.596  -0.846   1.134
ATOM    835 3HD  ARG    49      15.613  -2.304   1.049
ATOM    836  NE  ARG    49      17.671  -2.582   0.693
ATOM    837  HE  ARG    49      18.528  -2.033   0.756
ATOM    838  CZ  ARG    49      17.744  -3.919   0.654
ATOM    839  NH1 ARG    49      18.917  -4.520   0.818
ATOM    840 1HH1 ARG    49      19.746  -3.983   1.024
ATOM    841 2HH1 ARG    49      19.001  -5.526   0.844
ATOM    842  NH2 ARG    49      16.654  -4.652   0.450
ATOM    843 1HH2 ARG    49      15.742  -4.205   0.338
ATOM    844 2HH2 ARG    49      16.675  -5.663   0.357
ATOM    845  C   ARG    49      12.959  -0.737  -2.814
ATOM    846  O   ARG    49      12.665  -1.814  -3.324
ATOM    847  N   GLY    50      12.053   0.213  -2.574
ATOM    848  H   GLY    50      12.352   1.103  -2.189
ATOM    849  CA  GLY    50      10.655   0.116  -2.983
ATOM    850 2HA  GLY    50      10.352  -0.927  -3.049
ATOM    851 3HA  GLY    50      10.041   0.602  -2.225
ATOM    852  C   GLY    50      10.411   0.817  -4.323
ATOM    853  O   GLY    50       9.302   0.756  -4.854
ATOM    854  N   GLN    51      11.441   1.460  -4.881
ATOM    855  H   GLN    51      12.333   1.432  -4.408
ATOM    856  CA  GLN    51      11.377   2.364  -6.014
ATOM    857  HA  GLN    51      10.399   2.277  -6.476
ATOM    858  CB  GLN    51      11.595   3.819  -5.536
ATOM    859 2HB  GLN    51      12.653   3.987  -5.328
ATOM    860 3HB  GLN    51      11.335   4.472  -6.370
ATOM    861  CG  GLN    51      10.782   4.277  -4.306
ATOM    862 2HG  GLN    51      10.734   5.366  -4.337
ATOM    863 3HG  GLN    51       9.760   3.906  -4.389
ATOM    864  CD  GLN    51      11.362   3.885  -2.933
ATOM    865  OE1 GLN    51      12.283   3.081  -2.798
ATOM    866  NE2 GLN    51      10.812   4.427  -1.860
ATOM    867 1HE2 GLN    51      11.163   4.183  -0.946
ATOM    868 2HE2 GLN    51      10.049   5.084  -1.948
ATOM    869  C   GLN    51      12.471   1.989  -7.014
ATOM    870  O   GLN    51      13.550   1.565  -6.602
ATOM    871  N   ALA    52      12.225   2.172  -8.312
ATOM    872  H   ALA    52      11.331   2.565  -8.597
ATOM    873  CA  ALA    52      13.197   1.942  -9.377
ATOM    874  HA  ALA    52      14.186   2.259  -9.049
ATOM    875  CB  ALA    52      13.259   0.447  -9.726
ATOM    876 1HB  ALA    52      13.987   0.283 -10.522
ATOM    877 2HB  ALA    52      13.572  -0.124  -8.852
ATOM    878 3HB  ALA    52      12.284   0.094 -10.060
ATOM    879  C   ALA    52      12.799   2.749 -10.613
ATOM    880  O   ALA    52      11.650   3.175 -10.745
ATOM    881  N   PHE    53      13.734   2.896 -11.545
ATOM    882  H   PHE    53      14.656   2.497 -11.377
ATOM    883  CA  PHE    53      13.509   3.432 -12.879
ATOM    884  HA  PHE    53      12.441   3.536 -13.066
ATOM    885  CB  PHE    53      14.190   4.795 -13.066
ATOM    886 2HB  PHE    53      15.240   4.706 -12.795
ATOM    887 3HB  PHE    53      14.159   5.049 -14.126
ATOM    888  CG  PHE    53      13.586   5.947 -12.291
ATOM    889  CD1 PHE    53      14.035   6.239 -10.989
ATOM    890  HD1 PHE    53      14.796   5.625 -10.530
ATOM    891  CE1 PHE    53      13.506   7.339 -10.289
ATOM    892  HE1 PHE    53      13.849   7.558  -9.287
ATOM    893  CZ  PHE    53      12.539   8.158 -10.898
ATOM    894  HZ  PHE    53      12.127   9.003 -10.364
ATOM    895  CE2 PHE    53      12.099   7.875 -12.202
ATOM    896  HE2 PHE    53      11.357   8.509 -12.668
ATOM    897  CD2 PHE    53      12.614   6.766 -12.896
ATOM    898  HD2 PHE    53      12.272   6.552 -13.900
ATOM    899  C   PHE    53      14.099   2.426 -13.859
ATOM    900  O   PHE    53      15.070   1.732 -13.542
ATOM    901  N   VAL    54      13.538   2.351 -15.059
ATOM    902  H   VAL    54      12.725   2.921 -15.280
ATOM    903  CA  VAL    54      14.020   1.452 -16.092
ATOM    904  HA  VAL    54      15.108   1.415 -16.023
ATOM    905  CB  VAL    54      13.506   0.011 -15.838
ATOM    906  HB  VAL    54      14.123  -0.398 -15.036
ATOM    907  CG1 VAL    54      12.043  -0.104 -15.384
ATOM    908 1HG1 VAL    54      11.396   0.238 -16.183
ATOM    909 2HG1 VAL    54      11.805  -1.144 -15.160
ATOM    910 3HG1 VAL    54      11.861   0.481 -14.483
ATOM    911  CG2 VAL    54      13.684  -0.912 -17.044
ATOM    912 1HG2 VAL    54      13.326  -1.907 -16.789
ATOM    913 2HG2 VAL    54      13.122  -0.544 -17.901
ATOM    914 3HG2 VAL    54      14.736  -0.974 -17.306
ATOM    915  C   VAL    54      13.679   2.076 -17.443
ATOM    916  O   VAL    54      12.604   2.649 -17.633
ATOM    917  N   ILE    55      14.648   2.013 -18.350
ATOM    918  H   ILE    55      15.452   1.428 -18.141
ATOM    919  CA  ILE    55      14.678   2.651 -19.650
ATOM    920  HA  ILE    55      13.844   3.341 -19.746
ATOM    921  CB  ILE    55      16.015   3.414 -19.851
ATOM    922  HB  ILE    55      16.819   2.680 -19.865
ATOM    923  CG2 ILE    55      16.007   4.114 -21.223
ATOM    924 1HG2 ILE    55      15.872   3.389 -22.025
ATOM    925 2HG2 ILE    55      15.201   4.850 -21.263
ATOM    926 3HG2 ILE    55      16.958   4.620 -21.394
ATOM    927  CG1 ILE    55      16.380   4.497 -18.798
ATOM    928 2HG1 ILE    55      17.272   5.015 -19.151
ATOM    929 3HG1 ILE    55      15.584   5.238 -18.751
ATOM    930  CD1 ILE    55      16.700   4.028 -17.369
ATOM    931 1HD1 ILE    55      17.349   3.153 -17.390
ATOM    932 2HD1 ILE    55      17.209   4.829 -16.833
ATOM    933 3HD1 ILE    55      15.789   3.797 -16.822
ATOM    934  C   ILE    55      14.537   1.496 -20.639
ATOM    935  O   ILE    55      15.166   0.451 -20.448
ATOM    936  N   PHE    56      13.748   1.677 -21.695
ATOM    937  H   PHE    56      13.297   2.580 -21.812
ATOM    938  CA  PHE    56      13.340   0.621 -22.615
ATOM    939  HA  PHE    56      13.799  -0.321 -22.322
ATOM    940  CB  PHE    56      11.814   0.454 -22.519
ATOM    941 2HB  PHE    56      11.369   1.381 -22.160
ATOM    942 3HB  PHE    56      11.398   0.277 -23.512
ATOM    943  CG  PHE    56      11.370  -0.678 -21.613
ATOM    944  CD1 PHE    56      11.284  -0.500 -20.218
ATOM    945  HD1 PHE    56      11.565   0.438 -19.763
ATOM    946  CE1 PHE    56      10.822  -1.547 -19.402
ATOM    947  HE1 PHE    56      10.737  -1.406 -18.332
ATOM    948  CZ  PHE    56      10.468  -2.778 -19.981
ATOM    949  HZ  PHE    56      10.084  -3.577 -19.372
ATOM    950  CE2 PHE    56      10.582  -2.970 -21.364
ATOM    951  HE2 PHE    56      10.305  -3.922 -21.795
ATOM    952  CD2 PHE    56      11.024  -1.918 -22.181
ATOM    953  HD2 PHE    56      11.093  -2.063 -23.247
ATOM    954  C   PHE    56      13.798   0.916 -24.046
ATOM    955  O   PHE    56      14.259   2.018 -24.357
ATOM    956  N   LYS    57      13.674  -0.091 -24.917
ATOM    957  H   LYS    57      13.360  -0.994 -24.568
ATOM    958  CA  LYS    57      14.057  -0.034 -26.325
ATOM    959  HA  LYS    57      15.142   0.060 -26.383
ATOM    960  CB  LYS    57      13.642  -1.369 -26.973
ATOM    961 2HB  LYS    57      14.195  -2.177 -26.491
ATOM    962 3HB  LYS    57      12.577  -1.528 -26.800
ATOM    963  CG  LYS    57      13.914  -1.429 -28.483
ATOM    964 2HG  LYS    57      13.308  -0.682 -28.989
ATOM    965 3HG  LYS    57      14.964  -1.197 -28.664
ATOM    966  CD  LYS    57      13.605  -2.802 -29.100
ATOM    967 2HD  LYS    57      13.803  -2.748 -30.172
ATOM    968 3HD  LYS    57      14.297  -3.533 -28.680
ATOM    969  CE  LYS    57      12.172  -3.326 -28.890
ATOM    970 2HE  LYS    57      12.090  -4.278 -29.418
ATOM    971 3HE  LYS    57      12.005  -3.520 -27.828
ATOM    972  NZ  LYS    57      11.118  -2.411 -29.395
ATOM    973 1HZ  LYS    57      10.313  -2.937 -29.700
ATOM    974 2HZ  LYS    57      10.782  -1.791 -28.664
ATOM    975 3HZ  LYS    57      11.428  -1.831 -30.177
ATOM    976  C   LYS    57      13.438   1.172 -27.037
ATOM    977  O   LYS    57      14.165   1.938 -27.669
ATOM    978  N   GLU    58      12.120   1.347 -26.932
ATOM    979  H   GLU    58      11.587   0.741 -26.323
ATOM    980  CA  GLU    58      11.343   2.364 -27.637
ATOM    981  HA  GLU    58      11.966   3.236 -27.848
ATOM    982  CB  GLU    58      10.788   1.788 -28.957
ATOM    983 2HB  GLU    58      10.418   0.781 -28.771
ATOM    984 3HB  GLU    58       9.944   2.394 -29.288
ATOM    985  CG  GLU    58      11.805   1.746 -30.106
ATOM    986 2HG  GLU    58      12.001   2.767 -30.443
ATOM    987 3HG  GLU    58      12.748   1.332 -29.758
ATOM    988  CD  GLU    58      11.298   0.884 -31.275
ATOM    989  OE1 GLU    58      10.764   1.440 -32.263
ATOM    990  OE2 GLU    58      11.446  -0.359 -31.214
ATOM    991  C   GLU    58      10.186   2.782 -26.728
ATOM    992  O   GLU    58       9.792   2.029 -25.834
ATOM    993  N   ILE    59       9.616   3.967 -26.968
ATOM    994  H   ILE    59       9.972   4.538 -27.723
ATOM    995  CA  ILE    59       8.558   4.543 -26.134
ATOM    996  HA  ILE    59       8.918   4.537 -25.103
ATOM    997  CB  ILE    59       8.311   6.021 -26.534
ATOM    998  HB  ILE    59       7.638   6.446 -25.791
ATOM    999  CG2 ILE    59       9.624   6.821 -26.454
ATOM   1000 1HG2 ILE    59       9.405   7.889 -26.415
ATOM   1001 2HG2 ILE    59      10.168   6.553 -25.554
ATOM   1002 3HG2 ILE    59      10.257   6.621 -27.320
ATOM   1003  CG1 ILE    59       7.657   6.179 -27.930
ATOM   1004 2HG1 ILE    59       8.275   5.689 -28.684
ATOM   1005 3HG1 ILE    59       6.683   5.691 -27.926
ATOM   1006  CD1 ILE    59       7.435   7.634 -28.365
ATOM   1007 1HD1 ILE    59       6.843   7.649 -29.280
ATOM   1008 2HD1 ILE    59       6.903   8.182 -27.588
ATOM   1009 3HD1 ILE    59       8.390   8.121 -28.564
ATOM   1010  C   ILE    59       7.274   3.695 -26.150
ATOM   1011  O   ILE    59       6.580   3.600 -25.135
ATOM   1012  N   GLY    60       6.967   3.035 -27.272
ATOM   1013  H   GLY    60       7.552   3.141 -28.088
ATOM   1014  CA  GLY    60       5.815   2.144 -27.363
ATOM   1015 2HA  GLY    60       4.925   2.650 -26.988
ATOM   1016 3HA  GLY    60       5.655   1.873 -28.407
ATOM   1017  C   GLY    60       6.058   0.872 -26.556
ATOM   1018  O   GLY    60       5.162   0.395 -25.859
ATOM   1019  N   SER    61       7.287   0.354 -26.585
ATOM   1020  H   SER    61       8.008   0.808 -27.127
ATOM   1021  CA  SER    61       7.676  -0.824 -25.824
ATOM   1022  HA  SER    61       6.964  -1.625 -26.029
ATOM   1023  CB  SER    61       9.067  -1.278 -26.274
ATOM   1024 2HB  SER    61       9.832  -0.648 -25.820
ATOM   1025 3HB  SER    61       9.212  -2.302 -25.948
ATOM   1026  OG  SER    61       9.195  -1.213 -27.688
ATOM   1027  HG  SER    61       8.391  -1.594 -28.080
ATOM   1028  C   SER    61       7.649  -0.521 -24.323
ATOM   1029  O   SER    61       7.142  -1.326 -23.541
ATOM   1030  N   ALA    62       8.120   0.669 -23.933
ATOM   1031  H   ALA    62       8.554   1.271 -24.625
ATOM   1032  CA  ALA    62       8.029   1.165 -22.569
ATOM   1033  HA  ALA    62       8.583   0.492 -21.912
ATOM   1034  CB  ALA    62       8.653   2.562 -22.501
ATOM   1035 1HB  ALA    62       8.706   2.889 -21.464
ATOM   1036 2HB  ALA    62       9.653   2.562 -22.930
ATOM   1037 3HB  ALA    62       8.038   3.270 -23.055
ATOM   1038  C   ALA    62       6.567   1.210 -22.122
ATOM   1039  O   ALA    62       6.240   0.709 -21.047
ATOM   1040  N   SER    63       5.683   1.764 -22.960
ATOM   1041  H   SER    63       6.021   2.184 -23.817
ATOM   1042  CA  SER    63       4.254   1.848 -22.668
ATOM   1043  HA  SER    63       4.125   2.405 -21.744
ATOM   1044  CB  SER    63       3.522   2.587 -23.795
ATOM   1045 2HB  SER    63       3.549   1.996 -24.710
ATOM   1046 3HB  SER    63       2.480   2.727 -23.505
ATOM   1047  OG  SER    63       4.106   3.850 -24.042
ATOM   1048  HG  SER    63       4.980   3.724 -24.457
ATOM   1049  C   SER    63       3.645   0.459 -22.469
ATOM   1050  O   SER    63       2.878   0.247 -21.529
ATOM   1051  N   ASN    64       4.007  -0.493 -23.333
ATOM   1052  H   ASN    64       4.632  -0.240 -24.091
ATOM   1053  CA  ASN    64       3.492  -1.855 -23.270
ATOM   1054  HA  ASN    64       2.405  -1.812 -23.291
ATOM   1055  CB  ASN    64       3.967  -2.680 -24.471
ATOM   1056 2HB  ASN    64       3.643  -2.201 -25.396
ATOM   1057 3HB  ASN    64       5.057  -2.736 -24.480
ATOM   1058  CG  ASN    64       3.374  -4.084 -24.402
ATOM   1059  OD1 ASN    64       2.199  -4.284 -24.696
ATOM   1060  ND2 ASN    64       4.155  -5.075 -24.010
ATOM   1061 1HD2 ASN    64       3.783  -6.010 -23.949
ATOM   1062 2HD2 ASN    64       5.133  -4.901 -23.777
ATOM   1063  C   ASN    64       3.906  -2.528 -21.966
ATOM   1064  O   ASN    64       3.056  -3.085 -21.272
ATOM   1065  N   ALA    65       5.191  -2.438 -21.616
ATOM   1066  H   ALA    65       5.833  -1.976 -22.247
ATOM   1067  CA  ALA    65       5.731  -2.975 -20.379
ATOM   1068  HA  ALA    65       5.591  -4.056 -20.374
ATOM   1069  CB  ALA    65       7.229  -2.666 -20.295
ATOM   1070 1HB  ALA    65       7.633  -3.111 -19.385
ATOM   1071 2HB  ALA    65       7.741  -3.089 -21.159
ATOM   1072 3HB  ALA    65       7.403  -1.587 -20.263
ATOM   1073  C   ALA    65       4.994  -2.380 -19.184
ATOM   1074  O   ALA    65       4.481  -3.123 -18.351
ATOM   1075  N   LEU    66       4.901  -1.048 -19.136
ATOM   1076  H   LEU    66       5.339  -0.510 -19.879
ATOM   1077  CA  LEU    66       4.248  -0.309 -18.065
ATOM   1078  HA  LEU    66       4.809  -0.463 -17.143
ATOM   1079  CB  LEU    66       4.266   1.188 -18.429
ATOM   1080 2HB  LEU    66       5.255   1.430 -18.804
ATOM   1081 3HB  LEU    66       3.567   1.365 -19.246
ATOM   1082  CG  LEU    66       3.972   2.185 -17.297
ATOM   1083  HG  LEU    66       4.791   2.151 -16.583
ATOM   1084  CD1 LEU    66       3.941   3.587 -17.913
ATOM   1085 1HD1 LEU    66       4.934   3.847 -18.280
ATOM   1086 2HD1 LEU    66       3.239   3.621 -18.746
ATOM   1087 3HD1 LEU    66       3.638   4.317 -17.167
ATOM   1088  CD2 LEU    66       2.664   1.928 -16.545
ATOM   1089 1HD2 LEU    66       2.452   2.749 -15.859
ATOM   1090 2HD2 LEU    66       1.845   1.814 -17.253
ATOM   1091 3HD2 LEU    66       2.746   1.022 -15.952
ATOM   1092  C   LEU    66       2.828  -0.835 -17.879
ATOM   1093  O   LEU    66       2.490  -1.338 -16.809
ATOM   1094  N   ARG    67       1.995  -0.749 -18.920
ATOM   1095  H   ARG    67       2.337  -0.379 -19.803
ATOM   1096  CA  ARG    67       0.574  -1.042 -18.789
ATOM   1097  HA  ARG    67       0.190  -0.419 -17.973
ATOM   1098  CB  ARG    67      -0.143  -0.656 -20.093
ATOM   1099 2HB  ARG    67       0.185   0.341 -20.393
ATOM   1100 3HB  ARG    67       0.128  -1.360 -20.882
ATOM   1101  CG  ARG    67      -1.669  -0.627 -19.925
ATOM   1102 2HG  ARG    67      -2.032  -1.607 -19.614
ATOM   1103 3HG  ARG    67      -1.929   0.103 -19.155
ATOM   1104  CD  ARG    67      -2.338  -0.234 -21.248
ATOM   1105 2HD  ARG    67      -1.866   0.673 -21.625
ATOM   1106 3HD  ARG    67      -2.194  -1.024 -21.986
ATOM   1107  NE  ARG    67      -3.771   0.047 -21.076
ATOM   1108  HE  ARG    67      -4.001   1.041 -20.973
ATOM   1109  CZ  ARG    67      -4.782  -0.826 -21.061
ATOM   1110  NH1 ARG    67      -6.020  -0.373 -20.907
ATOM   1111 1HH1 ARG    67      -6.196   0.638 -20.824
ATOM   1112 2HH1 ARG    67      -6.822  -0.985 -20.886
ATOM   1113  NH2 ARG    67      -4.564  -2.133 -21.197
ATOM   1114 1HH2 ARG    67      -3.628  -2.488 -21.327
ATOM   1115 2HH2 ARG    67      -5.316  -2.808 -21.187
ATOM   1116  C   ARG    67       0.357  -2.515 -18.437
ATOM   1117  O   ARG    67      -0.510  -2.816 -17.619
ATOM   1118  N   THR    68       1.139  -3.428 -19.021
ATOM   1119  H   THR    68       1.844  -3.134 -19.686
ATOM   1120  CA  THR    68       0.997  -4.858 -18.761
ATOM   1121  HA  THR    68      -0.052  -5.124 -18.893
ATOM   1122  CB  THR    68       1.837  -5.664 -19.772
ATOM   1123  HB  THR    68       2.897  -5.472 -19.597
ATOM   1124  CG2 THR    68       1.586  -7.172 -19.671
ATOM   1125 1HG2 THR    68       0.520  -7.385 -19.755
ATOM   1126 2HG2 THR    68       2.118  -7.687 -20.470
ATOM   1127 3HG2 THR    68       1.954  -7.548 -18.716
ATOM   1128  OG1 THR    68       1.522  -5.270 -21.092
ATOM   1129 1HG  THR    68       2.031  -4.456 -21.268
ATOM   1130  C   THR    68       1.385  -5.180 -17.312
ATOM   1131  O   THR    68       0.696  -5.958 -16.649
ATOM   1132  N   MET    69       2.465  -4.577 -16.806
ATOM   1133  H   MET    69       2.990  -3.923 -17.380
ATOM   1134  CA  MET    69       3.008  -4.903 -15.492
ATOM   1135  HA  MET    69       2.797  -5.952 -15.283
ATOM   1136  CB  MET    69       4.535  -4.727 -15.499
ATOM   1137 2HB  MET    69       4.781  -3.694 -15.742
ATOM   1138 3HB  MET    69       4.912  -4.935 -14.499
ATOM   1139  CG  MET    69       5.240  -5.663 -16.500
ATOM   1140 2HG  MET    69       4.945  -5.386 -17.513
ATOM   1141 3HG  MET    69       6.315  -5.497 -16.432
ATOM   1142  SD  MET    69       4.913  -7.440 -16.294
ATOM   1143  CE  MET    69       5.706  -7.756 -14.694
ATOM   1144 1HE  MET    69       5.541  -8.794 -14.410
ATOM   1145 2HE  MET    69       6.777  -7.582 -14.778
ATOM   1146 3HE  MET    69       5.289  -7.100 -13.929
ATOM   1147  C   MET    69       2.346  -4.091 -14.373
ATOM   1148  O   MET    69       2.543  -4.404 -13.201
ATOM   1149  N   GLN    70       1.549  -3.069 -14.697
ATOM   1150  H   GLN    70       1.490  -2.794 -15.669
ATOM   1151  CA  GLN    70       0.782  -2.298 -13.727
ATOM   1152  HA  GLN    70       1.497  -1.809 -13.067
ATOM   1153  CB  GLN    70      -0.056  -1.239 -14.472
ATOM   1154 2HB  GLN    70       0.597  -0.654 -15.121
ATOM   1155 3HB  GLN    70      -0.780  -1.753 -15.105
ATOM   1156  CG  GLN    70      -0.825  -0.260 -13.570
ATOM   1157 2HG  GLN    70      -1.534   0.285 -14.196
ATOM   1158 3HG  GLN    70      -1.402  -0.805 -12.823
ATOM   1159  CD  GLN    70       0.102   0.736 -12.872
ATOM   1160  OE1 GLN    70       0.903   0.366 -12.020
ATOM   1161  NE2 GLN    70       0.039   2.009 -13.224
ATOM   1162 1HE2 GLN    70       0.735   2.664 -12.871
ATOM   1163 2HE2 GLN    70      -0.647   2.325 -13.889
ATOM   1164  C   GLN    70      -0.091  -3.247 -12.897
ATOM   1165  O   GLN    70      -0.854  -4.040 -13.454
ATOM   1166  N   GLY    71       0.027  -3.175 -11.568
ATOM   1167  H   GLY    71       0.667  -2.506 -11.156
ATOM   1168  CA  GLY    71      -0.727  -4.008 -10.637
ATOM   1169 2HA  GLY    71      -0.619  -3.594  -9.635
ATOM   1170 3HA  GLY    71      -1.782  -3.968 -10.909
ATOM   1171  C   GLY    71      -0.287  -5.476 -10.608
ATOM   1172  O   GLY    71      -0.868  -6.252  -9.849
ATOM   1173  N   PHE    72       0.704  -5.887 -11.409
ATOM   1174  H   PHE    72       1.200  -5.212 -11.984
ATOM   1175  CA  PHE    72       1.126  -7.284 -11.481
ATOM   1176  HA  PHE    72       0.236  -7.894 -11.635
ATOM   1177  CB  PHE    72       2.062  -7.476 -12.683
ATOM   1178 2HB  PHE    72       1.569  -7.086 -13.575
ATOM   1179 3HB  PHE    72       2.971  -6.894 -12.523
ATOM   1180  CG  PHE    72       2.446  -8.918 -12.949
ATOM   1181  CD1 PHE    72       3.658  -9.431 -12.450
ATOM   1182  HD1 PHE    72       4.329  -8.789 -11.898
ATOM   1183  CE1 PHE    72       4.004 -10.775 -12.672
ATOM   1184  HE1 PHE    72       4.934 -11.168 -12.283
ATOM   1185  CZ  PHE    72       3.139 -11.612 -13.399
ATOM   1186  HZ  PHE    72       3.404 -12.647 -13.570
ATOM   1187  CE2 PHE    72       1.931 -11.101 -13.906
ATOM   1188  HE2 PHE    72       1.266 -11.744 -14.468
ATOM   1189  CD2 PHE    72       1.585  -9.756 -13.683
ATOM   1190  HD2 PHE    72       0.652  -9.371 -14.073
ATOM   1191  C   PHE    72       1.823  -7.680 -10.168
ATOM   1192  O   PHE    72       2.607  -6.879  -9.653
ATOM   1193  N   PRO    73       1.599  -8.886  -9.616
ATOM   1194  CD  PRO    73       0.586  -9.850 -10.029
ATOM   1195 2HD  PRO    73       0.696 -10.122 -11.078
ATOM   1196 3HD  PRO    73      -0.404  -9.428  -9.852
ATOM   1197  CG  PRO    73       0.780 -11.085  -9.149
ATOM   1198 2HG  PRO    73       1.451 -11.787  -9.646
ATOM   1199 3HG  PRO    73      -0.170 -11.567  -8.915
ATOM   1200  CB  PRO    73       1.452 -10.518  -7.898
ATOM   1201 2HB  PRO    73       2.028 -11.269  -7.358
ATOM   1202 3HB  PRO    73       0.694 -10.085  -7.245
ATOM   1203  CA  PRO    73       2.325  -9.391  -8.454
ATOM   1204  HA  PRO    73       2.406  -8.609  -7.696
ATOM   1205  C   PRO    73       3.742  -9.832  -8.864
ATOM   1206  O   PRO    73       4.045 -11.022  -8.985
ATOM   1207  N   PHE    74       4.610  -8.854  -9.133
ATOM   1208  H   PHE    74       4.294  -7.900  -8.993
ATOM   1209  CA  PHE    74       6.010  -9.069  -9.516
ATOM   1210  HA  PHE    74       6.043  -9.742 -10.374
ATOM   1211  CB  PHE    74       6.591  -7.708  -9.914
ATOM   1212 2HB  PHE    74       5.943  -7.285 -10.681
ATOM   1213 3HB  PHE    74       6.541  -7.060  -9.039
ATOM   1214  CG  PHE    74       8.002  -7.662 -10.470
ATOM   1215  CD1 PHE    74       8.955  -6.805  -9.883
ATOM   1216  HD1 PHE    74       8.706  -6.238  -8.998
ATOM   1217  CE1 PHE    74      10.220  -6.641 -10.469
ATOM   1218  HE1 PHE    74      10.946  -5.977 -10.022
ATOM   1219  CZ  PHE    74      10.541  -7.332 -11.645
ATOM   1220  HZ  PHE    74      11.511  -7.190 -12.094
ATOM   1221  CE2 PHE    74       9.608  -8.209 -12.224
ATOM   1222  HE2 PHE    74       9.867  -8.748 -13.122
ATOM   1223  CD2 PHE    74       8.335  -8.368 -11.644
ATOM   1224  HD2 PHE    74       7.609  -9.015 -12.116
ATOM   1225  C   PHE    74       6.786  -9.711  -8.357
ATOM   1226  O   PHE    74       7.703 -10.504  -8.574
ATOM   1227  N   TYR    75       6.349  -9.404  -7.134
ATOM   1228  H   TYR    75       5.537  -8.805  -7.073
ATOM   1229  CA  TYR    75       6.737 -10.003  -5.869
ATOM   1230  HA  TYR    75       7.097 -11.018  -6.027
ATOM   1231  CB  TYR    75       7.851  -9.161  -5.216
ATOM   1232 2HB  TYR    75       7.560  -8.109  -5.212
ATOM   1233 3HB  TYR    75       7.979  -9.464  -4.176
ATOM   1234  CG  TYR    75       9.198  -9.327  -5.891
ATOM   1235  CD1 TYR    75       9.710  -8.325  -6.740
ATOM   1236  HD1 TYR    75       9.147  -7.419  -6.911
ATOM   1237  CE1 TYR    75      10.953  -8.503  -7.374
ATOM   1238  HE1 TYR    75      11.341  -7.734  -8.028
ATOM   1239  CZ  TYR    75      11.695  -9.685  -7.146
ATOM   1240  OH  TYR    75      12.914  -9.862  -7.720
ATOM   1241  HH  TYR    75      13.118  -9.169  -8.367
ATOM   1242  CE2 TYR    75      11.175 -10.694  -6.306
ATOM   1243  HE2 TYR    75      11.737 -11.601  -6.136
ATOM   1244  CD2 TYR    75       9.930 -10.512  -5.682
ATOM   1245  HD2 TYR    75       9.540 -11.288  -5.038
ATOM   1246  C   TYR    75       5.452 -10.089  -5.036
ATOM   1247  O   TYR    75       4.351  -9.946  -5.576
ATOM   1248  N   ASP    76       5.564 -10.287  -3.722
ATOM   1249  H   ASP    76       6.485 -10.425  -3.334
ATOM   1250  CA  ASP    76       4.443 -10.344  -2.776
ATOM   1251  HA  ASP    76       3.727 -11.061  -3.177
ATOM   1252  CB  ASP    76       4.960 -10.891  -1.434
ATOM   1253 2HB  ASP    76       5.550 -11.790  -1.625
ATOM   1254 3HB  ASP    76       5.624 -10.149  -0.984
ATOM   1255  CG  ASP    76       3.830 -11.257  -0.452
ATOM   1256  OD1 ASP    76       2.898 -12.000  -0.837
ATOM   1257  OD2 ASP    76       3.906 -10.868   0.736
ATOM   1258  C   ASP    76       3.709  -8.992  -2.610
ATOM   1259  O   ASP    76       3.011  -8.774  -1.619
ATOM   1260  N   LYS    77       3.863  -8.059  -3.559
ATOM   1261  H   LYS    77       4.319  -8.330  -4.427
ATOM   1262  CA  LYS    77       3.162  -6.782  -3.609
ATOM   1263  HA  LYS    77       2.265  -6.861  -3.000
ATOM   1264  CB  LYS    77       4.049  -5.638  -3.079
ATOM   1265 2HB  LYS    77       5.018  -5.657  -3.581
ATOM   1266 3HB  LYS    77       3.562  -4.694  -3.325
ATOM   1267  CG  LYS    77       4.251  -5.695  -1.557
ATOM   1268 2HG  LYS    77       3.275  -5.777  -1.076
ATOM   1269 3HG  LYS    77       4.845  -6.574  -1.302
ATOM   1270  CD  LYS    77       4.959  -4.440  -1.027
ATOM   1271 2HD  LYS    77       5.961  -4.379  -1.451
ATOM   1272 3HD  LYS    77       4.394  -3.555  -1.325
ATOM   1273  CE  LYS    77       5.032  -4.504   0.506
ATOM   1274 2HE  LYS    77       4.014  -4.581   0.895
ATOM   1275 3HE  LYS    77       5.576  -5.403   0.805
ATOM   1276  NZ  LYS    77       5.686  -3.313   1.102
ATOM   1277 1HZ  LYS    77       6.695  -3.315   0.939
ATOM   1278 2HZ  LYS    77       5.297  -2.453   0.745
ATOM   1279 3HZ  LYS    77       5.567  -3.312   2.104
ATOM   1280  C   LYS    77       2.780  -6.521  -5.069
ATOM   1281  O   LYS    77       3.597  -6.802  -5.952
ATOM   1282  N   PRO    78       1.575  -5.992  -5.347
ATOM   1283  CD  PRO    78       0.507  -5.698  -4.401
ATOM   1284 2HD  PRO    78       0.877  -5.137  -3.543
ATOM   1285 3HD  PRO    78       0.053  -6.634  -4.075
ATOM   1286  CG  PRO    78      -0.523  -4.865  -5.165
ATOM   1287 2HG  PRO    78      -0.299  -3.804  -5.042
ATOM   1288 3HG  PRO    78      -1.540  -5.079  -4.836
ATOM   1289  CB  PRO    78      -0.301  -5.273  -6.621
ATOM   1290 2HB  PRO    78      -0.592  -4.481  -7.312
ATOM   1291 3HB  PRO    78      -0.863  -6.184  -6.830
ATOM   1292  CA  PRO    78       1.198  -5.579  -6.688
ATOM   1293  HA  PRO    78       1.374  -6.389  -7.397
ATOM   1294  C   PRO    78       2.027  -4.353  -7.070
ATOM   1295  O   PRO    78       2.140  -3.401  -6.292
ATOM   1296  N   MET    79       2.609  -4.368  -8.266
ATOM   1297  H   MET    79       2.515  -5.193  -8.849
ATOM   1298  CA  MET    79       3.414  -3.266  -8.773
ATOM   1299  HA  MET    79       4.228  -3.078  -8.070
ATOM   1300  CB  MET    79       3.996  -3.642 -10.140
ATOM   1301 2HB  MET    79       3.195  -4.018 -10.775
ATOM   1302 3HB  MET    79       4.435  -2.764 -10.616
ATOM   1303  CG  MET    79       5.074  -4.713  -9.998
ATOM   1304 2HG  MET    79       4.686  -5.528  -9.388
ATOM   1305 3HG  MET    79       5.286  -5.116 -10.988
ATOM   1306  SD  MET    79       6.621  -4.130  -9.250
ATOM   1307  CE  MET    79       7.585  -3.883 -10.761
ATOM   1308 1HE  MET    79       7.537  -4.784 -11.372
ATOM   1309 2HE  MET    79       7.181  -3.040 -11.322
ATOM   1310 3HE  MET    79       8.625  -3.688 -10.504
ATOM   1311  C   MET    79       2.570  -2.002  -8.895
ATOM   1312  O   MET    79       1.369  -2.065  -9.163
ATOM   1313  N   GLN    80       3.219  -0.849  -8.770
ATOM   1314  H   GLN    80       4.219  -0.859  -8.613
ATOM   1315  CA  GLN    80       2.652   0.456  -9.058
ATOM   1316  HA  GLN    80       1.731   0.354  -9.632
ATOM   1317  CB  GLN    80       2.368   1.235  -7.763
ATOM   1318 2HB  GLN    80       3.292   1.301  -7.190
ATOM   1319 3HB  GLN    80       2.065   2.251  -8.022
ATOM   1320  CG  GLN    80       1.278   0.610  -6.875
ATOM   1321 2HG  GLN    80       1.499  -0.442  -6.690
ATOM   1322 3HG  GLN    80       1.295   1.116  -5.909
ATOM   1323  CD  GLN    80      -0.127   0.754  -7.469
ATOM   1324  OE1 GLN    80      -0.837   1.718  -7.194
ATOM   1325  NE2 GLN    80      -0.565  -0.187  -8.290
ATOM   1326 1HE2 GLN    80      -1.487  -0.121  -8.695
ATOM   1327 2HE2 GLN    80       0.044  -0.964  -8.546
ATOM   1328  C   GLN    80       3.708   1.135  -9.915
ATOM   1329  O   GLN    80       4.884   1.160  -9.535
ATOM   1330  N   ILE    81       3.299   1.614 -11.085
ATOM   1331  H   ILE    81       2.321   1.510 -11.342
ATOM   1332  CA  ILE    81       4.185   2.097 -12.132
ATOM   1333  HA  ILE    81       5.146   2.322 -11.678
ATOM   1334  CB  ILE    81       4.380   1.006 -13.228
ATOM   1335  HB  ILE    81       3.516   1.055 -13.888
ATOM   1336  CG2 ILE    81       5.639   1.298 -14.068
ATOM   1337 1HG2 ILE    81       5.629   2.316 -14.448
ATOM   1338 2HG2 ILE    81       6.532   1.167 -13.461
ATOM   1339 3HG2 ILE    81       5.687   0.633 -14.928
ATOM   1340  CG1 ILE    81       4.429  -0.443 -12.678
ATOM   1341 2HG1 ILE    81       5.159  -0.501 -11.871
ATOM   1342 3HG1 ILE    81       3.443  -0.690 -12.282
ATOM   1343  CD1 ILE    81       4.760  -1.535 -13.701
ATOM   1344 1HD1 ILE    81       5.797  -1.455 -14.022
ATOM   1345 2HD1 ILE    81       4.621  -2.512 -13.238
ATOM   1346 3HD1 ILE    81       4.098  -1.450 -14.563
ATOM   1347  C   ILE    81       3.576   3.381 -12.714
ATOM   1348  O   ILE    81       2.354   3.551 -12.704
ATOM   1349  N   ALA    82       4.417   4.263 -13.250
ATOM   1350  H   ALA    82       5.414   4.058 -13.214
ATOM   1351  CA  ALA    82       4.048   5.436 -14.033
ATOM   1352  HA  ALA    82       3.073   5.275 -14.502
ATOM   1353  CB  ALA    82       3.976   6.667 -13.118
ATOM   1354 1HB  ALA    82       3.683   7.544 -13.697
ATOM   1355 2HB  ALA    82       3.237   6.503 -12.333
ATOM   1356 3HB  ALA    82       4.950   6.853 -12.665
ATOM   1357  C   ALA    82       5.103   5.630 -15.128
ATOM   1358  O   ALA    82       6.175   5.022 -15.077
ATOM   1359  N   TYR    83       4.813   6.473 -16.118
ATOM   1360  H   TYR    83       3.973   7.029 -16.064
ATOM   1361  CA  TYR    83       5.790   6.855 -17.131
ATOM   1362  HA  TYR    83       6.456   6.012 -17.323
ATOM   1363  CB  TYR    83       5.096   7.204 -18.457
ATOM   1364 2HB  TYR    83       5.869   7.462 -19.182
ATOM   1365 3HB  TYR    83       4.606   6.307 -18.836
ATOM   1366  CG  TYR    83       4.069   8.324 -18.419
ATOM   1367  CD1 TYR    83       4.410   9.603 -18.898
ATOM   1368  HD1 TYR    83       5.407   9.798 -19.268
ATOM   1369  CE1 TYR    83       3.458  10.636 -18.903
ATOM   1370  HE1 TYR    83       3.736  11.614 -19.271
ATOM   1371  CZ  TYR    83       2.155  10.401 -18.405
ATOM   1372  OH  TYR    83       1.229  11.401 -18.374
ATOM   1373  HH  TYR    83       1.578  12.254 -18.676
ATOM   1374  CE2 TYR    83       1.807   9.114 -17.937
ATOM   1375  HE2 TYR    83       0.812   8.928 -17.557
ATOM   1376  CD2 TYR    83       2.761   8.081 -17.949
ATOM   1377  HD2 TYR    83       2.485   7.100 -17.589
ATOM   1378  C   TYR    83       6.613   8.015 -16.570
ATOM   1379  O   TYR    83       6.081   8.878 -15.862
ATOM   1380  N   SER    84       7.916   8.024 -16.847
ATOM   1381  H   SER    84       8.334   7.300 -17.422
ATOM   1382  CA  SER    84       8.800   9.076 -16.372
ATOM   1383  HA  SER    84       8.654   9.181 -15.297
ATOM   1384  CB  SER    84      10.249   8.660 -16.621
ATOM   1385 2HB  SER    84      10.422   8.591 -17.693
ATOM   1386 3HB  SER    84      10.930   9.400 -16.199
ATOM   1387  OG  SER    84      10.483   7.397 -16.019
ATOM   1388  HG  SER    84      10.434   7.504 -15.059
ATOM   1389  C   SER    84       8.467  10.418 -17.037
ATOM   1390  O   SER    84       7.789  10.469 -18.068
ATOM   1391  N   LYS    85       8.964  11.508 -16.442
ATOM   1392  H   LYS    85       9.434  11.371 -15.544
ATOM   1393  CA  LYS    85       8.610  12.893 -16.780
ATOM   1394  HA  LYS    85       9.159  13.516 -16.074
ATOM   1395  CB  LYS    85       9.084  13.305 -18.190
ATOM   1396 2HB  LYS    85       8.454  12.834 -18.946
ATOM   1397 3HB  LYS    85       8.967  14.386 -18.285
ATOM   1398  CG  LYS    85      10.553  12.943 -18.464
ATOM   1399 2HG  LYS    85      11.174  13.300 -17.641
ATOM   1400 3HG  LYS    85      10.648  11.858 -18.533
ATOM   1401  CD  LYS    85      11.049  13.573 -19.772
ATOM   1402 2HD  LYS    85      10.358  13.332 -20.582
ATOM   1403 3HD  LYS    85      11.089  14.657 -19.652
ATOM   1404  CE  LYS    85      12.446  13.032 -20.106
ATOM   1405 2HE  LYS    85      13.103  13.207 -19.250
ATOM   1406 3HE  LYS    85      12.376  11.951 -20.259
ATOM   1407  NZ  LYS    85      13.028  13.675 -21.312
ATOM   1408 1HZ  LYS    85      13.944  13.297 -21.511
ATOM   1409 2HZ  LYS    85      12.454  13.527 -22.128
ATOM   1410 3HZ  LYS    85      13.136  14.669 -21.180
ATOM   1411  C   LYS    85       7.123  13.173 -16.515
ATOM   1412  O   LYS    85       6.521  14.046 -17.140
ATOM   1413  N   SER    86       6.533  12.429 -15.582
ATOM   1414  H   SER    86       7.088  11.694 -15.165
ATOM   1415  CA  SER    86       5.211  12.602 -14.981
ATOM   1416  HA  SER    86       5.066  13.644 -14.694
ATOM   1417  CB  SER    86       4.111  12.186 -15.968
ATOM   1418 2HB  SER    86       4.360  11.215 -16.398
ATOM   1419 3HB  SER    86       3.158  12.106 -15.443
ATOM   1420  OG  SER    86       3.979  13.158 -16.991
ATOM   1421  HG  SER    86       4.872  13.507 -17.172
ATOM   1422  C   SER    86       5.237  11.746 -13.705
ATOM   1423  O   SER    86       4.357  10.921 -13.454
ATOM   1424  N   ASP    87       6.317  11.901 -12.932
ATOM   1425  H   ASP    87       6.960  12.658 -13.123
ATOM   1426  CA  ASP    87       6.684  11.055 -11.806
ATOM   1427  HA  ASP    87       5.791  10.580 -11.397
ATOM   1428  CB  ASP    87       7.653   9.965 -12.289
ATOM   1429 2HB  ASP    87       7.720   9.196 -11.520
ATOM   1430 3HB  ASP    87       7.263   9.492 -13.192
ATOM   1431  CG  ASP    87       9.056  10.532 -12.550
ATOM   1432  OD1 ASP    87       9.304  10.999 -13.687
ATOM   1433  OD2 ASP    87       9.878  10.521 -11.608
ATOM   1434  C   ASP    87       7.352  11.884 -10.708
ATOM   1435  O   ASP    87       7.691  13.055 -10.908
ATOM   1436  N   SER    88       7.537  11.255  -9.549
ATOM   1437  H   SER    88       7.248  10.292  -9.457
ATOM   1438  CA  SER    88       7.975  11.879  -8.314
ATOM   1439  HA  SER    88       7.193  12.569  -7.997
ATOM   1440  CB  SER    88       8.101  10.789  -7.242
ATOM   1441 2HB  SER    88       8.963  10.159  -7.469
ATOM   1442 3HB  SER    88       8.254  11.257  -6.269
ATOM   1443  OG  SER    88       6.930   9.983  -7.211
ATOM   1444  HG  SER    88       7.054   9.311  -6.520
ATOM   1445  C   SER    88       9.283  12.668  -8.436
ATOM   1446  O   SER    88       9.451  13.641  -7.703
ATOM   1447  N   ASP    89      10.202  12.303  -9.338
ATOM   1448  H   ASP    89      10.002  11.558 -10.007
ATOM   1449  CA  ASP    89      11.468  13.022  -9.474
ATOM   1450  HA  ASP    89      11.925  13.124  -8.492
ATOM   1451  CB  ASP    89      12.444  12.269 -10.380
ATOM   1452 2HB  ASP    89      12.672  11.298  -9.940
ATOM   1453 3HB  ASP    89      11.991  12.112 -11.360
ATOM   1454  CG  ASP    89      13.735  13.078 -10.547
ATOM   1455  OD1 ASP    89      13.931  13.711 -11.608
ATOM   1456  OD2 ASP    89      14.571  13.092  -9.619
ATOM   1457  C   ASP    89      11.241  14.426 -10.019
ATOM   1458  O   ASP    89      11.754  15.395  -9.455
ATOM   1459  N   ILE    90      10.430  14.559 -11.072
ATOM   1460  H   ILE    90       9.961  13.742 -11.437
ATOM   1461  CA  ILE    90      10.141  15.882 -11.618
ATOM   1462  HA  ILE    90      11.091  16.415 -11.662
ATOM   1463  CB  ILE    90       9.595  15.866 -13.061
ATOM   1464  HB  ILE    90       9.557  16.913 -13.369
ATOM   1465  CG2 ILE    90      10.599  15.156 -13.984
ATOM   1466 1HG2 ILE    90      11.597  15.565 -13.822
ATOM   1467 2HG2 ILE    90      10.615  14.086 -13.775
ATOM   1468 3HG2 ILE    90      10.328  15.319 -15.025
ATOM   1469  CG1 ILE    90       8.179  15.276 -13.237
ATOM   1470 2HG1 ILE    90       8.235  14.190 -13.322
ATOM   1471 3HG1 ILE    90       7.553  15.519 -12.382
ATOM   1472  CD1 ILE    90       7.482  15.856 -14.473
ATOM   1473 1HD1 ILE    90       7.384  16.937 -14.368
ATOM   1474 2HD1 ILE    90       8.053  15.637 -15.374
ATOM   1475 3HD1 ILE    90       6.486  15.427 -14.563
ATOM   1476  C   ILE    90       9.248  16.667 -10.661
ATOM   1477  O   ILE    90       9.412  17.881 -10.552
ATOM   1478  N   VAL    91       8.354  15.995  -9.927
ATOM   1479  H   VAL    91       8.244  14.995 -10.065
ATOM   1480  CA  VAL    91       7.527  16.659  -8.930
ATOM   1481  HA  VAL    91       7.016  17.478  -9.432
ATOM   1482  CB  VAL    91       6.457  15.689  -8.386
ATOM   1483  HB  VAL    91       6.947  14.786  -8.025
ATOM   1484  CG1 VAL    91       5.654  16.296  -7.227
ATOM   1485 1HG1 VAL    91       5.193  17.234  -7.540
ATOM   1486 2HG1 VAL    91       4.875  15.601  -6.910
ATOM   1487 3HG1 VAL    91       6.309  16.482  -6.376
ATOM   1488  CG2 VAL    91       5.463  15.298  -9.492
ATOM   1489 1HG2 VAL    91       4.926  16.179  -9.845
ATOM   1490 2HG2 VAL    91       5.979  14.845 -10.336
ATOM   1491 3HG2 VAL    91       4.745  14.574  -9.106
ATOM   1492  C   VAL    91       8.441  17.253  -7.848
ATOM   1493  O   VAL    91       8.305  18.428  -7.506
ATOM   1494  N   ALA    92       9.422  16.488  -7.359
ATOM   1495  H   ALA    92       9.508  15.524  -7.667
ATOM   1496  CA  ALA    92      10.386  16.975  -6.385
ATOM   1497  HA  ALA    92       9.836  17.364  -5.528
ATOM   1498  CB  ALA    92      11.265  15.815  -5.905
ATOM   1499 1HB  ALA    92      11.923  16.162  -5.110
ATOM   1500 2HB  ALA    92      10.638  15.015  -5.508
ATOM   1501 3HB  ALA    92      11.866  15.427  -6.728
ATOM   1502  C   ALA    92      11.230  18.116  -6.963
ATOM   1503  O   ALA    92      11.559  19.055  -6.239
ATOM   1504  N   LYS    93      11.582  18.077  -8.254
ATOM   1505  H   LYS    93      11.360  17.252  -8.803
ATOM   1506  CA  LYS    93      12.324  19.172  -8.881
ATOM   1507  HA  LYS    93      13.200  19.385  -8.267
ATOM   1508  CB  LYS    93      12.809  18.786 -10.286
ATOM   1509 2HB  LYS    93      12.011  18.287 -10.833
ATOM   1510 3HB  LYS    93      13.073  19.696 -10.829
ATOM   1511  CG  LYS    93      14.056  17.890 -10.225
ATOM   1512 2HG  LYS    93      14.869  18.457  -9.769
ATOM   1513 3HG  LYS    93      13.854  17.013  -9.612
ATOM   1514  CD  LYS    93      14.483  17.443 -11.630
ATOM   1515 2HD  LYS    93      13.740  16.755 -12.036
ATOM   1516 3HD  LYS    93      14.526  18.318 -12.282
ATOM   1517  CE  LYS    93      15.868  16.780 -11.646
ATOM   1518 2HE  LYS    93      16.136  16.574 -12.684
ATOM   1519 3HE  LYS    93      16.604  17.478 -11.241
ATOM   1520  NZ  LYS    93      15.912  15.514 -10.881
ATOM   1521 1HZ  LYS    93      15.187  14.868 -11.199
ATOM   1522 2HZ  LYS    93      16.802  15.054 -11.001
ATOM   1523 3HZ  LYS    93      15.773  15.666  -9.892
ATOM   1524  C   LYS    93      11.498  20.455  -8.910
ATOM   1525  O   LYS    93      12.022  21.493  -8.508
ATOM   1526  N   ILE    94      10.227  20.421  -9.331
ATOM   1527  H   ILE    94       9.828  19.549  -9.670
ATOM   1528  CA  ILE    94       9.423  21.647  -9.394
ATOM   1529  HA  ILE    94      10.059  22.414  -9.833
ATOM   1530  CB  ILE    94       8.195  21.513 -10.326
ATOM   1531  HB  ILE    94       7.717  22.493 -10.364
ATOM   1532  CG2 ILE    94       8.666  21.181 -11.756
ATOM   1533 1HG2 ILE    94       9.037  20.158 -11.813
ATOM   1534 2HG2 ILE    94       7.842  21.298 -12.460
ATOM   1535 3HG2 ILE    94       9.461  21.866 -12.055
ATOM   1536  CG1 ILE    94       7.144  20.507  -9.811
ATOM   1537 2HG1 ILE    94       7.596  19.523  -9.759
ATOM   1538 3HG1 ILE    94       6.831  20.795  -8.808
ATOM   1539  CD1 ILE    94       5.881  20.410 -10.675
ATOM   1540 1HD1 ILE    94       5.158  19.762 -10.180
ATOM   1541 2HD1 ILE    94       5.442  21.399 -10.805
ATOM   1542 3HD1 ILE    94       6.118  19.981 -11.649
ATOM   1543  C   ILE    94       9.065  22.160  -7.992
ATOM   1544  O   ILE    94       9.012  23.374  -7.784
ATOM   1545  N   LYS    95       8.877  21.266  -7.013
ATOM   1546  H   LYS    95       8.878  20.278  -7.248
ATOM   1547  CA  LYS    95       8.709  21.652  -5.608
ATOM   1548  HA  LYS    95       7.951  22.436  -5.546
ATOM   1549  CB  LYS    95       8.245  20.444  -4.778
ATOM   1550 2HB  LYS    95       8.871  19.582  -5.010
ATOM   1551 3HB  LYS    95       8.366  20.677  -3.718
ATOM   1552  CG  LYS    95       6.769  20.099  -5.027
ATOM   1553 2HG  LYS    95       6.154  20.962  -4.767
ATOM   1554 3HG  LYS    95       6.613  19.864  -6.080
ATOM   1555  CD  LYS    95       6.341  18.901  -4.169
ATOM   1556 2HD  LYS    95       6.939  18.030  -4.444
ATOM   1557 3HD  LYS    95       6.516  19.134  -3.117
ATOM   1558  CE  LYS    95       4.851  18.602  -4.387
ATOM   1559 2HE  LYS    95       4.277  19.504  -4.161
ATOM   1560 3HE  LYS    95       4.690  18.356  -5.439
ATOM   1561  NZ  LYS    95       4.368  17.488  -3.532
ATOM   1562 1HZ  LYS    95       4.867  16.631  -3.719
ATOM   1563 2HZ  LYS    95       4.473  17.707  -2.552
ATOM   1564 3HZ  LYS    95       3.387  17.312  -3.697
ATOM   1565  C   LYS    95      10.006  22.218  -5.024
ATOM   1566  O   LYS    95       9.954  23.000  -4.075
ATOM   1567  N   GLY    96      11.159  21.814  -5.558
ATOM   1568  H   GLY    96      11.133  21.116  -6.291
ATOM   1569  CA  GLY    96      12.483  22.153  -5.060
ATOM   1570 2HA  GLY    96      13.166  22.248  -5.904
ATOM   1571 3HA  GLY    96      12.448  23.105  -4.529
ATOM   1572  C   GLY    96      13.014  21.079  -4.114
ATOM   1573  O   GLY    96      14.227  20.959  -3.956
ATOM   1574  N   THR    97      12.146  20.254  -3.522
ATOM   1575  H   THR    97      11.172  20.279  -3.790
ATOM   1576  CA  THR    97      12.477  19.234  -2.532
ATOM   1577  HA  THR    97      12.958  19.731  -1.688
ATOM   1578  CB  THR    97      11.164  18.599  -2.039
ATOM   1579  HB  THR    97      11.385  17.674  -1.505
ATOM   1580  CG2 THR    97      10.416  19.549  -1.098
ATOM   1581 1HG2 THR    97       9.503  19.070  -0.742
ATOM   1582 2HG2 THR    97      11.042  19.783  -0.236
ATOM   1583 3HG2 THR    97      10.156  20.474  -1.613
ATOM   1584  OG1 THR    97      10.305  18.328  -3.133
ATOM   1585 1HG  THR    97       9.635  17.695  -2.833
ATOM   1586  C   THR    97      13.473  18.180  -3.047
ATOM   1587  O   THR    97      14.074  17.467  -2.240
ATOM   1588  N   PHE    98      13.703  18.106  -4.365
ATOM   1589  H   PHE    98      13.130  18.674  -4.980
ATOM   1590  CA  PHE    98      14.772  17.309  -4.961
ATOM   1591  HA  PHE    98      14.568  16.258  -4.762
ATOM   1592  CB  PHE    98      14.772  17.523  -6.484
ATOM   1593 2HB  PHE    98      13.849  17.117  -6.893
ATOM   1594 3HB  PHE    98      14.788  18.595  -6.686
ATOM   1595  CG  PHE    98      15.932  16.871  -7.214
ATOM   1596  CD1 PHE    98      16.014  15.468  -7.300
ATOM   1597  HD1 PHE    98      15.238  14.850  -6.868
ATOM   1598  CE1 PHE    98      17.117  14.862  -7.927
ATOM   1599  HE1 PHE    98      17.184  13.783  -7.975
ATOM   1600  CZ  PHE    98      18.137  15.655  -8.482
ATOM   1601  HZ  PHE    98      18.991  15.188  -8.956
ATOM   1602  CE2 PHE    98      18.047  17.057  -8.417
ATOM   1603  HE2 PHE    98      18.831  17.669  -8.843
ATOM   1604  CD2 PHE    98      16.949  17.664  -7.782
ATOM   1605  HD2 PHE    98      16.898  18.743  -7.722
ATOM   1606  C   PHE    98      16.144  17.657  -4.359
ATOM   1607  O   PHE    98      16.987  16.768  -4.213
ATOM   1608  N   LYS    99      16.375  18.929  -4.001
ATOM   1609  H   LYS    99      15.620  19.596  -4.113
ATOM   1610  CA  LYS    99      17.688  19.417  -3.561
ATOM   1611  HA  LYS    99      18.222  18.578  -3.112
ATOM   1612  CB  LYS    99      18.506  19.865  -4.793
ATOM   1613 2HB  LYS    99      19.516  20.130  -4.477
ATOM   1614 3HB  LYS    99      18.602  19.002  -5.453
ATOM   1615  CG  LYS    99      17.911  21.022  -5.624
ATOM   1616 2HG  LYS    99      18.252  20.903  -6.653
ATOM   1617 3HG  LYS    99      16.822  20.961  -5.630
ATOM   1618  CD  LYS    99      18.348  22.416  -5.147
ATOM   1619 2HD  LYS    99      18.073  22.564  -4.105
ATOM   1620 3HD  LYS    99      19.432  22.500  -5.241
ATOM   1621  CE  LYS    99      17.671  23.497  -5.997
ATOM   1622 2HE  LYS    99      17.929  23.341  -7.047
ATOM   1623 3HE  LYS    99      16.588  23.397  -5.889
ATOM   1624  NZ  LYS    99      18.079  24.860  -5.581
ATOM   1625 1HZ  LYS    99      19.075  24.992  -5.672
ATOM   1626 2HZ  LYS    99      17.620  25.561  -6.144
ATOM   1627 3HZ  LYS    99      17.819  25.024  -4.607
ATOM   1628  C   LYS    99      17.631  20.503  -2.484
ATOM   1629  O   LYS    99      18.631  20.707  -1.796
ATOM   1630  N   GLU   100      16.510  21.208  -2.324
ATOM   1631  H   GLU   100      15.703  21.016  -2.905
ATOM   1632  CA  GLU   100      16.353  22.233  -1.296
ATOM   1633  HA  GLU   100      17.193  22.928  -1.363
ATOM   1634  CB  GLU   100      15.037  23.005  -1.509
ATOM   1635 2HB  GLU   100      14.222  22.291  -1.634
ATOM   1636 3HB  GLU   100      14.822  23.597  -0.620
ATOM   1637  CG  GLU   100      15.060  23.949  -2.721
ATOM   1638 2HG  GLU   100      15.371  23.400  -3.612
ATOM   1639 3HG  GLU   100      14.043  24.306  -2.898
ATOM   1640  CD  GLU   100      15.988  25.156  -2.502
ATOM   1641  OE1 GLU   100      17.136  25.130  -2.999
ATOM   1642  OE2 GLU   100      15.571  26.145  -1.856
ATOM   1643  C   GLU   100      16.366  21.582   0.092
ATOM   1644  O   GLU   100      15.901  20.450   0.269
ATOM   1645  N   ARG   101      16.868  22.315   1.092
ATOM   1646  H   ARG   101      17.197  23.250   0.893
ATOM   1647  CA  ARG   101      16.755  21.924   2.499
ATOM   1648  HA  ARG   101      17.094  20.892   2.604
ATOM   1649  CB  ARG   101      17.624  22.847   3.373
ATOM   1650 2HB  ARG   101      17.276  23.875   3.261
ATOM   1651 3HB  ARG   101      17.490  22.551   4.412
ATOM   1652  CG  ARG   101      19.129  22.792   3.073
ATOM   1653 2HG  ARG   101      19.488  21.774   3.228
ATOM   1654 3HG  ARG   101      19.312  23.082   2.037
ATOM   1655  CD  ARG   101      19.888  23.752   4.002
ATOM   1656 2HD  ARG   101      19.534  24.769   3.830
ATOM   1657 3HD  ARG   101      19.688  23.482   5.040
ATOM   1658  NE  ARG   101      21.339  23.697   3.761
ATOM   1659  HE  ARG   101      21.644  23.014   3.080
ATOM   1660  CZ  ARG   101      22.264  24.455   4.365
ATOM   1661  NH1 ARG   101      23.547  24.286   4.058
ATOM   1662 1HH1 ARG   101      23.837  23.597   3.377
ATOM   1663 2HH1 ARG   101      24.278  24.835   4.489
ATOM   1664  NH2 ARG   101      21.925  25.372   5.267
ATOM   1665 1HH2 ARG   101      20.944  25.543   5.527
ATOM   1666 2HH2 ARG   101      22.613  25.947   5.730
ATOM   1667  C   ARG   101      15.283  22.026   2.937
ATOM   1668  O   ARG   101      14.546  22.837   2.367
ATOM   1669  N   PRO   102      14.845  21.291   3.978
ATOM   1670  CD  PRO   102      15.581  20.259   4.696
ATOM   1671 2HD  PRO   102      16.582  20.586   4.975
ATOM   1672 3HD  PRO   102      15.640  19.365   4.074
ATOM   1673  CG  PRO   102      14.760  19.961   5.950
ATOM   1674 2HG  PRO   102      15.059  20.637   6.753
ATOM   1675 3HG  PRO   102      14.867  18.923   6.265
ATOM   1676  CB  PRO   102      13.329  20.278   5.516
ATOM   1677 2HB  PRO   102      12.701  20.550   6.365
ATOM   1678 3HB  PRO   102      12.910  19.413   4.999
ATOM   1679  CA  PRO   102      13.494  21.431   4.519
ATOM   1680  HA  PRO   102      12.768  21.312   3.715
ATOM   1681  C   PRO   102      13.273  22.804   5.175
ATOM   1682  O   PRO   102      12.153  23.320   5.169
ATOM   1683  N   LYS   103      14.338  23.411   5.707
ATOM   1684  H   LYS   103      15.230  22.935   5.666
ATOM   1685  CA  LYS   103      14.404  24.789   6.192
ATOM   1686  HA  LYS   103      13.753  25.412   5.574
ATOM   1687  CB  LYS   103      13.937  24.885   7.658
ATOM   1688 2HB  LYS   103      14.001  25.928   7.973
ATOM   1689 3HB  LYS   103      12.888  24.589   7.708
ATOM   1690  CG  LYS   103      14.742  24.019   8.644
ATOM   1691 2HG  LYS   103      14.666  22.970   8.357
ATOM   1692 3HG  LYS   103      15.791  24.317   8.621
ATOM   1693  CD  LYS   103      14.211  24.181  10.075
ATOM   1694 2HD  LYS   103      14.288  25.229  10.371
ATOM   1695 3HD  LYS   103      13.163  23.877  10.107
ATOM   1696  CE  LYS   103      15.028  23.313  11.042
ATOM   1697 2HE  LYS   103      14.956  22.270  10.726
ATOM   1698 3HE  LYS   103      16.077  23.612  10.983
ATOM   1699  NZ  LYS   103      14.558  23.438  12.444
ATOM   1700 1HZ  LYS   103      13.596  23.147  12.536
ATOM   1701 2HZ  LYS   103      15.110  22.858  13.058
ATOM   1702 3HZ  LYS   103      14.634  24.388  12.774
ATOM   1703  C   LYS   103      15.849  25.260   6.014
ATOM   1704  O   LYS   103      16.744  24.417   5.921
ATOM   1705  N   LYS   104      16.070  26.575   5.922
ATOM   1706  H   LYS   104      15.299  27.214   6.035
ATOM   1707  CA  LYS   104      17.399  27.133   5.671
ATOM   1708  HA  LYS   104      17.720  26.749   4.702
ATOM   1709  CB  LYS   104      17.365  28.668   5.555
ATOM   1710 2HB  LYS   104      18.371  29.006   5.304
ATOM   1711 3HB  LYS   104      16.709  28.935   4.725
ATOM   1712  CG  LYS   104      16.901  29.416   6.818
ATOM   1713 2HG  LYS   104      15.907  29.070   7.106
ATOM   1714 3HG  LYS   104      17.597  29.221   7.633
ATOM   1715  CD  LYS   104      16.849  30.930   6.567
ATOM   1716 2HD  LYS   104      17.841  31.280   6.277
ATOM   1717 3HD  LYS   104      16.146  31.137   5.758
ATOM   1718  CE  LYS   104      16.398  31.661   7.839
ATOM   1719 2HE  LYS   104      15.412  31.290   8.128
ATOM   1720 3HE  LYS   104      17.097  31.427   8.646
ATOM   1721  NZ  LYS   104      16.337  33.132   7.651
ATOM   1722 1HZ  LYS   104      16.039  33.587   8.501
ATOM   1723 2HZ  LYS   104      17.240  33.508   7.405
ATOM   1724 3HZ  LYS   104      15.681  33.381   6.926
ATOM   1725  C   LYS   104      18.405  26.627   6.703
ATOM   1726  O   LYS   104      19.524  26.266   6.286
ATOM   1727  OXT LYS   104      18.084  26.589   7.912
TER   
END   

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   MET   1           HA       MET   1   0.702 -16.049   2.180
    2    H1   MET   1           H1       MET   1   0.846 -15.865   4.543
    3    H2   MET   1           H2       MET   1   1.222 -14.278   4.461
    4    H3   MET   1           H3       MET   1  -0.262 -14.797   3.981
    5    HB2  MET   1           HB2      MET   1  -0.048 -13.705   1.778
    6    HB3  MET   1           HB3      MET   1   1.578 -13.125   2.162
    7    HG2  MET   1           HG2      MET   1   2.479 -14.433   0.237
    8    HG3  MET   1           HG3      MET   1   0.856 -15.041  -0.094
    9    HE1  MET   1           HE1      MET   1   3.375 -12.092  -0.344
   10    HE2  MET   1           HE2      MET   1   2.374 -10.730  -0.894
   11    HE3  MET   1           HE3      MET   1   2.211 -11.331   0.768
   12    H    GLU   2           H        GLU   2   2.469 -17.179   1.448
   13    HA   GLU   2           HA       GLU   2   5.187 -16.197   1.971
   14    HB2  GLU   2           HB2      GLU   2   4.142 -18.962   2.751
   15    HB3  GLU   2           HB3      GLU   2   5.848 -18.614   2.512
   16    HG2  GLU   2           HG2      GLU   2   4.048 -17.343   4.617
   17    HG3  GLU   2           HG3      GLU   2   5.235 -18.612   4.884
   18    H    MET   3           H        MET   3   6.477 -16.619   0.185
   19    HA   MET   3           HA       MET   3   5.171 -17.418  -2.245
   20    HB2  MET   3           HB2      MET   3   8.159 -17.049  -1.749
   21    HB3  MET   3           HB3      MET   3   7.286 -16.914  -3.271
   22    HG2  MET   3           HG2      MET   3   7.489 -14.690  -2.746
   23    HG3  MET   3           HG3      MET   3   5.936 -15.013  -2.004
   24    HE1  MET   3           HE1      MET   3   7.478 -12.415  -1.224
   25    HE2  MET   3           HE2      MET   3   5.978 -12.937  -0.414
   26    HE3  MET   3           HE3      MET   3   7.387 -12.443   0.551
   27    H    LEU   4           H        LEU   4   6.118 -19.095  -3.747
   28    HA   LEU   4           HA       LEU   4   6.971 -21.543  -2.273
   29    HG   LEU   4           HG       LEU   4   4.991 -22.942  -2.108
   30    HB2  LEU   4           HB2      LEU   4   5.096 -21.221  -4.632
   31    HB3  LEU   4           HB3      LEU   4   6.008 -22.694  -4.366
   32   HD11  LEU   4          HD11      LEU   4   4.245 -20.719  -1.525
   33   HD12  LEU   4          HD12      LEU   4   3.233 -20.612  -2.983
   34   HD13  LEU   4          HD13      LEU   4   2.824 -21.739  -1.672
   35   HD21  LEU   4          HD21      LEU   4   2.827 -23.755  -2.972
   36   HD22  LEU   4          HD22      LEU   4   3.042 -22.788  -4.451
   37   HD23  LEU   4          HD23      LEU   4   4.139 -24.140  -4.093
   38    HA   PRO   5           HA       PRO   5  10.657 -21.168  -4.724
   39    HB2  PRO   5           HB2      PRO   5  10.559 -24.171  -4.927
   40    HB3  PRO   5           HB3      PRO   5  11.926 -23.103  -4.468
   41    HG2  PRO   5           HG2      PRO   5  10.551 -24.441  -2.567
   42    HG3  PRO   5           HG3      PRO   5  11.043 -22.733  -2.311
   43    HD2  PRO   5           HD2      PRO   5   8.334 -23.801  -3.141
   44    HD3  PRO   5           HD3      PRO   5   8.752 -22.525  -1.955
   45    H    ASN   6           H        ASN   6  11.129 -20.802  -6.768
   46    HA   ASN   6           HA       ASN   6  10.470 -22.546  -8.956
   47    HB2  ASN   6           HB2      ASN   6   8.408 -21.042  -8.912
   48    HB3  ASN   6           HB3      ASN   6   9.484 -19.644  -9.070
   49   HD21  ASN   6          HD22      ASN   6   8.243 -22.562 -10.707
   50   HD22  ASN   6          HD21      ASN   6   8.830 -22.126 -12.291
   51    H    GLN   7           H        GLN   7  12.111 -22.037 -10.674
   52    HA   GLN   7           HA       GLN   7  14.447 -20.856  -9.494
   53    HB2  GLN   7           HB2      GLN   7  14.345 -22.790 -11.164
   54    HB3  GLN   7           HB3      GLN   7  14.116 -21.573 -12.433
   55    HG2  GLN   7           HG2      GLN   7  16.270 -20.530 -11.826
   56    HG3  GLN   7           HG3      GLN   7  16.447 -21.620 -10.452
   57   HE21  GLN   7          HE22      GLN   7  18.549 -21.521 -11.926
   58   HE22  GLN   7          HE21      GLN   7  18.722 -22.900 -13.008
   59    H    THR   8           H        THR   8  11.803 -19.367 -11.130
   60    HA   THR   8           HA       THR   8  13.455 -16.975 -11.748
   61    HB   THR   8           HB       THR   8  10.920 -17.845 -13.171
   62    HG1  THR   8           HG1      THR   8  12.422 -19.393 -13.603
   63   HG21  THR   8          HG21      THR   8  13.117 -15.877 -13.939
   64   HG22  THR   8          HG22      THR   8  11.735 -16.333 -14.959
   65   HG23  THR   8          HG23      THR   8  11.474 -15.453 -13.450
   66    H    ILE   9           H        ILE   9  12.548 -14.994 -11.242
   67    HA   ILE   9           HA       ILE   9  10.057 -14.969  -9.648
   68    HB   ILE   9           HB       ILE   9  10.976 -13.485  -8.017
   69   HG12  ILE   9          HG12      ILE   9  13.648 -13.659  -9.456
   70   HG13  ILE   9          HG13      ILE   9  12.574 -12.251  -9.447
   71   HG21  ILE   9          HG21      ILE   9  12.548 -14.971  -6.835
   72   HG22  ILE   9          HG22      ILE   9  11.294 -15.936  -7.638
   73   HG23  ILE   9          HG23      ILE   9  12.930 -15.811  -8.327
   74   HD11  ILE   9          HD11      ILE   9  12.848 -12.138  -6.939
   75   HD12  ILE   9          HD12      ILE   9  14.124 -13.372  -7.089
   76   HD13  ILE   9          HD13      ILE   9  14.308 -11.806  -7.890
   77    H    TYR  10           H        TYR  10   9.073 -12.855  -9.662
   78    HA   TYR  10           HA       TYR  10   9.522 -11.356 -12.207
   79    HD1  TYR  10           HD2      TYR  10   8.001 -10.546 -14.018
   80    HD2  TYR  10           HD1      TYR  10   5.109 -11.119 -10.865
   81    HE1  TYR  10           HE2      TYR  10   6.568  -8.814 -15.031
   82    HE2  TYR  10           HE1      TYR  10   3.656  -9.394 -11.882
   83    HH   TYR  10           HH       TYR  10   4.544  -7.650 -14.897
   84    HB2  TYR  10           HB2      TYR  10   7.640 -12.852 -12.505
   85    HB3  TYR  10           HB3      TYR  10   7.008 -12.474 -10.911
   86    H    ILE  11           H        ILE  11   9.494  -9.187 -11.927
   87    HA   ILE  11           HA       ILE  11   9.006  -8.057  -9.205
   88    HB   ILE  11           HB       ILE  11  11.124  -7.421 -11.310
   89   HG12  ILE  11          HG12      ILE  11  11.557  -8.353  -8.441
   90   HG13  ILE  11          HG13      ILE  11  11.541  -9.459  -9.817
   91   HG21  ILE  11          HG21      ILE  11  11.960  -5.687  -9.787
   92   HG22  ILE  11          HG22      ILE  11  10.301  -5.344 -10.225
   93   HG23  ILE  11          HG23      ILE  11  10.655  -6.040  -8.627
   94   HD11  ILE  11          HD11      ILE  11  13.813  -8.983  -9.253
   95   HD12  ILE  11          HD12      ILE  11  13.456  -8.236 -10.823
   96   HD13  ILE  11          HD13      ILE  11  13.554  -7.236  -9.354
   97    H    ASN  12           H        ASN  12   7.642  -6.256  -9.257
   98    HA   ASN  12           HA       ASN  12   6.759  -5.238 -11.913
   99    HB2  ASN  12           HB2      ASN  12   4.445  -5.733 -11.444
  100    HB3  ASN  12           HB3      ASN  12   5.398  -7.197 -11.393
  101   HD21  ASN  12          HD22      ASN  12   5.571  -8.369  -9.404
  102   HD22  ASN  12          HD21      ASN  12   4.597  -7.957  -8.017
  103    H    ASN  13           H        ASN  13   8.158  -4.005  -9.406
  104    HA   ASN  13           HA       ASN  13   6.639  -1.573  -9.745
  105    HB2  ASN  13           HB2      ASN  13   5.657  -2.612  -7.654
  106    HB3  ASN  13           HB3      ASN  13   7.238  -2.397  -6.885
  107   HD21  ASN  13          HD22      ASN  13   6.857  -0.674  -5.427
  108   HD22  ASN  13          HD21      ASN  13   6.048   0.816  -5.870
  109    H    LEU  14           H        LEU  14   9.022  -2.228 -10.894
  110    HA   LEU  14           HA       LEU  14  11.280  -0.972  -9.487
  111    HG   LEU  14           HG       LEU  14  11.556  -3.463 -10.892
  112    HB2  LEU  14           HB2      LEU  14  10.668  -1.577 -12.408
  113    HB3  LEU  14           HB3      LEU  14  12.090  -0.674 -11.945
  114   HD11  LEU  14          HD11      LEU  14  12.980  -4.321 -12.648
  115   HD12  LEU  14          HD12      LEU  14  11.588  -3.508 -13.358
  116   HD13  LEU  14          HD13      LEU  14  13.164  -2.690 -13.347
  117   HD21  LEU  14          HD21      LEU  14  13.961  -3.491 -10.474
  118   HD22  LEU  14          HD22      LEU  14  14.117  -1.836 -11.111
  119   HD23  LEU  14          HD23      LEU  14  13.201  -2.147  -9.619
  120    H    ASN  15           H        ASN  15  12.039   1.214  -9.958
  121    HA   ASN  15           HA       ASN  15   9.903   3.156 -10.530
  122    HB2  ASN  15           HB2      ASN  15  11.755   3.690  -8.944
  123    HB3  ASN  15           HB3      ASN  15  12.912   3.606 -10.276
  124   HD21  ASN  15          HD22      ASN  15  11.627   5.898  -8.448
  125   HD22  ASN  15          HD21      ASN  15  11.268   7.129  -9.629
  126    H    GLU  16           H        GLU  16   9.285   3.584 -12.550
  127    HA   GLU  16           HA       GLU  16  10.300   2.174 -14.735
  128    HB2  GLU  16           HB2      GLU  16   8.764   3.601 -16.083
  129    HB3  GLU  16           HB3      GLU  16   8.011   2.807 -14.713
  130    HG2  GLU  16           HG2      GLU  16   9.007   5.634 -14.317
  131    HG3  GLU  16           HG3      GLU  16   7.594   5.382 -15.329
  132    H    LYS  17           H        LYS  17  11.614   5.171 -13.479
  133    HA   LYS  17           HA       LYS  17  12.657   6.131 -15.955
  134    HB2  LYS  17           HB2      LYS  17  13.960   7.607 -14.748
  135    HB3  LYS  17           HB3      LYS  17  12.490   7.402 -13.800
  136    HG2  LYS  17           HG2      LYS  17  13.827   5.711 -12.367
  137    HG3  LYS  17           HG3      LYS  17  15.264   6.246 -13.259
  138    HD2  LYS  17           HD2      LYS  17  14.824   8.580 -12.589
  139    HD3  LYS  17           HD3      LYS  17  13.396   8.050 -11.671
  140    HE2  LYS  17           HE2      LYS  17  14.833   6.637 -10.227
  141    HE3  LYS  17           HE3      LYS  17  16.260   7.107 -11.160
  142    HZ1  LYS  17           HZ1      LYS  17  16.066   8.404  -9.134
  143    HZ2  LYS  17           HZ2      LYS  17  15.917   9.390 -10.420
  144    HZ3  LYS  17           HZ3      LYS  17  14.596   8.967  -9.557
  145    H    ILE  18           H        ILE  18  13.626   3.461 -13.911
  146    HA   ILE  18           HA       ILE  18  16.406   3.416 -14.523
  147    HB   ILE  18           HB       ILE  18  14.471   1.287 -13.523
  148   HG12  ILE  18          HG12      ILE  18  14.502   3.153 -11.983
  149   HG13  ILE  18          HG13      ILE  18  15.392   1.827 -11.278
  150   HG21  ILE  18          HG21      ILE  18  16.504   0.192 -14.345
  151   HG22  ILE  18          HG22      ILE  18  17.493   1.232 -13.294
  152   HG23  ILE  18          HG23      ILE  18  16.356   0.075 -12.592
  153   HD11  ILE  18          HD11      ILE  18  17.536   3.002 -11.875
  154   HD12  ILE  18          HD12      ILE  18  16.586   4.336 -12.563
  155   HD13  ILE  18          HD13      ILE  18  16.475   3.981 -10.844
  156    H    LYS  19           H        LYS  19  17.435   2.865 -16.301
  157    HA   LYS  19           HA       LYS  19  16.091   1.803 -18.651
  158    HB2  LYS  19           HB2      LYS  19  19.047   2.181 -17.964
  159    HB3  LYS  19           HB3      LYS  19  18.444   1.742 -19.563
  160    HG2  LYS  19           HG2      LYS  19  17.228   3.858 -19.752
  161    HG3  LYS  19           HG3      LYS  19  17.726   4.328 -18.117
  162    HD2  LYS  19           HD2      LYS  19  20.111   4.245 -18.820
  163    HD3  LYS  19           HD3      LYS  19  19.599   3.827 -20.472
  164    HE2  LYS  19           HE2      LYS  19  18.335   5.960 -20.619
  165    HE3  LYS  19           HE3      LYS  19  18.815   6.367 -18.966
  166    HZ1  LYS  19           HZ1      LYS  19  20.682   6.041 -21.246
  167    HZ2  LYS  19           HZ2      LYS  19  20.222   7.459 -20.590
  168    HZ3  LYS  19           HZ3      LYS  19  21.122   6.420 -19.717
  169    H    LYS  20           H        LYS  20  16.932  -0.195 -19.780
  170    HA   LYS  20           HA       LYS  20  16.697  -2.549 -18.210
  171    HB2  LYS  20           HB2      LYS  20  16.353  -2.439 -20.690
  172    HB3  LYS  20           HB3      LYS  20  18.093  -2.170 -20.905
  173    HG2  LYS  20           HG2      LYS  20  18.518  -4.407 -19.805
  174    HG3  LYS  20           HG3      LYS  20  16.771  -4.660 -19.728
  175    HD2  LYS  20           HD2      LYS  20  16.659  -4.541 -22.212
  176    HD3  LYS  20           HD3      LYS  20  18.402  -4.202 -22.277
  177    HE2  LYS  20           HE2      LYS  20  18.864  -6.388 -21.177
  178    HE3  LYS  20           HE3      LYS  20  17.129  -6.733 -21.141
  179    HZ1  LYS  20           HZ1      LYS  20  18.223  -7.791 -23.021
  180    HZ2  LYS  20           HZ2      LYS  20  17.132  -6.710 -23.562
  181    HZ3  LYS  20           HZ3      LYS  20  18.731  -6.362 -23.609
  182    H    GLU  21           H        GLU  21  19.622  -0.853 -19.431
  183    HA   GLU  21           HA       GLU  21  21.522  -2.683 -18.432
  184    HB2  GLU  21           HB2      GLU  21  22.036  -1.015 -20.095
  185    HB3  GLU  21           HB3      GLU  21  21.638   0.309 -18.995
  186    HG2  GLU  21           HG2      GLU  21  23.546  -0.198 -17.571
  187    HG3  GLU  21           HG3      GLU  21  23.906  -1.664 -18.498
  188    H    GLU  22           H        GLU  22  19.963   0.144 -16.862
  189    HA   GLU  22           HA       GLU  22  21.629   0.058 -14.523
  190    HB2  GLU  22           HB2      GLU  22  18.910   1.294 -15.061
  191    HB3  GLU  22           HB3      GLU  22  19.845   1.552 -13.574
  192    HG2  GLU  22           HG2      GLU  22  21.681   2.546 -14.870
  193    HG3  GLU  22           HG3      GLU  22  20.807   2.280 -16.377
  194    H    LEU  23           H        LEU  23  18.397  -1.289 -15.327
  195    HA   LEU  23           HA       LEU  23  17.890  -2.573 -12.822
  196    HG   LEU  23           HG       LEU  23  15.123  -4.334 -15.004
  197    HB2  LEU  23           HB2      LEU  23  16.097  -2.311 -14.336
  198    HB3  LEU  23           HB3      LEU  23  16.992  -2.944 -15.703
  199   HD11  LEU  23          HD11      LEU  23  17.647  -5.929 -14.581
  200   HD12  LEU  23          HD12      LEU  23  16.088  -6.467 -15.187
  201   HD13  LEU  23          HD13      LEU  23  17.081  -5.360 -16.156
  202   HD21  LEU  23          HD21      LEU  23  15.124  -5.585 -12.922
  203   HD22  LEU  23          HD22      LEU  23  16.701  -4.905 -12.468
  204   HD23  LEU  23          HD23      LEU  23  15.293  -3.851 -12.560
  205    H    LYS  24           H        LYS  24  19.618  -3.741 -15.769
  206    HA   LYS  24           HA       LYS  24  20.166  -6.316 -14.747
  207    HB2  LYS  24           HB2      LYS  24  20.413  -5.534 -17.134
  208    HB3  LYS  24           HB3      LYS  24  21.898  -4.696 -16.667
  209    HG2  LYS  24           HG2      LYS  24  22.860  -6.910 -15.936
  210    HG3  LYS  24           HG3      LYS  24  21.351  -7.689 -16.432
  211    HD2  LYS  24           HD2      LYS  24  22.974  -8.040 -18.155
  212    HD3  LYS  24           HD3      LYS  24  21.747  -6.925 -18.778
  213    HE2  LYS  24           HE2      LYS  24  23.268  -5.005 -18.337
  214    HE3  LYS  24           HE3      LYS  24  24.464  -6.103 -17.640
  215    HZ1  LYS  24           HZ1      LYS  24  24.676  -7.156 -19.813
  216    HZ2  LYS  24           HZ2      LYS  24  23.566  -6.148 -20.464
  217    HZ3  LYS  24           HZ3      LYS  24  24.989  -5.564 -19.930
  218    H    LYS  25           H        LYS  25  22.204  -3.333 -14.594
  219    HA   LYS  25           HA       LYS  25  24.284  -4.588 -13.087
  220    HB2  LYS  25           HB2      LYS  25  23.461  -1.666 -13.374
  221    HB3  LYS  25           HB3      LYS  25  24.813  -2.201 -12.370
  222    HG2  LYS  25           HG2      LYS  25  25.763  -3.387 -14.430
  223    HG3  LYS  25           HG3      LYS  25  24.516  -2.576 -15.379
  224    HD2  LYS  25           HD2      LYS  25  26.535  -1.300 -15.568
  225    HD3  LYS  25           HD3      LYS  25  25.416  -0.361 -14.564
  226    HE2  LYS  25           HE2      LYS  25  26.594  -1.170 -12.513
  227    HE3  LYS  25           HE3      LYS  25  27.661  -2.157 -13.507
  228    HZ1  LYS  25           HZ1      LYS  25  27.525   0.804 -13.587
  229    HZ2  LYS  25           HZ2      LYS  25  28.704  -0.073 -12.886
  230    HZ3  LYS  25           HZ3      LYS  25  28.521  -0.115 -14.503
  231    H    SER  26           H        SER  26  21.375  -2.744 -11.941
  232    HA   SER  26           HA       SER  26  22.217  -2.856  -9.240
  233    HG   SER  26           HG       SER  26  19.700  -2.027 -11.544
  234    HB2  SER  26           HB2      SER  26  19.809  -2.332  -8.704
  235    HB3  SER  26           HB3      SER  26  20.714  -1.204  -9.711
  236    H    LEU  27           H        LEU  27  20.218  -5.111 -11.116
  237    HA   LEU  27           HA       LEU  27  19.626  -6.912  -8.974
  238    HG   LEU  27           HG       LEU  27  17.724  -6.240 -11.050
  239    HB2  LEU  27           HB2      LEU  27  19.868  -7.163 -11.981
  240    HB3  LEU  27           HB3      LEU  27  19.635  -8.597 -11.006
  241   HD11  LEU  27          HD11      LEU  27  17.820  -7.547 -13.162
  242   HD12  LEU  27          HD12      LEU  27  17.502  -9.036 -12.262
  243   HD13  LEU  27          HD13      LEU  27  16.265  -7.758 -12.342
  244   HD21  LEU  27          HD21      LEU  27  17.542  -8.971  -9.722
  245   HD22  LEU  27          HD22      LEU  27  17.505  -7.368  -8.939
  246   HD23  LEU  27          HD23      LEU  27  16.162  -7.873  -9.949
  247    H    TYR  28           H        TYR  28  22.359  -6.922 -11.365
  248    HA   TYR  28           HA       TYR  28  23.658  -9.177 -10.243
  249    HD1  TYR  28           HD1      TYR  28  25.229 -10.499 -11.939
  250    HD2  TYR  28           HD2      TYR  28  27.152  -6.740 -11.034
  251    HE1  TYR  28           HE1      TYR  28  27.420 -11.652 -11.819
  252    HE2  TYR  28           HE2      TYR  28  29.341  -7.881 -10.909
  253    HH   TYR  28           HH       TYR  28  30.479  -9.908 -11.084
  254    HB2  TYR  28           HB2      TYR  28  24.166  -8.193 -12.450
  255    HB3  TYR  28           HB3      TYR  28  24.849  -6.770 -11.673
  256    H    ALA  29           H        ALA  29  23.869  -5.709  -9.389
  257    HA   ALA  29           HA       ALA  29  26.054  -5.920  -7.620
  258    HB1  ALA  29           HB1      ALA  29  23.809  -3.864  -7.705
  259    HB2  ALA  29           HB2      ALA  29  25.349  -3.688  -6.844
  260    HB3  ALA  29           HB3      ALA  29  25.338  -3.806  -8.614
  261    H    ILE  30           H        ILE  30  22.493  -6.082  -6.960
  262    HA   ILE  30           HA       ILE  30  23.156  -6.583  -4.084
  263    HB   ILE  30           HB       ILE  30  20.539  -5.531  -5.153
  264   HG12  ILE  30          HG12      ILE  30  22.974  -3.947  -4.184
  265   HG13  ILE  30          HG13      ILE  30  22.276  -3.902  -5.803
  266   HG21  ILE  30          HG21      ILE  30  21.760  -5.454  -2.370
  267   HG22  ILE  30          HG22      ILE  30  20.162  -4.827  -2.838
  268   HG23  ILE  30          HG23      ILE  30  20.470  -6.547  -2.925
  269   HD11  ILE  30          HD11      ILE  30  21.029  -2.775  -3.281
  270   HD12  ILE  30          HD12      ILE  30  21.626  -1.905  -4.700
  271   HD13  ILE  30          HD13      ILE  30  20.180  -2.920  -4.841
  272    H    PHE  31           H        PHE  31  20.787  -7.643  -6.660
  273    HA   PHE  31           HA       PHE  31  19.499  -9.470  -4.856
  274    HD1  PHE  31           HD1      PHE  31  18.360  -6.861  -6.311
  275    HD2  PHE  31           HD2      PHE  31  16.605 -10.776  -6.796
  276    HE1  PHE  31           HE1      PHE  31  16.115  -5.918  -5.881
  277    HE2  PHE  31           HE2      PHE  31  14.367  -9.827  -6.335
  278    HZ   PHE  31           HZ       PHE  31  14.113  -7.400  -5.888
  279    HB2  PHE  31           HB2      PHE  31  19.389  -8.916  -7.793
  280    HB3  PHE  31           HB3      PHE  31  18.864 -10.482  -7.267
  281    H    SER  32           H        SER  32  22.280  -9.889  -7.107
  282    HA   SER  32           HA       SER  32  22.416 -12.718  -6.728
  283    HG   SER  32           HG       SER  32  23.093 -11.033  -9.051
  284    HB2  SER  32           HB2      SER  32  24.580 -10.709  -7.428
  285    HB3  SER  32           HB3      SER  32  24.843 -12.461  -7.351
  286    H    GLN  33           H        GLN  33  23.321 -10.102  -4.495
  287    HA   GLN  33           HA       GLN  33  25.096 -11.709  -2.881
  288    HB2  GLN  33           HB2      GLN  33  23.388  -9.412  -1.876
  289    HB3  GLN  33           HB3      GLN  33  24.902 -10.001  -1.217
  290    HG2  GLN  33           HG2      GLN  33  24.519  -8.492  -3.825
  291    HG3  GLN  33           HG3      GLN  33  25.198  -7.852  -2.342
  292   HE21  GLN  33          HE22      GLN  33  26.451  -7.719  -4.861
  293   HE22  GLN  33          HE21      GLN  33  27.926  -8.677  -4.816
  294    H    PHE  34           H        PHE  34  21.696 -11.816  -3.414
  295    HA   PHE  34           HA       PHE  34  21.198 -13.224  -0.850
  296    HD1  PHE  34           HD2      PHE  34  20.092 -11.989   1.008
  297    HD2  PHE  34           HD1      PHE  34  19.967  -9.271  -2.362
  298    HE1  PHE  34           HE2      PHE  34  20.638 -10.094   2.508
  299    HE2  PHE  34           HE1      PHE  34  20.498  -7.399  -0.839
  300    HZ   PHE  34           HZ       PHE  34  20.841  -7.793   1.583
  301    HB2  PHE  34           HB2      PHE  34  19.347 -11.619  -2.658
  302    HB3  PHE  34           HB3      PHE  34  18.840 -12.505  -1.226
  303    H    GLY  35           H        GLY  35  22.159 -14.255  -3.719
  304    HA2  GLY  35           HA2      GLY  35  21.372 -16.812  -3.279
  305    HA3  GLY  35           HA3      GLY  35  20.038 -16.212  -4.270
  306    H    GLN  36           H        GLN  36  22.824 -14.683  -5.346
  307    HA   GLN  36           HA       GLN  36  23.807 -14.623  -7.286
  308    HB2  GLN  36           HB2      GLN  36  25.153 -16.417  -6.337
  309    HB3  GLN  36           HB3      GLN  36  24.091 -17.631  -7.057
  310    HG2  GLN  36           HG2      GLN  36  26.173 -17.264  -8.369
  311    HG3  GLN  36           HG3      GLN  36  24.717 -16.954  -9.301
  312   HE21  GLN  36          HE22      GLN  36  24.672 -15.023 -10.450
  313   HE22  GLN  36          HE21      GLN  36  25.601 -13.594 -10.039
  314    H    ILE  37           H        ILE  37  22.796 -13.884  -8.964
  315    HA   ILE  37           HA       ILE  37  20.459 -15.090 -10.151
  316    HB   ILE  37           HB       ILE  37  22.330 -12.796 -10.811
  317   HG12  ILE  37          HG12      ILE  37  19.398 -13.000  -9.968
  318   HG13  ILE  37          HG13      ILE  37  20.730 -12.641  -8.872
  319   HG21  ILE  37          HG21      ILE  37  19.901 -13.559 -12.460
  320   HG22  ILE  37          HG22      ILE  37  20.867 -12.075 -12.601
  321   HG23  ILE  37          HG23      ILE  37  21.602 -13.596 -12.999
  322   HD11  ILE  37          HD11      ILE  37  19.546 -10.630  -9.428
  323   HD12  ILE  37          HD12      ILE  37  21.198 -10.549 -10.088
  324   HD13  ILE  37          HD13      ILE  37  19.801 -10.872 -11.147
  325    H    LEU  38           H        LEU  38  20.308 -15.932 -12.256
  326    HA   LEU  38           HA       LEU  38  22.756 -17.121 -13.442
  327    HG   LEU  38           HG       LEU  38  20.959 -18.820 -15.497
  328    HB2  LEU  38           HB2      LEU  38  21.254 -18.805 -12.455
  329    HB3  LEU  38           HB3      LEU  38  19.892 -18.147 -13.365
  330   HD11  LEU  38          HD11      LEU  38  23.345 -18.729 -14.905
  331   HD12  LEU  38          HD12      LEU  38  23.125 -20.022 -13.705
  332   HD13  LEU  38          HD13      LEU  38  22.930 -20.356 -15.441
  333   HD21  LEU  38          HD21      LEU  38  19.411 -20.338 -14.335
  334   HD22  LEU  38          HD22      LEU  38  20.658 -21.244 -15.203
  335   HD23  LEU  38          HD23      LEU  38  20.766 -21.056 -13.438
  336    H    ASP  39           H        ASP  39  19.567 -15.432 -14.050
  337    HA   ASP  39           HA       ASP  39  20.751 -14.205 -16.403
  338    HB2  ASP  39           HB2      ASP  39  19.992 -16.388 -17.356
  339    HB3  ASP  39           HB3      ASP  39  18.358 -16.045 -16.809
  340    H    ILE  40           H        ILE  40  19.146 -12.576 -17.406
  341    HA   ILE  40           HA       ILE  40  17.145 -11.552 -15.464
  342    HB   ILE  40           HB       ILE  40  19.552 -10.019 -16.559
  343   HG12  ILE  40          HG12      ILE  40  18.757 -10.635 -13.679
  344   HG13  ILE  40          HG13      ILE  40  20.045 -11.435 -14.581
  345   HG21  ILE  40          HG21      ILE  40  17.574  -8.561 -16.624
  346   HG22  ILE  40          HG22      ILE  40  17.181  -8.984 -14.942
  347   HG23  ILE  40          HG23      ILE  40  18.640  -8.046 -15.351
  348   HD11  ILE  40          HD11      ILE  40  20.059  -8.518 -13.768
  349   HD12  ILE  40          HD12      ILE  40  21.009  -9.822 -13.065
  350   HD13  ILE  40          HD13      ILE  40  21.307  -9.337 -14.741
  351    H    VAL  41           H        VAL  41  15.448 -10.474 -16.520
  352    HA   VAL  41           HA       VAL  41  15.696  -9.873 -19.409
  353    HB   VAL  41           HB       VAL  41  13.451 -11.524 -18.179
  354   HG11  VAL  41          HG11      VAL  41  13.931 -10.658 -21.068
  355   HG12  VAL  41          HG12      VAL  41  12.638 -11.742 -20.510
  356   HG13  VAL  41          HG13      VAL  41  12.645 -10.055 -19.999
  357   HG21  VAL  41          HG21      VAL  41  14.191 -13.346 -19.688
  358   HG22  VAL  41          HG22      VAL  41  15.630 -12.393 -20.112
  359   HG23  VAL  41          HG23      VAL  41  15.383 -12.975 -18.448
  360    H    ALA  42           H        ALA  42  15.343  -7.741 -19.451
  361    HA   ALA  42           HA       ALA  42  12.780  -6.675 -18.621
  362    HB1  ALA  42           HB1      ALA  42  14.226  -6.087 -16.686
  363    HB2  ALA  42           HB2      ALA  42  15.396  -5.330 -17.798
  364    HB3  ALA  42           HB3      ALA  42  13.763  -4.651 -17.612
  365    H    LEU  43           H        LEU  43  12.827  -4.243 -19.712
  366    HA   LEU  43           HA       LEU  43  14.368  -4.273 -22.212
  367    HG   LEU  43           HG       LEU  43  11.689  -5.296 -24.571
  368    HB2  LEU  43           HB2      LEU  43  11.861  -5.528 -22.173
  369    HB3  LEU  43           HB3      LEU  43  11.455  -3.901 -22.648
  370   HD11  LEU  43          HD11      LEU  43  14.182  -3.552 -24.574
  371   HD12  LEU  43          HD12      LEU  43  13.236  -4.106 -25.956
  372   HD13  LEU  43          HD13      LEU  43  12.511  -2.958 -24.835
  373   HD21  LEU  43          HD21      LEU  43  13.725  -6.471 -25.201
  374   HD22  LEU  43          HD22      LEU  43  14.553  -5.908 -23.736
  375   HD23  LEU  43          HD23      LEU  43  13.175  -7.016 -23.609
  376    H    LYS  44           H        LYS  44  14.280  -2.210 -23.275
  377    HA   LYS  44           HA       LYS  44  14.053   0.021 -21.471
  378    HB2  LYS  44           HB2      LYS  44  15.737  -0.325 -23.314
  379    HB3  LYS  44           HB3      LYS  44  14.459  -0.045 -24.501
  380    HG2  LYS  44           HG2      LYS  44  14.206   2.261 -23.753
  381    HG3  LYS  44           HG3      LYS  44  15.303   1.980 -22.381
  382    HD2  LYS  44           HD2      LYS  44  17.158   1.515 -23.932
  383    HD3  LYS  44           HD3      LYS  44  16.105   1.754 -25.327
  384    HE2  LYS  44           HE2      LYS  44  16.660   3.895 -23.221
  385    HE3  LYS  44           HE3      LYS  44  17.640   3.687 -24.672
  386    HZ1  LYS  44           HZ1      LYS  44  14.744   4.326 -24.708
  387    HZ2  LYS  44           HZ2      LYS  44  15.958   5.371 -25.008
  388    HZ3  LYS  44           HZ3      LYS  44  15.695   4.131 -26.024
  389    H    THR  45           H        THR  45  11.665  -1.542 -23.466
  390    HA   THR  45           HA       THR  45  10.031   0.771 -24.000
  391    HB   THR  45           HB       THR  45   8.326  -1.154 -24.377
  392    HG1  THR  45           HG1      THR  45   9.238  -3.195 -24.519
  393   HG21  THR  45          HG21      THR  45  10.939  -1.182 -25.961
  394   HG22  THR  45          HG22      THR  45   9.368  -1.808 -26.508
  395   HG23  THR  45          HG23      THR  45   9.575  -0.073 -26.226
  396    H    LEU  46           H        LEU  46   8.129   1.382 -22.879
  397    HA   LEU  46           HA       LEU  46   8.356   1.518 -20.116
  398    HG   LEU  46           HG       LEU  46   6.483   2.592 -18.952
  399    HB2  LEU  46           HB2      LEU  46   7.145   3.071 -21.504
  400    HB3  LEU  46           HB3      LEU  46   5.882   1.891 -21.842
  401   HD11  LEU  46          HD11      LEU  46   6.393   4.778 -20.063
  402   HD12  LEU  46          HD12      LEU  46   4.850   4.349 -20.833
  403   HD13  LEU  46          HD13      LEU  46   4.956   4.528 -19.066
  404   HD21  LEU  46          HD21      LEU  46   3.868   2.028 -20.445
  405   HD22  LEU  46          HD22      LEU  46   4.726   0.871 -19.412
  406   HD23  LEU  46          HD23      LEU  46   4.027   2.321 -18.701
  407    H    LYS  47           H        LYS  47   6.530  -0.867 -22.010
  408    HA   LYS  47           HA       LYS  47   5.113  -2.078 -19.906
  409    HB2  LYS  47           HB2      LYS  47   4.830  -3.977 -21.418
  410    HB3  LYS  47           HB3      LYS  47   4.578  -2.443 -22.245
  411    HG2  LYS  47           HG2      LYS  47   6.814  -2.597 -23.287
  412    HG3  LYS  47           HG3      LYS  47   7.173  -4.056 -22.363
  413    HD2  LYS  47           HD2      LYS  47   6.603  -4.677 -24.615
  414    HD3  LYS  47           HD3      LYS  47   5.340  -5.256 -23.520
  415    HE2  LYS  47           HE2      LYS  47   3.910  -3.315 -24.146
  416    HE3  LYS  47           HE3      LYS  47   5.188  -2.712 -25.210
  417    HZ1  LYS  47           HZ1      LYS  47   3.755  -5.285 -25.554
  418    HZ2  LYS  47           HZ2      LYS  47   3.513  -3.939 -26.438
  419    HZ3  LYS  47           HZ3      LYS  47   4.933  -4.727 -26.541
  420    H    MET  48           H        MET  48   8.526  -2.146 -20.263
  421    HA   MET  48           HA       MET  48   8.697  -4.213 -18.158
  422    HB2  MET  48           HB2      MET  48  10.244  -4.194 -20.758
  423    HB3  MET  48           HB3      MET  48  10.783  -5.092 -19.342
  424    HG2  MET  48           HG2      MET  48   8.159  -5.521 -20.788
  425    HG3  MET  48           HG3      MET  48   9.595  -6.518 -20.949
  426    HE1  MET  48           HE1      MET  48  10.613  -6.816 -17.907
  427    HE2  MET  48           HE2      MET  48   9.759  -8.285 -17.410
  428    HE3  MET  48           HE3      MET  48  10.498  -8.194 -19.029
  429    H    ARG  49           H        ARG  49   8.767  -1.216 -18.261
  430    HA   ARG  49           HA       ARG  49  11.558  -0.730 -17.290
  431    HE   ARG  49           HE       ARG  49  12.270   2.848 -21.168
  432    HB2  ARG  49           HB2      ARG  49   9.294   1.031 -18.208
  433    HB3  ARG  49           HB3      ARG  49  10.360   1.645 -16.961
  434    HG2  ARG  49           HG2      ARG  49  12.331   1.325 -18.300
  435    HG3  ARG  49           HG3      ARG  49  11.402   0.545 -19.596
  436    HD2  ARG  49           HD2      ARG  49  10.244   2.589 -20.113
  437    HD3  ARG  49           HD3      ARG  49  10.831   3.392 -18.660
  438   HH11  ARG  49          HH21      ARG  49  12.599   3.871 -17.777
  439   HH12  ARG  49          HH22      ARG  49  14.123   4.661 -17.998
  440   HH21  ARG  49          HH11      ARG  49  14.181   4.106 -21.518
  441   HH22  ARG  49          HH12      ARG  49  14.996   4.865 -20.204
  442    H    GLY  50           H        GLY  50   8.188  -1.030 -16.173
  443    HA2  GLY  50           HA2      GLY  50   9.023  -0.492 -13.367
  444    HA3  GLY  50           HA3      GLY  50   7.378  -0.659 -13.983
  445    H    GLN  51           H        GLN  51   8.966  -3.044 -15.562
  446    HA   GLN  51           HA       GLN  51   8.316  -5.126 -13.569
  447    HB2  GLN  51           HB2      GLN  51   7.710  -5.259 -16.558
  448    HB3  GLN  51           HB3      GLN  51   7.163  -6.324 -15.283
  449    HG2  GLN  51           HG2      GLN  51   5.269  -5.121 -15.792
  450    HG3  GLN  51           HG3      GLN  51   5.846  -4.291 -14.356
  451   HE21  GLN  51          HE22      GLN  51   4.016  -2.958 -15.874
  452   HE22  GLN  51          HE21      GLN  51   4.777  -1.681 -16.795
  453    H    ALA  52           H        ALA  52   9.568  -7.084 -13.788
  454    HA   ALA  52           HA       ALA  52  11.466  -7.431 -15.961
  455    HB1  ALA  52           HB1      ALA  52  13.472  -7.521 -14.518
  456    HB2  ALA  52           HB2      ALA  52  12.781  -5.894 -14.546
  457    HB3  ALA  52           HB3      ALA  52  12.519  -6.946 -13.136
  458    H    PHE  53           H        PHE  53  12.612  -9.508 -15.697
  459    HA   PHE  53           HA       PHE  53  11.502 -11.373 -13.664
  460    HD1  PHE  53           HD1      PHE  53  10.033 -10.581 -17.346
  461    HD2  PHE  53           HD2      PHE  53   9.622 -13.752 -14.454
  462    HE1  PHE  53           HE1      PHE  53   7.575 -10.598 -17.716
  463    HE2  PHE  53           HE2      PHE  53   7.168 -13.793 -14.857
  464    HZ   PHE  53           HZ       PHE  53   6.143 -12.212 -16.468
  465    HB2  PHE  53           HB2      PHE  53  11.972 -11.953 -16.617
  466    HB3  PHE  53           HB3      PHE  53  11.783 -13.188 -15.394
  467    H    VAL  54           H        VAL  54  13.115 -12.865 -12.937
  468    HA   VAL  54           HA       VAL  54  15.773 -12.751 -14.131
  469    HB   VAL  54           HB       VAL  54  16.120 -10.865 -12.885
  470   HG11  VAL  54          HG11      VAL  54  14.787 -12.029 -10.430
  471   HG12  VAL  54          HG12      VAL  54  15.523 -10.427 -10.561
  472   HG13  VAL  54          HG13      VAL  54  14.065 -10.788 -11.481
  473   HG21  VAL  54          HG21      VAL  54  17.610 -11.418 -11.025
  474   HG22  VAL  54          HG22      VAL  54  17.034 -13.093 -11.032
  475   HG23  VAL  54          HG23      VAL  54  17.900 -12.443 -12.436
  476    H    ILE  55           H        ILE  55  16.919 -14.522 -13.737
  477    HA   ILE  55           HA       ILE  55  15.451 -16.841 -12.601
  478    HB   ILE  55           HB       ILE  55  17.514 -16.719 -14.845
  479   HG12  ILE  55          HG12      ILE  55  15.730 -17.471 -16.401
  480   HG13  ILE  55          HG13      ILE  55  14.516 -17.180 -15.176
  481   HG21  ILE  55          HG21      ILE  55  17.513 -18.851 -13.611
  482   HG22  ILE  55          HG22      ILE  55  15.760 -19.012 -13.871
  483   HG23  ILE  55          HG23      ILE  55  16.891 -19.081 -15.240
  484   HD11  ILE  55          HD11      ILE  55  16.302 -14.973 -16.297
  485   HD12  ILE  55          HD12      ILE  55  14.761 -15.452 -17.031
  486   HD13  ILE  55          HD13      ILE  55  14.771 -14.788 -15.406
  487    H    PHE  56           H        PHE  56  16.674 -18.087 -11.153
  488    HA   PHE  56           HA       PHE  56  19.264 -16.897 -10.254
  489    HD1  PHE  56           HD1      PHE  56  16.384 -15.101  -9.483
  490    HD2  PHE  56           HD2      PHE  56  19.558 -16.538  -6.938
  491    HE1  PHE  56           HE1      PHE  56  16.629 -12.839  -8.504
  492    HE2  PHE  56           HE2      PHE  56  19.824 -14.253  -5.995
  493    HZ   PHE  56           HZ       PHE  56  18.342 -12.439  -6.736
  494    HB2  PHE  56           HB2      PHE  56  16.709 -17.598  -8.909
  495    HB3  PHE  56           HB3      PHE  56  18.147 -18.092  -8.049
  496    H    LYS  57           H        LYS  57  20.562 -18.347  -8.874
  497    HA   LYS  57           HA       LYS  57  21.556 -20.529 -10.228
  498    HB2  LYS  57           HB2      LYS  57  22.735 -19.308  -8.486
  499    HB3  LYS  57           HB3      LYS  57  21.576 -19.845  -7.260
  500    HG2  LYS  57           HG2      LYS  57  22.353 -22.164  -7.508
  501    HG3  LYS  57           HG3      LYS  57  23.426 -21.691  -8.826
  502    HD2  LYS  57           HD2      LYS  57  24.646 -22.000  -6.718
  503    HD3  LYS  57           HD3      LYS  57  24.778 -20.353  -7.315
  504    HE2  LYS  57           HE2      LYS  57  24.522 -20.427  -4.886
  505    HE3  LYS  57           HE3      LYS  57  23.196 -19.540  -5.637
  506    HZ1  LYS  57           HZ1      LYS  57  22.769 -21.325  -3.809
  507    HZ2  LYS  57           HZ2      LYS  57  21.704 -21.141  -5.008
  508    HZ3  LYS  57           HZ3      LYS  57  22.764 -22.399  -5.050
  509    H    GLU  58           H        GLU  58  19.207 -20.680  -7.477
  510    HA   GLU  58           HA       GLU  58  18.305 -23.364  -8.301
  511    HB2  GLU  58           HB2      GLU  58  19.708 -22.661  -5.691
  512    HB3  GLU  58           HB3      GLU  58  18.538 -23.972  -5.762
  513    HG2  GLU  58           HG2      GLU  58  19.860 -25.240  -7.294
  514    HG3  GLU  58           HG3      GLU  58  20.965 -23.905  -7.583
  515    H    ILE  59           H        ILE  59  16.281 -23.892  -7.156
  516    HA   ILE  59           HA       ILE  59  14.528 -21.678  -7.111
  517    HB   ILE  59           HB       ILE  59  12.809 -23.255  -6.554
  518   HG12  ILE  59          HG12      ILE  59  15.020 -25.246  -5.850
  519   HG13  ILE  59          HG13      ILE  59  13.849 -24.540  -4.736
  520   HG21  ILE  59          HG21      ILE  59  12.964 -24.674  -8.440
  521   HG22  ILE  59          HG22      ILE  59  13.924 -23.250  -8.840
  522   HG23  ILE  59          HG23      ILE  59  14.736 -24.749  -8.366
  523   HD11  ILE  59          HD11      ILE  59  13.143 -26.769  -5.214
  524   HD12  ILE  59          HD12      ILE  59  12.007 -25.678  -6.032
  525   HD13  ILE  59          HD13      ILE  59  13.267 -26.524  -6.961
  526    H    GLY  60           H        GLY  60  16.213 -23.281  -4.406
  527    HA2  GLY  60           HA2      GLY  60  14.709 -21.962  -2.321
  528    HA3  GLY  60           HA3      GLY  60  16.301 -22.731  -2.170
  529    H    SER  61           H        SER  61  17.689 -21.197  -4.177
  530    HA   SER  61           HA       SER  61  18.403 -18.866  -2.669
  531    HG   SER  61           HG       SER  61  20.062 -20.648  -3.232
  532    HB2  SER  61           HB2      SER  61  19.076 -19.392  -5.583
  533    HB3  SER  61           HB3      SER  61  20.011 -18.533  -4.349
  534    H    ALA  62           H        ALA  62  16.480 -19.423  -5.648
  535    HA   ALA  62           HA       ALA  62  15.804 -16.749  -6.249
  536    HB1  ALA  62           HB1      ALA  62  13.928 -17.738  -7.460
  537    HB2  ALA  62           HB2      ALA  62  15.329 -18.811  -7.660
  538    HB3  ALA  62           HB3      ALA  62  14.045 -19.230  -6.520
  539    H    SER  63           H        SER  63  14.144 -19.142  -4.110
  540    HA   SER  63           HA       SER  63  12.051 -17.460  -3.254
  541    HG   SER  63           HG       SER  63  12.791 -20.484  -3.626
  542    HB2  SER  63           HB2      SER  63  13.421 -19.645  -1.626
  543    HB3  SER  63           HB3      SER  63  11.786 -19.009  -1.398
  544    H    ASN  64           H        ASN  64  15.307 -17.930  -1.861
  545    HA   ASN  64           HA       ASN  64  14.927 -16.269   0.413
  546    HB2  ASN  64           HB2      ASN  64  16.818 -17.849   0.197
  547    HB3  ASN  64           HB3      ASN  64  17.508 -16.865  -1.098
  548   HD21  ASN  64          HD22      ASN  64  18.787 -15.069  -0.527
  549   HD22  ASN  64          HD21      ASN  64  18.973 -14.516   1.129
  550    H    ALA  65           H        ALA  65  16.327 -15.493  -2.798
  551    HA   ALA  65           HA       ALA  65  16.840 -12.764  -2.371
  552    HB1  ALA  65           HB1      ALA  65  16.750 -12.586  -4.820
  553    HB2  ALA  65           HB2      ALA  65  17.610 -14.066  -4.341
  554    HB3  ALA  65           HB3      ALA  65  15.937 -14.157  -4.946
  555    H    LEU  66           H        LEU  66  13.920 -14.342  -3.736
  556    HA   LEU  66           HA       LEU  66  12.349 -12.086  -4.197
  557    HG   LEU  66           HG       LEU  66  10.192 -13.097  -5.411
  558    HB2  LEU  66           HB2      LEU  66  11.978 -14.545  -4.793
  559    HB3  LEU  66           HB3      LEU  66  11.361 -14.786  -3.177
  560   HD11  LEU  66          HD11      LEU  66   9.825 -15.460  -5.657
  561   HD12  LEU  66          HD12      LEU  66   9.331 -15.629  -3.963
  562   HD13  LEU  66          HD13      LEU  66   8.304 -14.741  -5.100
  563   HD21  LEU  66          HD21      LEU  66   8.223 -12.717  -3.885
  564   HD22  LEU  66          HD22      LEU  66   9.230 -13.308  -2.535
  565   HD23  LEU  66          HD23      LEU  66   9.664 -11.835  -3.415
  566    H    ARG  67           H        ARG  67  12.245 -14.199  -1.244
  567    HA   ARG  67           HA       ARG  67  10.324 -12.557   0.011
  568    HE   ARG  67           HE       ARG  67   8.500 -15.638   3.996
  569    HB2  ARG  67           HB2      ARG  67  10.891 -14.980   0.503
  570    HB3  ARG  67           HB3      ARG  67  12.316 -14.421   1.393
  571    HG2  ARG  67           HG2      ARG  67  10.798 -13.126   2.926
  572    HG3  ARG  67           HG3      ARG  67   9.403 -13.717   2.003
  573    HD2  ARG  67           HD2      ARG  67  10.165 -16.078   2.529
  574    HD3  ARG  67           HD3      ARG  67  11.389 -15.402   3.607
  575   HH11  ARG  67          HH21      ARG  67  11.405 -13.959   5.205
  576   HH12  ARG  67          HH22      ARG  67  10.703 -13.577   6.732
  577   HH21  ARG  67          HH11      ARG  67   7.593 -15.175   5.987
  578   HH22  ARG  67          HH12      ARG  67   8.472 -14.279   7.193
  579    H    THR  68           H        THR  68  13.928 -12.524   0.243
  580    HA   THR  68           HA       THR  68  14.024 -10.650   2.403
  581    HB   THR  68           HB       THR  68  16.118 -11.186   0.248
  582    HG1  THR  68           HG1      THR  68  15.710 -13.092   1.129
  583   HG21  THR  68          HG21      THR  68  16.350 -10.116   3.100
  584   HG22  THR  68          HG22      THR  68  17.720 -10.617   2.087
  585   HG23  THR  68          HG23      THR  68  16.725  -9.241   1.598
  586    H    MET  69           H        MET  69  14.022 -10.237  -1.177
  587    HA   MET  69           HA       MET  69  14.420  -7.354  -0.886
  588    HB2  MET  69           HB2      MET  69  14.021  -9.108  -3.338
  589    HB3  MET  69           HB3      MET  69  14.411  -7.390  -3.360
  590    HG2  MET  69           HG2      MET  69  16.146  -9.622  -2.221
  591    HG3  MET  69           HG3      MET  69  16.432  -8.739  -3.703
  592    HE1  MET  69           HE1      MET  69  17.481  -5.173  -2.383
  593    HE2  MET  69           HE2      MET  69  17.411  -6.224  -3.806
  594    HE3  MET  69           HE3      MET  69  15.905  -5.719  -3.003
  595    H    GLN  70           H        GLN  70  11.644  -9.386  -0.905
  596    HA   GLN  70           HA       GLN  70   9.734  -7.797  -2.156
  597    HB2  GLN  70           HB2      GLN  70   9.386 -10.095  -1.176
  598    HB3  GLN  70           HB3      GLN  70   9.464  -9.391   0.437
  599    HG2  GLN  70           HG2      GLN  70   7.184  -9.752  -0.031
  600    HG3  GLN  70           HG3      GLN  70   7.405  -8.013  -0.157
  601   HE21  GLN  70          HE22      GLN  70   6.024 -10.695  -1.707
  602   HE22  GLN  70          HE21      GLN  70   6.020 -10.118  -3.359
  603    H    GLY  71           H        GLY  71   8.928  -5.786  -1.792
  604    HA2  GLY  71           HA2      GLY  71   8.349  -3.853  -0.754
  605    HA3  GLY  71           HA3      GLY  71   8.610  -4.632   0.808
  606    H    PHE  72           H        PHE  72  11.539  -4.970  -0.894
  607    HA   PHE  72           HA       PHE  72  12.819  -3.121   0.890
  608    HD1  PHE  72           HD2      PHE  72  15.227  -4.319   1.923
  609    HD2  PHE  72           HD1      PHE  72  15.693  -3.043  -2.169
  610    HE1  PHE  72           HE2      PHE  72  17.440  -3.338   2.476
  611    HE2  PHE  72           HE1      PHE  72  17.901  -2.050  -1.609
  612    HZ   PHE  72           HZ       PHE  72  18.777  -2.199   0.714
  613    HB2  PHE  72           HB2      PHE  72  13.818  -5.244   0.060
  614    HB3  PHE  72           HB3      PHE  72  13.914  -4.557  -1.561
  615    HA   PRO  73           HA       PRO  73  12.632   0.418  -1.970
  616    HB2  PRO  73           HB2      PRO  73  14.203   2.216  -0.692
  617    HB3  PRO  73           HB3      PRO  73  12.609   1.710  -0.061
  618    HG2  PRO  73           HG2      PRO  73  15.338   0.651   0.757
  619    HG3  PRO  73           HG3      PRO  73  14.007   1.213   1.818
  620    HD2  PRO  73           HD2      PRO  73  14.408  -1.429   1.206
  621    HD3  PRO  73           HD3      PRO  73  12.775  -0.753   1.469
  622    H    PHE  74           H        PHE  74  13.691  -1.148  -3.446
  623    HA   PHE  74           HA       PHE  74  16.559  -1.338  -3.754
  624    HD1  PHE  74           HD2      PHE  74  17.644  -3.264  -4.815
  625    HD2  PHE  74           HD1      PHE  74  14.762  -2.316  -7.886
  626    HE1  PHE  74           HE2      PHE  74  19.078  -4.360  -6.526
  627    HE2  PHE  74           HE1      PHE  74  16.199  -3.423  -9.573
  628    HZ   PHE  74           HZ       PHE  74  18.323  -4.476  -8.893
  629    HB2  PHE  74           HB2      PHE  74  14.875  -2.971  -4.551
  630    HB3  PHE  74           HB3      PHE  74  14.261  -1.775  -5.690
  631    H    TYR  75           H        TYR  75  14.097   0.881  -4.776
  632    HA   TYR  75           HA       TYR  75  16.014   2.910  -5.567
  633    HD1  TYR  75           HD2      TYR  75  17.009   3.752  -7.874
  634    HD2  TYR  75           HD1      TYR  75  14.878   0.047  -8.474
  635    HE1  TYR  75           HE2      TYR  75  18.873   2.911  -9.270
  636    HE2  TYR  75           HE1      TYR  75  16.750  -0.809  -9.860
  637    HH   TYR  75           HH       TYR  75  18.857  -0.370 -10.696
  638    HB2  TYR  75           HB2      TYR  75  13.775   1.918  -7.395
  639    HB3  TYR  75           HB3      TYR  75  14.490   3.515  -7.550
  640    H    ASP  76           H        ASP  76  14.027   4.827  -6.162
  641    HA   ASP  76           HA       ASP  76  12.995   5.457  -3.598
  642    HB2  ASP  76           HB2      ASP  76  13.742   7.054  -5.374
  643    HB3  ASP  76           HB3      ASP  76  12.299   6.653  -6.304
  644    H    LYS  77           H        LYS  77  11.904   2.857  -4.789
  645    HA   LYS  77           HA       LYS  77   9.127   3.310  -4.086
  646    HB2  LYS  77           HB2      LYS  77   9.942   2.011  -6.734
  647    HB3  LYS  77           HB3      LYS  77   8.379   1.754  -5.957
  648    HG2  LYS  77           HG2      LYS  77   7.975   4.233  -6.014
  649    HG3  LYS  77           HG3      LYS  77   9.462   4.415  -6.964
  650    HD2  LYS  77           HD2      LYS  77   8.520   2.997  -8.750
  651    HD3  LYS  77           HD3      LYS  77   7.060   2.717  -7.779
  652    HE2  LYS  77           HE2      LYS  77   6.580   5.145  -7.770
  653    HE3  LYS  77           HE3      LYS  77   8.019   5.454  -8.748
  654    HZ1  LYS  77           HZ1      LYS  77   7.024   4.330 -10.586
  655    HZ2  LYS  77           HZ2      LYS  77   5.772   3.756  -9.671
  656    HZ3  LYS  77           HZ3      LYS  77   5.904   5.346 -10.003
  657    HA   PRO  78           HA       PRO  78  10.359  -0.535  -2.073
  658    HB2  PRO  78           HB2      PRO  78   7.930  -1.439  -1.182
  659    HB3  PRO  78           HB3      PRO  78   8.799  -0.068  -0.426
  660    HG2  PRO  78           HG2      PRO  78   6.543   0.035  -2.446
  661    HG3  PRO  78           HG3      PRO  78   6.731   0.988  -0.941
  662    HD2  PRO  78           HD2      PRO  78   7.419   1.962  -3.410
  663    HD3  PRO  78           HD3      PRO  78   8.322   2.410  -1.931
  664    H    MET  79           H        MET  79  10.753  -2.464  -3.053
  665    HA   MET  79           HA       MET  79   9.747  -3.103  -5.621
  666    HB2  MET  79           HB2      MET  79  11.144  -4.749  -3.476
  667    HB3  MET  79           HB3      MET  79  10.803  -5.389  -5.091
  668    HG2  MET  79           HG2      MET  79  12.361  -2.831  -4.601
  669    HG3  MET  79           HG3      MET  79  13.112  -4.413  -4.756
  670    HE1  MET  79           HE1      MET  79  14.207  -5.033  -6.690
  671    HE2  MET  79           HE2      MET  79  12.741  -5.957  -7.100
  672    HE3  MET  79           HE3      MET  79  13.574  -4.991  -8.344
  673    H    GLN  80           H        GLN  80   8.390  -4.801  -6.324
  674    HA   GLN  80           HA       GLN  80   6.705  -6.197  -4.346
  675    HB2  GLN  80           HB2      GLN  80   5.695  -4.798  -6.861
  676    HB3  GLN  80           HB3      GLN  80   4.762  -5.957  -5.918
  677    HG2  GLN  80           HG2      GLN  80   5.801  -3.311  -4.792
  678    HG3  GLN  80           HG3      GLN  80   4.210  -3.536  -5.496
  679   HE21  GLN  80          HE22      GLN  80   6.287  -4.472  -2.730
  680   HE22  GLN  80          HE21      GLN  80   4.959  -4.991  -1.708
  681    H    ILE  81           H        ILE  81   6.963  -8.289  -4.755
  682    HA   ILE  81           HA       ILE  81   7.985  -9.169  -7.388
  683    HB   ILE  81           HB       ILE  81   9.083 -10.192  -4.762
  684   HG12  ILE  81          HG12      ILE  81  10.120  -7.737  -6.206
  685   HG13  ILE  81          HG13      ILE  81   9.564  -7.881  -4.527
  686   HG21  ILE  81          HG21      ILE  81   9.518 -11.474  -6.893
  687   HG22  ILE  81          HG22      ILE  81  10.356 -10.059  -7.529
  688   HG23  ILE  81          HG23      ILE  81  10.985 -10.923  -6.112
  689   HD11  ILE  81          HD11      ILE  81  12.132  -9.005  -5.666
  690   HD12  ILE  81          HD12      ILE  81  11.928  -7.702  -4.493
  691   HD13  ILE  81          HD13      ILE  81  11.504  -9.366  -4.037
  692    H    ALA  82           H        ALA  82   7.579 -11.428  -7.810
  693    HA   ALA  82           HA       ALA  82   6.090 -13.055  -5.872
  694    HB1  ALA  82           HB1      ALA  82   4.393 -13.702  -7.565
  695    HB2  ALA  82           HB2      ALA  82   4.285 -11.968  -7.213
  696    HB3  ALA  82           HB3      ALA  82   5.067 -12.527  -8.711
  697    H    TYR  83           H        TYR  83   6.008 -15.378  -6.833
  698    HA   TYR  83           HA       TYR  83   8.602 -15.970  -8.139
  699    HD1  TYR  83           HD2      TYR  83   5.896 -16.598  -5.089
  700    HD2  TYR  83           HD1      TYR  83   6.226 -19.654  -8.120
  701    HE1  TYR  83           HE2      TYR  83   3.700 -17.517  -4.399
  702    HE2  TYR  83           HE1      TYR  83   4.056 -20.594  -7.416
  703    HH   TYR  83           HH       TYR  83   2.208 -20.354  -6.020
  704    HB2  TYR  83           HB2      TYR  83   8.111 -18.290  -7.609
  705    HB3  TYR  83           HB3      TYR  83   8.136 -17.288  -6.179
  706    H    SER  84           H        SER  84   8.683 -16.874 -10.230
  707    HA   SER  84           HA       SER  84   6.507 -16.200 -11.952
  708    HG   SER  84           HG       SER  84   8.524 -15.149 -12.882
  709    HB2  SER  84           HB2      SER  84   8.950 -17.933 -12.445
  710    HB3  SER  84           HB3      SER  84   7.936 -17.184 -13.693
  711    H    LYS  85           H        LYS  85   5.440 -17.678 -13.416
  712    HA   LYS  85           HA       LYS  85   3.994 -19.310 -13.865
  713    HB2  LYS  85           HB2      LYS  85   5.451 -21.257 -12.049
  714    HB3  LYS  85           HB3      LYS  85   4.288 -21.613 -13.326
  715    HG2  LYS  85           HG2      LYS  85   5.911 -20.584 -14.991
  716    HG3  LYS  85           HG3      LYS  85   7.094 -20.479 -13.672
  717    HD2  LYS  85           HD2      LYS  85   6.827 -22.984 -13.343
  718    HD3  LYS  85           HD3      LYS  85   5.816 -23.002 -14.803
  719    HE2  LYS  85           HE2      LYS  85   7.714 -21.957 -16.079
  720    HE3  LYS  85           HE3      LYS  85   8.713 -22.043 -14.623
  721    HZ1  LYS  85           HZ1      LYS  85   9.126 -23.914 -16.095
  722    HZ2  LYS  85           HZ2      LYS  85   8.478 -24.476 -14.709
  723    HZ3  LYS  85           HZ3      LYS  85   7.566 -24.374 -16.061
  724    H    SER  86           H        SER  86   3.825 -17.427 -11.661
  725    HA   SER  86           HA       SER  86   1.158 -18.035 -10.865
  726    HG   SER  86           HG       SER  86   2.303 -19.990  -9.833
  727    HB2  SER  86           HB2      SER  86   3.337 -18.033  -8.730
  728    HB3  SER  86           HB3      SER  86   1.634 -17.687  -8.371
  729    H    ASP  87           H        ASP  87   2.119 -16.281 -12.605
  730    HA   ASP  87           HA       ASP  87   2.221 -13.627 -11.337
  731    HB2  ASP  87           HB2      ASP  87   4.270 -13.047 -12.394
  732    HB3  ASP  87           HB3      ASP  87   4.594 -14.568 -11.575
  733    H    SER  88           H        SER  88   2.283 -11.940 -13.104
  734    HA   SER  88           HA       SER  88  -0.065 -12.018 -14.446
  735    HG   SER  88           HG       SER  88   1.534  -8.956 -13.506
  736    HB2  SER  88           HB2      SER  88   2.342 -10.314 -15.169
  737    HB3  SER  88           HB3      SER  88   0.630  -9.908 -15.395
  738    H    ASP  89           H        ASP  89   3.039 -13.249 -15.788
  739    HA   ASP  89           HA       ASP  89   2.197 -12.982 -18.557
  740    HB2  ASP  89           HB2      ASP  89   4.569 -13.184 -17.992
  741    HB3  ASP  89           HB3      ASP  89   4.287 -14.779 -17.270
  742    H    ILE  90           H        ILE  90   2.101 -15.657 -16.160
  743    HA   ILE  90           HA       ILE  90   0.855 -17.407 -18.123
  744    HB   ILE  90           HB       ILE  90   0.495 -19.016 -16.451
  745   HG12  ILE  90          HG12      ILE  90   1.760 -17.374 -14.245
  746   HG13  ILE  90          HG13      ILE  90   0.015 -17.314 -14.500
  747   HG21  ILE  90          HG21      ILE  90   2.727 -18.735 -17.509
  748   HG22  ILE  90          HG22      ILE  90   3.269 -17.812 -16.092
  749   HG23  ILE  90          HG23      ILE  90   2.808 -19.522 -15.931
  750   HD11  ILE  90          HD11      ILE  90  -0.179 -19.742 -14.274
  751   HD12  ILE  90          HD12      ILE  90   1.569 -19.872 -13.997
  752   HD13  ILE  90          HD13      ILE  90   0.540 -19.005 -12.837
  753    H    VAL  91           H        VAL  91  -0.322 -15.144 -15.640
  754    HA   VAL  91           HA       VAL  91  -3.040 -15.959 -15.790
  755    HB   VAL  91           HB       VAL  91  -1.780 -13.278 -15.114
  756   HG11  VAL  91          HG11      VAL  91  -4.675 -14.168 -14.751
  757   HG12  VAL  91          HG12      VAL  91  -3.950 -12.712 -14.031
  758   HG13  VAL  91          HG13      VAL  91  -4.096 -12.842 -15.786
  759   HG21  VAL  91          HG21      VAL  91  -2.985 -15.460 -13.346
  760   HG22  VAL  91          HG22      VAL  91  -1.253 -15.166 -13.553
  761   HG23  VAL  91          HG23      VAL  91  -2.261 -13.936 -12.790
  762    H    ALA  92           H        ALA  92  -1.162 -13.531 -17.719
  763    HA   ALA  92           HA       ALA  92  -3.310 -12.822 -19.436
  764    HB1  ALA  92           HB1      ALA  92  -1.562 -11.907 -20.878
  765    HB2  ALA  92           HB2      ALA  92  -1.210 -11.522 -19.189
  766    HB3  ALA  92           HB3      ALA  92  -0.312 -12.823 -20.005
  767    H    LYS  93           H        LYS  93  -0.932 -15.537 -19.624
  768    HA   LYS  93           HA       LYS  93  -1.774 -16.392 -22.228
  769    HB2  LYS  93           HB2      LYS  93  -0.407 -17.827 -19.931
  770    HB3  LYS  93           HB3      LYS  93  -0.881 -18.673 -21.406
  771    HG2  LYS  93           HG2      LYS  93   0.449 -17.193 -22.794
  772    HG3  LYS  93           HG3      LYS  93   0.897 -16.197 -21.398
  773    HD2  LYS  93           HD2      LYS  93   2.145 -18.044 -20.404
  774    HD3  LYS  93           HD3      LYS  93   1.534 -19.168 -21.622
  775    HE2  LYS  93           HE2      LYS  93   3.808 -18.599 -22.171
  776    HE3  LYS  93           HE3      LYS  93   2.729 -17.943 -23.405
  777    HZ1  LYS  93           HZ1      LYS  93   3.866 -16.364 -21.162
  778    HZ2  LYS  93           HZ2      LYS  93   4.471 -16.389 -22.683
  779    HZ3  LYS  93           HZ3      LYS  93   2.987 -15.767 -22.410
  780    H    ILE  94           H        ILE  94  -2.979 -17.468 -18.948
  781    HA   ILE  94           HA       ILE  94  -4.855 -19.229 -20.239
  782    HB   ILE  94           HB       ILE  94  -5.871 -19.591 -18.093
  783   HG12  ILE  94          HG12      ILE  94  -4.067 -17.412 -16.998
  784   HG13  ILE  94          HG13      ILE  94  -5.819 -17.306 -17.164
  785   HG21  ILE  94          HG21      ILE  94  -2.836 -19.537 -17.814
  786   HG22  ILE  94          HG22      ILE  94  -3.975 -20.651 -17.035
  787   HG23  ILE  94          HG23      ILE  94  -3.740 -20.721 -18.781
  788   HD11  ILE  94          HD11      ILE  94  -5.300 -17.768 -14.869
  789   HD12  ILE  94          HD12      ILE  94  -6.047 -19.221 -15.563
  790   HD13  ILE  94          HD13      ILE  94  -4.285 -19.152 -15.298
  791    H    LYS  95           H        LYS  95  -5.114 -15.833 -19.219
  792    HA   LYS  95           HA       LYS  95  -7.936 -15.600 -19.846
  793    HB2  LYS  95           HB2      LYS  95  -5.648 -13.596 -19.667
  794    HB3  LYS  95           HB3      LYS  95  -7.296 -13.122 -20.096
  795    HG2  LYS  95           HG2      LYS  95  -8.155 -14.034 -17.973
  796    HG3  LYS  95           HG3      LYS  95  -6.519 -14.521 -17.497
  797    HD2  LYS  95           HD2      LYS  95  -5.783 -12.155 -17.577
  798    HD3  LYS  95           HD3      LYS  95  -7.411 -11.662 -18.091
  799    HE2  LYS  95           HE2      LYS  95  -8.348 -12.616 -15.981
  800    HE3  LYS  95           HE3      LYS  95  -6.715 -13.043 -15.457
  801    HZ1  LYS  95           HZ1      LYS  95  -6.173 -10.662 -15.481
  802    HZ2  LYS  95           HZ2      LYS  95  -7.692 -10.286 -15.956
  803    HZ3  LYS  95           HZ3      LYS  95  -7.436 -10.952 -14.494
  804    H    GLY  96           H        GLY  96  -5.001 -15.633 -21.798
  805    HA2  GLY  96           HA2      GLY  96  -4.952 -16.057 -24.118
  806    HA3  GLY  96           HA3      GLY  96  -6.576 -15.370 -24.296
  807    H    THR  97           H        THR  97  -5.532 -13.102 -22.315
  808    HA   THR  97           HA       THR  97  -5.189 -11.152 -24.312
  809    HB   THR  97           HB       THR  97  -4.596  -9.760 -22.202
  810    HG1  THR  97           HG1      THR  97  -4.898 -10.777 -20.278
  811   HG21  THR  97          HG21      THR  97  -6.926  -9.822 -21.399
  812   HG22  THR  97          HG22      THR  97  -6.883  -9.886 -23.168
  813   HG23  THR  97          HG23      THR  97  -7.201 -11.365 -22.235
  814    H    PHE  98           H        PHE  98  -2.815 -13.278 -22.959
  815    HA   PHE  98           HA       PHE  98  -0.431 -11.810 -23.294
  816    HD1  PHE  98           HD1      PHE  98   1.904 -12.787 -22.615
  817    HD2  PHE  98           HD2      PHE  98   0.340 -15.771 -25.315
  818    HE1  PHE  98           HE1      PHE  98   4.187 -13.198 -23.492
  819    HE2  PHE  98           HE2      PHE  98   2.628 -16.189 -26.173
  820    HZ   PHE  98           HZ       PHE  98   4.555 -14.891 -25.280
  821    HB2  PHE  98           HB2      PHE  98  -0.437 -14.014 -22.325
  822    HB3  PHE  98           HB3      PHE  98  -1.117 -14.725 -23.788
  823    H    LYS  99           H        LYS  99  -2.601 -13.211 -25.743
  824    HA   LYS  99           HA       LYS  99  -0.990 -11.946 -27.891
  825    HB2  LYS  99           HB2      LYS  99  -0.815 -14.013 -29.173
  826    HB3  LYS  99           HB3      LYS  99  -0.019 -14.134 -27.620
  827    HG2  LYS  99           HG2      LYS  99  -1.018 -16.177 -27.688
  828    HG3  LYS  99           HG3      LYS  99  -2.268 -15.293 -26.822
  829    HD2  LYS  99           HD2      LYS  99  -3.487 -15.004 -29.034
  830    HD3  LYS  99           HD3      LYS  99  -2.217 -15.975 -29.800
  831    HE2  LYS  99           HE2      LYS  99  -2.763 -17.860 -28.259
  832    HE3  LYS  99           HE3      LYS  99  -4.029 -16.868 -27.512
  833    HZ1  LYS  99           HZ1      LYS  99  -4.002 -17.717 -30.350
  834    HZ2  LYS  99           HZ2      LYS  99  -4.943 -18.352 -29.178
  835    HZ3  LYS  99           HZ3      LYS  99  -5.163 -16.792 -29.637
  836    H    GLU 100           H        GLU 100  -4.143 -13.021 -26.778
  837    HA   GLU 100           HA       GLU 100  -5.470 -12.904 -29.323
  838    HB2  GLU 100           HB2      GLU 100  -6.413 -12.616 -26.436
  839    HB3  GLU 100           HB3      GLU 100  -7.516 -12.547 -27.804
  840    HG2  GLU 100           HG2      GLU 100  -5.709 -14.930 -27.217
  841    HG3  GLU 100           HG3      GLU 100  -7.376 -14.784 -26.676
  842    H    ARG 101           H        ARG 101  -6.743 -11.226 -30.194
  843    HA   ARG 101           HA       ARG 101  -5.883  -8.481 -29.721
  844    HE   ARG 101           HE       ARG 101  -5.295  -9.519 -34.621
  845    HB2  ARG 101           HB2      ARG 101  -8.248  -9.631 -31.286
  846    HB3  ARG 101           HB3      ARG 101  -7.713  -7.947 -31.316
  847    HG2  ARG 101           HG2      ARG 101  -5.577  -8.587 -32.328
  848    HG3  ARG 101           HG3      ARG 101  -6.062 -10.297 -32.311
  849    HD2  ARG 101           HD2      ARG 101  -7.995  -9.782 -33.763
  850    HD3  ARG 101           HD3      ARG 101  -7.545  -8.067 -33.776
  851   HH11  ARG 101          HH21      ARG 101  -8.613  -8.892 -35.835
  852   HH12  ARG 101          HH22      ARG 101  -8.140  -9.038 -37.492
  853   HH21  ARG 101          HH11      ARG 101  -4.725  -9.716 -36.829
  854   HH22  ARG 101          HH12      ARG 101  -5.907  -9.520 -38.066
  855    HA   PRO 102           HA       PRO 102  -8.925  -7.580 -26.550
  856    HB2  PRO 102           HB2      PRO 102  -9.633  -4.962 -27.055
  857    HB3  PRO 102           HB3      PRO 102  -8.073  -5.458 -26.332
  858    HG2  PRO 102           HG2      PRO 102  -8.663  -4.813 -29.235
  859    HG3  PRO 102           HG3      PRO 102  -7.298  -4.239 -28.225
  860    HD2  PRO 102           HD2      PRO 102  -7.021  -6.328 -29.936
  861    HD3  PRO 102           HD3      PRO 102  -6.207  -6.334 -28.347
  862    H    LYS 103           H        LYS 103  -9.732  -7.013 -29.945
  863    HA   LYS 103           HA       LYS 103 -12.239  -8.410 -29.643
  864    HB2  LYS 103           HB2      LYS 103 -13.593  -6.736 -30.846
  865    HB3  LYS 103           HB3      LYS 103 -13.076  -6.142 -29.271
  866    HG2  LYS 103           HG2      LYS 103 -11.291  -4.786 -30.357
  867    HG3  LYS 103           HG3      LYS 103 -11.808  -5.386 -31.946
  868    HD2  LYS 103           HD2      LYS 103 -14.048  -4.380 -31.597
  869    HD3  LYS 103           HD3      LYS 103 -13.528  -3.777 -30.006
  870    HE2  LYS 103           HE2      LYS 103 -11.731  -2.453 -31.100
  871    HE3  LYS 103           HE3      LYS 103 -12.243  -3.056 -32.681
  872    HZ1  LYS 103           HZ1      LYS 103 -13.901  -1.386 -30.879
  873    HZ2  LYS 103           HZ2      LYS 103 -13.154  -0.871 -32.231
  874    HZ3  LYS 103           HZ3      LYS 103 -14.373  -1.943 -32.343
  875    H    LYS 104           H        LYS 104 -12.959  -9.125 -31.838
  876    HA   LYS 104           HA       LYS 104 -10.761 -10.086 -33.288
  877    HB2  LYS 104           HB2      LYS 104 -12.335 -10.896 -34.946
  878    HB3  LYS 104           HB3      LYS 104 -12.871 -11.248 -33.305
  879    HG2  LYS 104           HG2      LYS 104 -14.482  -9.320 -33.452
  880    HG3  LYS 104           HG3      LYS 104 -13.965  -9.058 -35.131
  881    HD2  LYS 104           HD2      LYS 104 -14.700 -11.349 -35.721
  882    HD3  LYS 104           HD3      LYS 104 -15.229 -11.609 -34.043
  883    HE2  LYS 104           HE2      LYS 104 -16.812  -9.704 -34.251
  884    HE3  LYS 104           HE3      LYS 104 -16.284  -9.441 -35.918
  885    HZ1  LYS 104           HZ1      LYS 104 -18.321 -10.724 -35.829
  886    HZ2  LYS 104           HZ2      LYS 104 -17.140 -11.645 -36.467
  887    HZ3  LYS 104           HZ3      LYS 104 -17.629 -11.888 -34.925
  Start of MODEL    2
    1    HA   MET   1           HA       MET   1   8.210 -20.469   5.111
    2    H1   MET   1           H1       MET   1   7.493 -17.886   6.304
    3    H2   MET   1           H2       MET   1   7.756 -19.277   7.136
    4    H3   MET   1           H3       MET   1   8.980 -18.565   6.310
    5    HB2  MET   1           HB2      MET   1   5.901 -20.454   5.996
    6    HB3  MET   1           HB3      MET   1   5.531 -19.006   5.049
    7    HG2  MET   1           HG2      MET   1   5.941 -20.251   2.965
    8    HG3  MET   1           HG3      MET   1   6.400 -21.687   3.889
    9    HE1  MET   1           HE1      MET   1   4.281 -21.597   1.493
   10    HE2  MET   1           HE2      MET   1   4.739 -23.082   2.359
   11    HE3  MET   1           HE3      MET   1   3.023 -22.675   2.138
   12    H    GLU   2           H        GLU   2   9.267 -20.246   3.200
   13    HA   GLU   2           HA       GLU   2   9.592 -17.673   1.891
   14    HB2  GLU   2           HB2      GLU   2  10.376 -20.548   1.270
   15    HB3  GLU   2           HB3      GLU   2  10.529 -19.290   0.054
   16    HG2  GLU   2           HG2      GLU   2  12.651 -19.582   1.175
   17    HG3  GLU   2           HG3      GLU   2  12.004 -17.971   1.461
   18    H    MET   3           H        MET   3   8.758 -17.047  -0.137
   19    HA   MET   3           HA       MET   3   6.125 -17.829  -0.896
   20    HB2  MET   3           HB2      MET   3   8.328 -16.435  -2.485
   21    HB3  MET   3           HB3      MET   3   6.614 -16.481  -2.899
   22    HG2  MET   3           HG2      MET   3   6.979 -14.362  -1.972
   23    HG3  MET   3           HG3      MET   3   6.119 -15.276  -0.739
   24    HE1  MET   3           HE1      MET   3   8.406 -12.697   1.235
   25    HE2  MET   3           HE2      MET   3   7.767 -12.425  -0.400
   26    HE3  MET   3           HE3      MET   3   6.742 -13.187   0.843
   27    H    LEU   4           H        LEU   4   5.502 -19.083  -2.736
   28    HA   LEU   4           HA       LEU   4   6.449 -21.617  -2.767
   29    HG   LEU   4           HG       LEU   4   4.210 -22.508  -3.067
   30    HB2  LEU   4           HB2      LEU   4   4.873 -20.115  -4.855
   31    HB3  LEU   4           HB3      LEU   4   5.362 -21.779  -5.113
   32   HD11  LEU   4          HD11      LEU   4   3.203 -19.631  -2.908
   33   HD12  LEU   4          HD12      LEU   4   2.513 -21.002  -2.016
   34   HD13  LEU   4          HD13      LEU   4   4.166 -20.503  -1.683
   35   HD21  LEU   4          HD21      LEU   4   1.931 -22.297  -3.979
   36   HD22  LEU   4          HD22      LEU   4   2.463 -20.965  -5.031
   37   HD23  LEU   4          HD23      LEU   4   3.105 -22.605  -5.266
   38    HA   PRO   5           HA       PRO   5  10.462 -21.089  -4.765
   39    HB2  PRO   5           HB2      PRO   5  10.251 -24.097  -4.646
   40    HB3  PRO   5           HB3      PRO   5  11.681 -23.041  -4.369
   41    HG2  PRO   5           HG2      PRO   5  10.335 -23.947  -2.240
   42    HG3  PRO   5           HG3      PRO   5  10.785 -22.206  -2.332
   43    HD2  PRO   5           HD2      PRO   5   8.109 -23.489  -2.981
   44    HD3  PRO   5           HD3      PRO   5   8.455 -22.029  -2.006
   45    H    ASN   6           H        ASN   6  10.807 -20.610  -6.767
   46    HA   ASN   6           HA       ASN   6  10.369 -22.465  -8.959
   47    HB2  ASN   6           HB2      ASN   6   8.227 -21.166  -9.009
   48    HB3  ASN   6           HB3      ASN   6   9.148 -19.655  -8.955
   49   HD21  ASN   6          HD22      ASN   6   9.571 -18.711 -10.987
   50   HD22  ASN   6          HD21      ASN   6   9.560 -19.614 -12.468
   51    H    GLN   7           H        GLN   7  12.012 -21.921 -10.595
   52    HA   GLN   7           HA       GLN   7  14.301 -20.737  -9.408
   53    HB2  GLN   7           HB2      GLN   7  14.158 -22.625 -11.102
   54    HB3  GLN   7           HB3      GLN   7  13.908 -21.398 -12.356
   55    HG2  GLN   7           HG2      GLN   7  16.105 -20.410 -11.826
   56    HG3  GLN   7           HG3      GLN   7  16.319 -21.529 -10.482
   57   HE21  GLN   7          HE22      GLN   7  18.320 -21.414 -12.174
   58   HE22  GLN   7          HE21      GLN   7  18.384 -22.805 -13.251
   59    H    THR   8           H        THR   8  11.725 -19.156 -10.951
   60    HA   THR   8           HA       THR   8  13.356 -16.778 -11.634
   61    HB   THR   8           HB       THR   8  10.998 -17.958 -13.148
   62    HG1  THR   8           HG1      THR   8  12.435 -18.749 -14.567
   63   HG21  THR   8          HG21      THR   8  12.902 -15.685 -13.864
   64   HG22  THR   8          HG22      THR   8  11.708 -16.404 -14.969
   65   HG23  THR   8          HG23      THR   8  11.170 -15.541 -13.525
   66    H    ILE   9           H        ILE   9  12.372 -14.809 -11.217
   67    HA   ILE   9           HA       ILE   9   9.836 -14.826  -9.666
   68    HB   ILE   9           HB       ILE   9  10.702 -13.478  -7.969
   69   HG12  ILE   9          HG12      ILE   9  13.151 -13.042  -9.684
   70   HG13  ILE   9          HG13      ILE   9  11.951 -11.847  -9.211
   71   HG21  ILE   9          HG21      ILE   9  12.471 -14.806  -6.947
   72   HG22  ILE   9          HG22      ILE   9  11.385 -15.886  -7.830
   73   HG23  ILE   9          HG23      ILE   9  12.973 -15.440  -8.506
   74   HD11  ILE   9          HD11      ILE   9  13.894 -11.449  -7.882
   75   HD12  ILE   9          HD12      ILE   9  12.659 -12.139  -6.807
   76   HD13  ILE   9          HD13      ILE   9  13.998 -13.139  -7.369
   77    H    TYR  10           H        TYR  10   8.964 -12.542  -9.531
   78    HA   TYR  10           HA       TYR  10   9.392 -11.013 -12.050
   79    HD1  TYR  10           HD1      TYR  10   7.982 -10.261 -13.966
   80    HD2  TYR  10           HD2      TYR  10   4.973 -10.576 -10.889
   81    HE1  TYR  10           HE1      TYR  10   6.628  -8.550 -15.124
   82    HE2  TYR  10           HE2      TYR  10   3.604  -8.879 -12.050
   83    HH   TYR  10           HH       TYR  10   3.459  -7.423 -13.838
   84    HB2  TYR  10           HB2      TYR  10   7.477 -12.475 -12.389
   85    HB3  TYR  10           HB3      TYR  10   6.804 -12.036 -10.827
   86    H    ILE  11           H        ILE  11   9.555  -8.913 -11.641
   87    HA   ILE  11           HA       ILE  11   9.123  -7.863  -8.876
   88    HB   ILE  11           HB       ILE  11  11.147  -7.235 -11.079
   89   HG12  ILE  11          HG12      ILE  11  11.681  -8.134  -8.214
   90   HG13  ILE  11          HG13      ILE  11  11.518  -9.277  -9.546
   91   HG21  ILE  11          HG21      ILE  11  10.832  -5.805  -8.401
   92   HG22  ILE  11          HG22      ILE  11  12.097  -5.514  -9.620
   93   HG23  ILE  11          HG23      ILE  11  10.430  -5.121  -9.993
   94   HD11  ILE  11          HD11      ILE  11  13.841  -8.934  -9.146
   95   HD12  ILE  11          HD12      ILE  11  13.438  -8.194 -10.706
   96   HD13  ILE  11          HD13      ILE  11  13.684  -7.171  -9.268
   97    H    ASN  12           H        ASN  12   7.522  -6.316  -8.809
   98    HA   ASN  12           HA       ASN  12   6.523  -5.230 -11.405
   99    HB2  ASN  12           HB2      ASN  12   4.272  -5.821 -10.814
  100    HB3  ASN  12           HB3      ASN  12   5.294  -7.242 -10.770
  101   HD21  ASN  12          HD22      ASN  12   5.561  -8.375  -8.782
  102   HD22  ASN  12          HD21      ASN  12   4.653  -7.952  -7.353
  103    H    ASN  13           H        ASN  13   7.956  -3.962  -8.901
  104    HA   ASN  13           HA       ASN  13   6.366  -1.538  -9.198
  105    HB2  ASN  13           HB2      ASN  13   5.656  -2.507  -6.988
  106    HB3  ASN  13           HB3      ASN  13   7.332  -2.359  -6.436
  107   HD21  ASN  13          HD22      ASN  13   7.154  -0.672  -4.897
  108   HD22  ASN  13          HD21      ASN  13   6.386   0.863  -5.225
  109    H    LEU  14           H        LEU  14   8.471  -2.189 -10.672
  110    HA   LEU  14           HA       LEU  14  11.035  -1.306  -9.574
  111    HG   LEU  14           HG       LEU  14  12.647  -2.774 -10.882
  112    HB2  LEU  14           HB2      LEU  14  10.313  -2.996 -11.569
  113    HB3  LEU  14           HB3      LEU  14  10.407  -1.520 -12.518
  114   HD11  LEU  14          HD11      LEU  14  12.091  -2.614 -13.891
  115   HD12  LEU  14          HD12      LEU  14  13.542  -3.310 -13.160
  116   HD13  LEU  14          HD13      LEU  14  11.975  -4.065 -12.869
  117   HD21  LEU  14          HD21      LEU  14  13.090  -0.381 -10.980
  118   HD22  LEU  14          HD22      LEU  14  14.137  -1.182 -12.142
  119   HD23  LEU  14          HD23      LEU  14  12.691  -0.329 -12.715
  120    H    ASN  15           H        ASN  15  11.793   0.875  -9.761
  121    HA   ASN  15           HA       ASN  15   9.920   2.938 -10.597
  122    HB2  ASN  15           HB2      ASN  15  11.615   3.303  -8.813
  123    HB3  ASN  15           HB3      ASN  15  12.900   3.182 -10.017
  124   HD21  ASN  15          HD22      ASN  15  12.459   5.515  -8.391
  125   HD22  ASN  15          HD21      ASN  15  11.941   6.810  -9.438
  126    H    GLU  16           H        GLU  16   9.414   3.223 -12.650
  127    HA   GLU  16           HA       GLU  16  10.644   1.981 -14.787
  128    HB2  GLU  16           HB2      GLU  16   9.195   3.365 -16.203
  129    HB3  GLU  16           HB3      GLU  16   8.331   2.708 -14.812
  130    HG2  GLU  16           HG2      GLU  16   8.521   4.920 -13.668
  131    HG3  GLU  16           HG3      GLU  16   9.390   5.562 -15.063
  132    H    LYS  17           H        LYS  17  11.636   5.066 -13.386
  133    HA   LYS  17           HA       LYS  17  12.853   6.059 -15.774
  134    HB2  LYS  17           HB2      LYS  17  13.751   7.804 -14.442
  135    HB3  LYS  17           HB3      LYS  17  12.146   7.445 -13.842
  136    HG2  LYS  17           HG2      LYS  17  13.119   7.525 -11.818
  137    HG3  LYS  17           HG3      LYS  17  13.611   5.862 -12.152
  138    HD2  LYS  17           HD2      LYS  17  15.820   6.673 -12.946
  139    HD3  LYS  17           HD3      LYS  17  15.294   8.350 -12.685
  140    HE2  LYS  17           HE2      LYS  17  14.937   7.850 -10.270
  141    HE3  LYS  17           HE3      LYS  17  15.505   6.198 -10.527
  142    HZ1  LYS  17           HZ1      LYS  17  17.267   7.625  -9.682
  143    HZ2  LYS  17           HZ2      LYS  17  17.669   7.139 -11.186
  144    HZ3  LYS  17           HZ3      LYS  17  17.121   8.657 -10.930
  145    H    ILE  18           H        ILE  18  13.876   3.551 -13.630
  146    HA   ILE  18           HA       ILE  18  16.726   3.911 -13.825
  147    HB   ILE  18           HB       ILE  18  14.991   1.473 -13.232
  148   HG12  ILE  18          HG12      ILE  18  14.636   3.263 -11.589
  149   HG13  ILE  18          HG13      ILE  18  15.461   1.897 -10.872
  150   HG21  ILE  18          HG21      ILE  18  17.000   0.515 -12.118
  151   HG22  ILE  18          HG22      ILE  18  17.178   0.670 -13.865
  152   HG23  ILE  18          HG23      ILE  18  17.977   1.836 -12.791
  153   HD11  ILE  18          HD11      ILE  18  16.345   4.054 -10.082
  154   HD12  ILE  18          HD12      ILE  18  17.605   3.147 -10.934
  155   HD13  ILE  18          HD13      ILE  18  16.790   4.513 -11.728
  156    H    LYS  19           H        LYS  19  18.077   3.469 -15.473
  157    HA   LYS  19           HA       LYS  19  17.081   2.695 -18.076
  158    HB2  LYS  19           HB2      LYS  19  19.071   4.182 -17.556
  159    HB3  LYS  19           HB3      LYS  19  19.926   2.752 -16.979
  160    HG2  LYS  19           HG2      LYS  19  19.748   1.768 -19.287
  161    HG3  LYS  19           HG3      LYS  19  18.972   3.272 -19.825
  162    HD2  LYS  19           HD2      LYS  19  21.008   4.541 -19.136
  163    HD3  LYS  19           HD3      LYS  19  21.757   3.030 -18.587
  164    HE2  LYS  19           HE2      LYS  19  21.476   2.143 -20.962
  165    HE3  LYS  19           HE3      LYS  19  20.964   3.769 -21.438
  166    HZ1  LYS  19           HZ1      LYS  19  23.303   3.477 -21.844
  167    HZ2  LYS  19           HZ2      LYS  19  23.155   4.558 -20.633
  168    HZ3  LYS  19           HZ3      LYS  19  23.602   3.004 -20.308
  169    H    LYS  20           H        LYS  20  17.528   0.623 -19.180
  170    HA   LYS  20           HA       LYS  20  17.212  -1.649 -17.477
  171    HB2  LYS  20           HB2      LYS  20  17.514  -1.155 -20.406
  172    HB3  LYS  20           HB3      LYS  20  18.129  -2.707 -19.863
  173    HG2  LYS  20           HG2      LYS  20  15.787  -2.990 -20.434
  174    HG3  LYS  20           HG3      LYS  20  16.021  -3.211 -18.705
  175    HD2  LYS  20           HD2      LYS  20  15.286  -0.581 -18.674
  176    HD3  LYS  20           HD3      LYS  20  14.541  -1.068 -20.199
  177    HE2  LYS  20           HE2      LYS  20  13.545  -3.047 -18.845
  178    HE3  LYS  20           HE3      LYS  20  14.095  -2.200 -17.393
  179    HZ1  LYS  20           HZ1      LYS  20  11.779  -1.723 -17.931
  180    HZ2  LYS  20           HZ2      LYS  20  12.653  -0.328 -18.088
  181    HZ3  LYS  20           HZ3      LYS  20  12.164  -1.225 -19.407
  182    H    GLU  21           H        GLU  21  20.125  -0.229 -18.888
  183    HA   GLU  21           HA       GLU  21  21.925  -2.296 -18.067
  184    HB2  GLU  21           HB2      GLU  21  22.531  -0.795 -19.731
  185    HB3  GLU  21           HB3      GLU  21  22.100   0.626 -18.778
  186    HG2  GLU  21           HG2      GLU  21  24.015   0.299 -17.290
  187    HG3  GLU  21           HG3      GLU  21  24.432  -1.216 -18.113
  188    H    GLU  22           H        GLU  22  20.602   0.585 -16.353
  189    HA   GLU  22           HA       GLU  22  22.269   0.254 -14.013
  190    HB2  GLU  22           HB2      GLU  22  19.618   1.667 -14.459
  191    HB3  GLU  22           HB3      GLU  22  20.500   1.695 -12.931
  192    HG2  GLU  22           HG2      GLU  22  22.400   2.795 -13.973
  193    HG3  GLU  22           HG3      GLU  22  21.651   2.715 -15.562
  194    H    LEU  23           H        LEU  23  18.989  -0.855 -14.966
  195    HA   LEU  23           HA       LEU  23  18.301  -2.228 -12.584
  196    HG   LEU  23           HG       LEU  23  15.544  -3.789 -14.869
  197    HB2  LEU  23           HB2      LEU  23  16.674  -1.809 -14.305
  198    HB3  LEU  23           HB3      LEU  23  17.612  -2.618 -15.528
  199   HD11  LEU  23          HD11      LEU  23  16.346  -6.001 -14.932
  200   HD12  LEU  23          HD12      LEU  23  17.372  -4.997 -15.970
  201   HD13  LEU  23          HD13      LEU  23  17.952  -5.533 -14.384
  202   HD21  LEU  23          HD21      LEU  23  15.683  -3.275 -12.413
  203   HD22  LEU  23          HD22      LEU  23  15.404  -4.996 -12.755
  204   HD23  LEU  23          HD23      LEU  23  17.012  -4.425 -12.272
  205    H    LYS  24           H        LYS  24  20.009  -3.480 -15.510
  206    HA   LYS  24           HA       LYS  24  20.490  -6.067 -14.446
  207    HB2  LYS  24           HB2      LYS  24  21.881  -4.389 -16.577
  208    HB3  LYS  24           HB3      LYS  24  22.479  -5.998 -16.125
  209    HG2  LYS  24           HG2      LYS  24  20.265  -6.991 -16.591
  210    HG3  LYS  24           HG3      LYS  24  19.639  -5.420 -17.091
  211    HD2  LYS  24           HD2      LYS  24  21.922  -6.935 -18.433
  212    HD3  LYS  24           HD3      LYS  24  20.241  -6.897 -18.984
  213    HE2  LYS  24           HE2      LYS  24  20.400  -4.409 -19.233
  214    HE3  LYS  24           HE3      LYS  24  22.111  -4.496 -18.785
  215    HZ1  LYS  24           HZ1      LYS  24  21.836  -4.463 -21.185
  216    HZ2  LYS  24           HZ2      LYS  24  22.486  -5.888 -20.742
  217    HZ3  LYS  24           HZ3      LYS  24  20.909  -5.801 -21.162
  218    H    LYS  25           H        LYS  25  22.623  -3.158 -14.350
  219    HA   LYS  25           HA       LYS  25  24.710  -4.338 -12.874
  220    HB2  LYS  25           HB2      LYS  25  24.809  -2.167 -14.013
  221    HB3  LYS  25           HB3      LYS  25  23.698  -1.452 -12.855
  222    HG2  LYS  25           HG2      LYS  25  26.317  -2.690 -11.928
  223    HG3  LYS  25           HG3      LYS  25  26.288  -1.092 -12.673
  224    HD2  LYS  25           HD2      LYS  25  24.680  -0.293 -10.952
  225    HD3  LYS  25           HD3      LYS  25  24.798  -1.861 -10.126
  226    HE2  LYS  25           HE2      LYS  25  27.232  -1.557  -9.848
  227    HE3  LYS  25           HE3      LYS  25  27.151  -0.016 -10.708
  228    HZ1  LYS  25           HZ1      LYS  25  25.819  -0.584  -8.121
  229    HZ2  LYS  25           HZ2      LYS  25  27.164   0.311  -8.324
  230    HZ3  LYS  25           HZ3      LYS  25  25.748   0.840  -8.925
  231    H    SER  26           H        SER  26  21.747  -2.687 -11.654
  232    HA   SER  26           HA       SER  26  22.466  -2.851  -8.925
  233    HG   SER  26           HG       SER  26  20.915  -1.036 -10.939
  234    HB2  SER  26           HB2      SER  26  19.699  -2.680 -10.156
  235    HB3  SER  26           HB3      SER  26  20.147  -2.249  -8.489
  236    H    LEU  27           H        LEU  27  20.492  -5.024 -10.954
  237    HA   LEU  27           HA       LEU  27  19.760  -6.854  -8.894
  238    HG   LEU  27           HG       LEU  27  17.964  -5.974 -11.040
  239    HB2  LEU  27           HB2      LEU  27  20.055  -7.032 -11.903
  240    HB3  LEU  27           HB3      LEU  27  19.685  -8.462 -10.967
  241   HD11  LEU  27          HD11      LEU  27  17.533  -8.758 -12.218
  242   HD12  LEU  27          HD12      LEU  27  16.406  -7.383 -12.326
  243   HD13  LEU  27          HD13      LEU  27  17.978  -7.305 -13.127
  244   HD21  LEU  27          HD21      LEU  27  17.600  -7.024  -8.922
  245   HD22  LEU  27          HD22      LEU  27  16.256  -7.480  -9.954
  246   HD23  LEU  27          HD23      LEU  27  17.559  -8.651  -9.656
  247    H    TYR  28           H        TYR  28  22.560  -6.991 -11.222
  248    HA   TYR  28           HA       TYR  28  23.683  -9.302  -9.982
  249    HD1  TYR  28           HD2      TYR  28  24.299 -10.805 -11.614
  250    HD2  TYR  28           HD1      TYR  28  24.523  -7.151 -13.896
  251    HE1  TYR  28           HE2      TYR  28  23.706 -12.055 -13.655
  252    HE2  TYR  28           HE1      TYR  28  23.918  -8.393 -15.949
  253    HH   TYR  28           HH       TYR  28  23.315 -11.938 -15.955
  254    HB2  TYR  28           HB2      TYR  28  24.974  -7.063 -11.588
  255    HB3  TYR  28           HB3      TYR  28  25.832  -8.500 -11.063
  256    H    ALA  29           H        ALA  29  23.954  -5.841  -9.145
  257    HA   ALA  29           HA       ALA  29  26.184  -6.134  -7.408
  258    HB1  ALA  29           HB1      ALA  29  25.497  -3.958  -8.321
  259    HB2  ALA  29           HB2      ALA  29  23.988  -4.019  -7.375
  260    HB3  ALA  29           HB3      ALA  29  25.553  -3.919  -6.551
  261    H    ILE  30           H        ILE  30  22.632  -6.305  -6.723
  262    HA   ILE  30           HA       ILE  30  23.392  -7.200  -3.962
  263    HB   ILE  30           HB       ILE  30  21.208  -6.044  -3.279
  264   HG12  ILE  30          HG12      ILE  30  21.862  -4.269  -5.658
  265   HG13  ILE  30          HG13      ILE  30  20.490  -5.390  -5.594
  266   HG21  ILE  30          HG21      ILE  30  23.702  -4.404  -3.938
  267   HG22  ILE  30          HG22      ILE  30  22.520  -4.054  -2.658
  268   HG23  ILE  30          HG23      ILE  30  23.522  -5.488  -2.541
  269   HD11  ILE  30          HD11      ILE  30  19.786  -3.110  -5.099
  270   HD12  ILE  30          HD12      ILE  30  19.577  -4.128  -3.655
  271   HD13  ILE  30          HD13      ILE  30  20.934  -2.981  -3.773
  272    H    PHE  31           H        PHE  31  20.822  -7.679  -6.463
  273    HA   PHE  31           HA       PHE  31  19.405  -9.553  -4.791
  274    HD1  PHE  31           HD2      PHE  31  18.416  -6.849  -6.424
  275    HD2  PHE  31           HD1      PHE  31  16.561 -10.737  -6.601
  276    HE1  PHE  31           HE2      PHE  31  16.201  -5.822  -6.029
  277    HE2  PHE  31           HE1      PHE  31  14.351  -9.705  -6.226
  278    HZ   PHE  31           HZ       PHE  31  14.158  -7.241  -5.949
  279    HB2  PHE  31           HB2      PHE  31  19.420  -8.972  -7.734
  280    HB3  PHE  31           HB3      PHE  31  18.805 -10.519  -7.206
  281    H    SER  32           H        SER  32  22.165 -10.008  -7.092
  282    HA   SER  32           HA       SER  32  22.305 -12.795  -6.817
  283    HG   SER  32           HG       SER  32  24.255 -11.553  -9.369
  284    HB2  SER  32           HB2      SER  32  24.469 -10.725  -7.272
  285    HB3  SER  32           HB3      SER  32  24.781 -12.471  -7.303
  286    H    GLN  33           H        GLN  33  23.211 -10.361  -4.359
  287    HA   GLN  33           HA       GLN  33  24.967 -12.118  -2.895
  288    HB2  GLN  33           HB2      GLN  33  23.373  -9.713  -1.902
  289    HB3  GLN  33           HB3      GLN  33  24.652 -10.553  -1.031
  290    HG2  GLN  33           HG2      GLN  33  26.257  -9.974  -2.886
  291    HG3  GLN  33           HG3      GLN  33  24.979  -9.024  -3.643
  292   HE21  GLN  33          HE22      GLN  33  25.777  -6.912  -3.399
  293   HE22  GLN  33          HE21      GLN  33  26.194  -6.208  -1.849
  294    H    PHE  34           H        PHE  34  21.578 -12.247  -3.392
  295    HA   PHE  34           HA       PHE  34  21.185 -13.871  -0.927
  296    HD1  PHE  34           HD2      PHE  34  20.642 -12.451   1.052
  297    HD2  PHE  34           HD1      PHE  34  19.657  -9.863  -2.259
  298    HE1  PHE  34           HE2      PHE  34  21.434 -10.487   2.344
  299    HE2  PHE  34           HE1      PHE  34  20.446  -7.909  -0.964
  300    HZ   PHE  34           HZ       PHE  34  21.338  -8.211   1.341
  301    HB2  PHE  34           HB2      PHE  34  19.174 -12.164  -2.427
  302    HB3  PHE  34           HB3      PHE  34  18.887 -13.043  -0.928
  303    H    GLY  35           H        GLY  35  21.940 -14.569  -3.935
  304    HA2  GLY  35           HA2      GLY  35  20.874 -17.119  -3.817
  305    HA3  GLY  35           HA3      GLY  35  19.704 -16.219  -4.788
  306    H    GLN  36           H        GLN  36  22.657 -14.877  -5.522
  307    HA   GLN  36           HA       GLN  36  23.669 -14.616  -7.428
  308    HB2  GLN  36           HB2      GLN  36  25.064 -16.346  -6.536
  309    HB3  GLN  36           HB3      GLN  36  24.068 -17.594  -7.278
  310    HG2  GLN  36           HG2      GLN  36  26.136 -17.171  -8.568
  311    HG3  GLN  36           HG3      GLN  36  24.696 -16.862  -9.519
  312   HE21  GLN  36          HE22      GLN  36  24.685 -14.913 -10.667
  313   HE22  GLN  36          HE21      GLN  36  25.664 -13.523 -10.258
  314    H    ILE  37           H        ILE  37  22.711 -13.791  -9.074
  315    HA   ILE  37           HA       ILE  37  20.466 -14.910 -10.433
  316    HB   ILE  37           HB       ILE  37  22.450 -12.687 -11.017
  317   HG12  ILE  37          HG12      ILE  37  19.514 -12.728 -10.160
  318   HG13  ILE  37          HG13      ILE  37  20.867 -12.497  -9.055
  319   HG21  ILE  37          HG21      ILE  37  21.615 -13.446 -13.208
  320   HG22  ILE  37          HG22      ILE  37  19.939 -13.327 -12.616
  321   HG23  ILE  37          HG23      ILE  37  20.969 -11.887 -12.783
  322   HD11  ILE  37          HD11      ILE  37  20.027 -10.617 -11.257
  323   HD12  ILE  37          HD12      ILE  37  19.923 -10.380  -9.507
  324   HD13  ILE  37          HD13      ILE  37  21.518 -10.447 -10.292
  325    H    LEU  38           H        LEU  38  20.317 -15.829 -12.372
  326    HA   LEU  38           HA       LEU  38  22.680 -17.107 -13.657
  327    HG   LEU  38           HG       LEU  38  22.333 -19.508 -14.317
  328    HB2  LEU  38           HB2      LEU  38  20.902 -18.543 -12.538
  329    HB3  LEU  38           HB3      LEU  38  19.756 -17.968 -13.744
  330   HD11  LEU  38          HD11      LEU  38  20.660 -20.830 -13.067
  331   HD12  LEU  38          HD12      LEU  38  19.432 -20.442 -14.293
  332   HD13  LEU  38          HD13      LEU  38  20.849 -21.429 -14.719
  333   HD21  LEU  38          HD21      LEU  38  21.223 -19.953 -16.557
  334   HD22  LEU  38          HD22      LEU  38  20.046 -18.680 -16.160
  335   HD23  LEU  38          HD23      LEU  38  21.782 -18.308 -16.324
  336    H    ASP  39           H        ASP  39  19.464 -15.391 -14.135
  337    HA   ASP  39           HA       ASP  39  20.599 -14.055 -16.480
  338    HB2  ASP  39           HB2      ASP  39  19.838 -16.226 -17.428
  339    HB3  ASP  39           HB3      ASP  39  18.216 -15.918 -16.819
  340    H    ILE  40           H        ILE  40  18.993 -12.424 -17.410
  341    HA   ILE  40           HA       ILE  40  17.048 -11.407 -15.410
  342    HB   ILE  40           HB       ILE  40  19.336  -9.795 -16.641
  343   HG12  ILE  40          HG12      ILE  40  18.899 -10.612 -13.740
  344   HG13  ILE  40          HG13      ILE  40  20.151 -11.231 -14.822
  345   HG21  ILE  40          HG21      ILE  40  18.476  -7.915 -15.264
  346   HG22  ILE  40          HG22      ILE  40  17.298  -8.436 -16.434
  347   HG23  ILE  40          HG23      ILE  40  17.112  -8.935 -14.738
  348   HD11  ILE  40          HD11      ILE  40  21.192  -9.671 -13.356
  349   HD12  ILE  40          HD12      ILE  40  21.120  -8.928 -14.967
  350   HD13  ILE  40          HD13      ILE  40  19.985  -8.431 -13.692
  351    H    VAL  41           H        VAL  41  15.306 -10.358 -16.432
  352    HA   VAL  41           HA       VAL  41  15.480  -9.793 -19.335
  353    HB   VAL  41           HB       VAL  41  13.225 -11.391 -18.059
  354   HG11  VAL  41          HG11      VAL  41  12.485  -9.967 -19.945
  355   HG12  VAL  41          HG12      VAL  41  13.768 -10.648 -20.970
  356   HG13  VAL  41          HG13      VAL  41  12.440 -11.674 -20.386
  357   HG21  VAL  41          HG21      VAL  41  15.146 -12.880 -18.246
  358   HG22  VAL  41          HG22      VAL  41  13.959 -13.281 -19.483
  359   HG23  VAL  41          HG23      VAL  41  15.417 -12.367 -19.929
  360    H    ALA  42           H        ALA  42  15.408  -7.577 -19.061
  361    HA   ALA  42           HA       ALA  42  12.759  -6.503 -18.427
  362    HB1  ALA  42           HB1      ALA  42  13.703  -4.635 -17.183
  363    HB2  ALA  42           HB2      ALA  42  14.260  -6.124 -16.407
  364    HB3  ALA  42           HB3      ALA  42  15.363  -5.221 -17.459
  365    H    LEU  43           H        LEU  43  12.288  -4.878 -20.021
  366    HA   LEU  43           HA       LEU  43  14.366  -4.370 -22.106
  367    HG   LEU  43           HG       LEU  43  12.456  -6.860 -24.197
  368    HB2  LEU  43           HB2      LEU  43  11.498  -5.350 -22.496
  369    HB3  LEU  43           HB3      LEU  43  12.434  -4.598 -23.755
  370   HD11  LEU  43          HD11      LEU  43  15.186  -6.287 -22.982
  371   HD12  LEU  43          HD12      LEU  43  14.804  -7.428 -24.283
  372   HD13  LEU  43          HD13      LEU  43  14.613  -5.689 -24.557
  373   HD21  LEU  43          HD21      LEU  43  13.640  -7.597 -21.507
  374   HD22  LEU  43          HD22      LEU  43  11.908  -7.708 -21.899
  375   HD23  LEU  43          HD23      LEU  43  13.093  -8.662 -22.802
  376    H    LYS  44           H        LYS  44  13.819  -2.513 -23.497
  377    HA   LYS  44           HA       LYS  44  12.770  -0.280 -21.926
  378    HB2  LYS  44           HB2      LYS  44  13.688  -0.469 -24.835
  379    HB3  LYS  44           HB3      LYS  44  13.319   1.030 -23.978
  380    HG2  LYS  44           HG2      LYS  44  15.156   0.606 -22.377
  381    HG3  LYS  44           HG3      LYS  44  15.549  -0.909 -23.213
  382    HD2  LYS  44           HD2      LYS  44  15.988   0.360 -25.306
  383    HD3  LYS  44           HD3      LYS  44  15.640   1.879 -24.450
  384    HE2  LYS  44           HE2      LYS  44  17.506   1.429 -22.882
  385    HE3  LYS  44           HE3      LYS  44  17.838  -0.105 -23.701
  386    HZ1  LYS  44           HZ1      LYS  44  19.317   1.638 -24.471
  387    HZ2  LYS  44           HZ2      LYS  44  18.373   1.157 -25.705
  388    HZ3  LYS  44           HZ3      LYS  44  18.072   2.574 -24.949
  389    H    THR  45           H        THR  45  11.242  -2.608 -23.960
  390    HA   THR  45           HA       THR  45   9.269  -0.997 -25.223
  391    HB   THR  45           HB       THR  45   8.089  -3.317 -25.234
  392    HG1  THR  45           HG1      THR  45   9.387  -5.032 -24.631
  393   HG21  THR  45          HG21      THR  45   9.633  -4.210 -26.933
  394   HG22  THR  45          HG22      THR  45   9.435  -2.463 -27.139
  395   HG23  THR  45          HG23      THR  45  10.914  -3.104 -26.390
  396    H    LEU  46           H        LEU  46   7.071  -0.647 -24.596
  397    HA   LEU  46           HA       LEU  46   6.739   0.108 -21.947
  398    HG   LEU  46           HG       LEU  46   3.549  -1.345 -23.230
  399    HB2  LEU  46           HB2      LEU  46   4.606   0.757 -22.411
  400    HB3  LEU  46           HB3      LEU  46   5.461   0.952 -23.929
  401   HD11  LEU  46          HD11      LEU  46   2.411   0.828 -23.416
  402   HD12  LEU  46          HD12      LEU  46   3.141   1.088 -25.015
  403   HD13  LEU  46          HD13      LEU  46   1.982  -0.237 -24.760
  404   HD21  LEU  46          HD21      LEU  46   3.569  -1.831 -25.670
  405   HD22  LEU  46          HD22      LEU  46   4.851  -0.624 -25.899
  406   HD23  LEU  46          HD23      LEU  46   5.151  -2.099 -24.951
  407    H    LYS  47           H        LYS  47   6.225  -3.017 -23.341
  408    HA   LYS  47           HA       LYS  47   4.541  -4.287 -21.479
  409    HB2  LYS  47           HB2      LYS  47   5.424  -5.012 -23.778
  410    HB3  LYS  47           HB3      LYS  47   6.918  -5.497 -22.967
  411    HG2  LYS  47           HG2      LYS  47   5.638  -7.145 -21.620
  412    HG3  LYS  47           HG3      LYS  47   4.126  -6.570 -22.357
  413    HD2  LYS  47           HD2      LYS  47   5.107  -7.185 -24.627
  414    HD3  LYS  47           HD3      LYS  47   6.464  -7.944 -23.768
  415    HE2  LYS  47           HE2      LYS  47   4.891  -9.453 -22.605
  416    HE3  LYS  47           HE3      LYS  47   3.519  -8.636 -23.370
  417    HZ1  LYS  47           HZ1      LYS  47   3.935 -10.595 -24.561
  418    HZ2  LYS  47           HZ2      LYS  47   4.458  -9.397 -25.538
  419    HZ3  LYS  47           HZ3      LYS  47   5.547 -10.308 -24.726
  420    H    MET  48           H        MET  48   7.865  -3.214 -21.100
  421    HA   MET  48           HA       MET  48   8.098  -4.623 -18.483
  422    HB2  MET  48           HB2      MET  48  10.165  -4.312 -20.686
  423    HB3  MET  48           HB3      MET  48  10.529  -4.913 -19.068
  424    HG2  MET  48           HG2      MET  48   8.344  -6.426 -20.346
  425    HG3  MET  48           HG3      MET  48   9.809  -6.408 -21.308
  426    HE1  MET  48           HE1      MET  48   7.968  -7.762 -18.212
  427    HE2  MET  48           HE2      MET  48   9.276  -8.301 -17.133
  428    HE3  MET  48           HE3      MET  48   9.027  -6.571 -17.425
  429    H    ARG  49           H        ARG  49   7.251  -1.807 -19.282
  430    HA   ARG  49           HA       ARG  49   9.420  -0.024 -19.080
  431    HE   ARG  49           HE       ARG  49  10.120   2.363 -17.981
  432    HB2  ARG  49           HB2      ARG  49   7.101   0.444 -19.941
  433    HB3  ARG  49           HB3      ARG  49   6.516   0.478 -18.290
  434    HG2  ARG  49           HG2      ARG  49   6.824   2.706 -19.241
  435    HG3  ARG  49           HG3      ARG  49   7.840   2.492 -17.828
  436    HD2  ARG  49           HD2      ARG  49   8.927   2.017 -20.631
  437    HD3  ARG  49           HD3      ARG  49   8.778   3.656 -19.985
  438   HH11  ARG  49          HH21      ARG  49  10.770   2.454 -21.472
  439   HH12  ARG  49          HH22      ARG  49  12.469   2.673 -21.293
  440   HH21  ARG  49          HH11      ARG  49  12.362   2.824 -17.742
  441   HH22  ARG  49          HH12      ARG  49  13.410   2.741 -19.112
  442    H    GLY  50           H        GLY  50   7.509  -1.541 -16.504
  443    HA2  GLY  50           HA2      GLY  50   9.284  -0.347 -14.437
  444    HA3  GLY  50           HA3      GLY  50   7.533  -0.092 -14.329
  445    H    GLN  51           H        GLN  51   9.000  -3.075 -15.600
  446    HA   GLN  51           HA       GLN  51   8.770  -4.538 -13.124
  447    HB2  GLN  51           HB2      GLN  51   7.255  -6.276 -14.103
  448    HB3  GLN  51           HB3      GLN  51   6.460  -4.773 -13.691
  449    HG2  GLN  51           HG2      GLN  51   7.333  -5.405 -16.539
  450    HG3  GLN  51           HG3      GLN  51   5.809  -5.961 -15.877
  451   HE21  GLN  51          HE22      GLN  51   4.363  -4.154 -14.840
  452   HE22  GLN  51          HE21      GLN  51   4.311  -2.661 -15.739
  453    H    ALA  52           H        ALA  52   9.590  -6.814 -13.485
  454    HA   ALA  52           HA       ALA  52  11.195  -7.293 -15.895
  455    HB1  ALA  52           HB1      ALA  52  13.331  -7.367 -14.608
  456    HB2  ALA  52           HB2      ALA  52  12.651  -5.729 -14.629
  457    HB3  ALA  52           HB3      ALA  52  12.494  -6.742 -13.175
  458    H    PHE  53           H        PHE  53  12.404  -9.373 -15.637
  459    HA   PHE  53           HA       PHE  53  11.411 -11.158 -13.478
  460    HD1  PHE  53           HD1      PHE  53  10.034 -10.538 -17.321
  461    HD2  PHE  53           HD2      PHE  53   9.346 -13.402 -14.177
  462    HE1  PHE  53           HE1      PHE  53   7.598 -10.496 -17.814
  463    HE2  PHE  53           HE2      PHE  53   6.910 -13.386 -14.697
  464    HZ   PHE  53           HZ       PHE  53   6.036 -11.926 -16.507
  465    HB2  PHE  53           HB2      PHE  53  11.868 -11.918 -16.391
  466    HB3  PHE  53           HB3      PHE  53  11.574 -13.046 -15.089
  467    H    VAL  54           H        VAL  54  13.053 -12.710 -12.824
  468    HA   VAL  54           HA       VAL  54  15.669 -12.603 -14.068
  469    HB   VAL  54           HB       VAL  54  16.054 -10.689 -12.862
  470   HG11  VAL  54          HG11      VAL  54  15.601 -10.235 -10.520
  471   HG12  VAL  54          HG12      VAL  54  14.094 -10.622 -11.344
  472   HG13  VAL  54          HG13      VAL  54  14.883 -11.835 -10.314
  473   HG21  VAL  54          HG21      VAL  54  17.690 -11.199 -11.122
  474   HG22  VAL  54          HG22      VAL  54  17.137 -12.884 -11.074
  475   HG23  VAL  54          HG23      VAL  54  17.882 -12.235 -12.536
  476    H    ILE  55           H        ILE  55  16.917 -14.344 -13.543
  477    HA   ILE  55           HA       ILE  55  15.456 -16.683 -12.433
  478    HB   ILE  55           HB       ILE  55  17.447 -16.567 -14.744
  479   HG12  ILE  55          HG12      ILE  55  15.640 -17.239 -16.286
  480   HG13  ILE  55          HG13      ILE  55  14.443 -16.933 -15.051
  481   HG21  ILE  55          HG21      ILE  55  17.393 -18.733 -13.559
  482   HG22  ILE  55          HG22      ILE  55  15.632 -18.815 -13.775
  483   HG23  ILE  55          HG23      ILE  55  16.722 -18.899 -15.173
  484   HD11  ILE  55          HD11      ILE  55  16.252 -14.762 -16.172
  485   HD12  ILE  55          HD12      ILE  55  14.696 -15.210 -16.885
  486   HD13  ILE  55          HD13      ILE  55  14.737 -14.557 -15.257
  487    H    PHE  56           H        PHE  56  16.762 -18.008 -11.094
  488    HA   PHE  56           HA       PHE  56  19.507 -17.025 -10.411
  489    HD1  PHE  56           HD2      PHE  56  15.779 -16.168  -9.449
  490    HD2  PHE  56           HD1      PHE  56  19.623 -15.303  -7.682
  491    HE1  PHE  56           HE2      PHE  56  15.166 -13.785  -9.241
  492    HE2  PHE  56           HE1      PHE  56  18.955 -12.939  -7.391
  493    HZ   PHE  56           HZ       PHE  56  16.738 -12.166  -8.227
  494    HB2  PHE  56           HB2      PHE  56  17.306 -17.999  -8.554
  495    HB3  PHE  56           HB3      PHE  56  18.938 -17.587  -8.060
  496    H    LYS  57           H        LYS  57  20.587 -18.786  -8.889
  497    HA   LYS  57           HA       LYS  57  21.245 -20.999 -10.436
  498    HB2  LYS  57           HB2      LYS  57  21.292 -20.715  -7.404
  499    HB3  LYS  57           HB3      LYS  57  22.060 -22.038  -8.286
  500    HG2  LYS  57           HG2      LYS  57  23.468 -20.379  -9.522
  501    HG3  LYS  57           HG3      LYS  57  22.794 -19.100  -8.508
  502    HD2  LYS  57           HD2      LYS  57  24.388 -21.516  -7.546
  503    HD3  LYS  57           HD3      LYS  57  24.987 -19.859  -7.678
  504    HE2  LYS  57           HE2      LYS  57  23.268 -19.132  -5.994
  505    HE3  LYS  57           HE3      LYS  57  22.742 -20.808  -5.832
  506    HZ1  LYS  57           HZ1      LYS  57  24.301 -20.215  -4.094
  507    HZ2  LYS  57           HZ2      LYS  57  24.959 -21.373  -5.028
  508    HZ3  LYS  57           HZ3      LYS  57  25.460 -19.824  -5.171
  509    H    GLU  58           H        GLU  58  18.724 -20.923  -7.836
  510    HA   GLU  58           HA       GLU  58  17.584 -23.444  -8.811
  511    HB2  GLU  58           HB2      GLU  58  19.560 -24.008  -7.330
  512    HB3  GLU  58           HB3      GLU  58  18.773 -23.151  -6.007
  513    HG2  GLU  58           HG2      GLU  58  16.948 -24.769  -5.982
  514    HG3  GLU  58           HG3      GLU  58  17.549 -25.532  -7.458
  515    H    ILE  59           H        ILE  59  15.566 -23.922  -7.595
  516    HA   ILE  59           HA       ILE  59  13.860 -21.730  -7.391
  517    HB   ILE  59           HB       ILE  59  12.222 -23.297  -6.588
  518   HG12  ILE  59          HG12      ILE  59  14.500 -25.254  -6.033
  519   HG13  ILE  59          HG13      ILE  59  13.448 -24.505  -4.834
  520   HG21  ILE  59          HG21      ILE  59  13.953 -24.891  -8.504
  521   HG22  ILE  59          HG22      ILE  59  12.184 -24.797  -8.405
  522   HG23  ILE  59          HG23      ILE  59  13.108 -23.416  -8.986
  523   HD11  ILE  59          HD11      ILE  59  11.486 -25.690  -5.890
  524   HD12  ILE  59          HD12      ILE  59  12.651 -26.581  -6.899
  525   HD13  ILE  59          HD13      ILE  59  12.701 -26.743  -5.138
  526    H    GLY  60           H        GLY  60  15.690 -23.324  -4.761
  527    HA2  GLY  60           HA2      GLY  60  14.385 -21.918  -2.619
  528    HA3  GLY  60           HA3      GLY  60  15.944 -22.765  -2.548
  529    H    SER  61           H        SER  61  17.454 -21.378  -4.462
  530    HA   SER  61           HA       SER  61  18.315 -19.062  -3.112
  531    HG   SER  61           HG       SER  61  20.080 -20.899  -3.964
  532    HB2  SER  61           HB2      SER  61  18.701 -19.577  -6.077
  533    HB3  SER  61           HB3      SER  61  19.818 -18.847  -4.916
  534    H    ALA  62           H        ALA  62  16.147 -19.492  -5.941
  535    HA   ALA  62           HA       ALA  62  15.729 -16.762  -6.539
  536    HB1  ALA  62           HB1      ALA  62  13.698 -17.609  -7.686
  537    HB2  ALA  62           HB2      ALA  62  15.104 -18.642  -8.023
  538    HB3  ALA  62           HB3      ALA  62  13.881 -19.157  -6.845
  539    H    SER  63           H        SER  63  13.634 -18.979  -4.475
  540    HA   SER  63           HA       SER  63  12.001 -16.790  -3.669
  541    HG   SER  63           HG       SER  63  10.060 -19.282  -3.162
  542    HB2  SER  63           HB2      SER  63  12.447 -19.509  -2.402
  543    HB3  SER  63           HB3      SER  63  11.292 -18.298  -1.795
  544    H    ASN  64           H        ASN  64  15.100 -17.914  -2.347
  545    HA   ASN  64           HA       ASN  64  14.911 -16.420   0.093
  546    HB2  ASN  64           HB2      ASN  64  16.586 -18.220  -0.296
  547    HB3  ASN  64           HB3      ASN  64  17.420 -17.181  -1.459
  548   HD21  ASN  64          HD22      ASN  64  18.804 -15.552  -0.659
  549   HD22  ASN  64          HD21      ASN  64  19.048 -15.259   1.057
  550    H    ALA  65           H        ALA  65  16.279 -15.573  -3.122
  551    HA   ALA  65           HA       ALA  65  17.004 -12.907  -2.534
  552    HB1  ALA  65           HB1      ALA  65  17.659 -14.152  -4.607
  553    HB2  ALA  65           HB2      ALA  65  15.972 -14.069  -5.176
  554    HB3  ALA  65           HB3      ALA  65  16.914 -12.583  -4.966
  555    H    LEU  66           H        LEU  66  13.987 -14.245  -3.928
  556    HA   LEU  66           HA       LEU  66  12.480 -11.940  -4.237
  557    HG   LEU  66           HG       LEU  66  10.141 -12.758  -5.204
  558    HB2  LEU  66           HB2      LEU  66  11.982 -14.336  -4.881
  559    HB3  LEU  66           HB3      LEU  66  11.482 -14.632  -3.229
  560   HD11  LEU  66          HD11      LEU  66   9.540 -15.550  -4.164
  561   HD12  LEU  66          HD12      LEU  66   8.322 -14.553  -4.964
  562   HD13  LEU  66          HD13      LEU  66   9.789 -15.031  -5.837
  563   HD21  LEU  66          HD21      LEU  66   8.248 -12.737  -3.530
  564   HD22  LEU  66          HD22      LEU  66   9.364 -13.466  -2.353
  565   HD23  LEU  66          HD23      LEU  66   9.665 -11.844  -3.011
  566    H    ARG  67           H        ARG  67  12.464 -14.083  -1.313
  567    HA   ARG  67           HA       ARG  67  10.757 -12.404   0.184
  568    HE   ARG  67           HE       ARG  67  13.715 -13.506   3.770
  569    HB2  ARG  67           HB2      ARG  67  11.268 -14.827   0.651
  570    HB3  ARG  67           HB3      ARG  67  12.894 -14.365   1.118
  571    HG2  ARG  67           HG2      ARG  67  11.530 -12.774   2.864
  572    HG3  ARG  67           HG3      ARG  67  10.262 -13.946   2.555
  573    HD2  ARG  67           HD2      ARG  67  11.569 -14.621   4.518
  574    HD3  ARG  67           HD3      ARG  67  11.837 -15.776   3.205
  575   HH11  ARG  67          HH21      ARG  67  13.328 -17.056   3.638
  576   HH12  ARG  67          HH22      ARG  67  14.999 -17.318   3.240
  577   HH21  ARG  67          HH11      ARG  67  15.895 -13.924   3.066
  578   HH22  ARG  67          HH12      ARG  67  16.433 -15.558   2.942
  579    H    THR  68           H        THR  68  14.391 -12.583   0.185
  580    HA   THR  68           HA       THR  68  14.639 -10.725   2.324
  581    HB   THR  68           HB       THR  68  16.698 -11.300   0.151
  582    HG1  THR  68           HG1      THR  68  16.191 -13.239   0.888
  583   HG21  THR  68          HG21      THR  68  18.284 -10.997   2.083
  584   HG22  THR  68          HG22      THR  68  17.426  -9.512   1.649
  585   HG23  THR  68          HG23      THR  68  16.924 -10.446   3.078
  586    H    MET  69           H        MET  69  14.358 -10.240  -1.205
  587    HA   MET  69           HA       MET  69  14.873  -7.363  -0.924
  588    HB2  MET  69           HB2      MET  69  14.252  -9.101  -3.341
  589    HB3  MET  69           HB3      MET  69  14.678  -7.391  -3.385
  590    HG2  MET  69           HG2      MET  69  16.441  -9.683  -2.408
  591    HG3  MET  69           HG3      MET  69  16.641  -8.775  -3.885
  592    HE1  MET  69           HE1      MET  69  16.209  -5.769  -3.110
  593    HE2  MET  69           HE2      MET  69  17.806  -5.236  -2.540
  594    HE3  MET  69           HE3      MET  69  17.679  -6.234  -3.994
  595    H    GLN  70           H        GLN  70  12.103  -9.346  -0.613
  596    HA   GLN  70           HA       GLN  70  10.108  -7.798  -1.804
  597    HB2  GLN  70           HB2      GLN  70   9.886 -10.095  -0.729
  598    HB3  GLN  70           HB3      GLN  70   9.981  -9.314   0.847
  599    HG2  GLN  70           HG2      GLN  70   7.727  -9.813   0.433
  600    HG3  GLN  70           HG3      GLN  70   7.866  -8.062   0.284
  601   HE21  GLN  70          HE22      GLN  70   6.607 -10.850  -1.225
  602   HE22  GLN  70          HE21      GLN  70   6.486 -10.254  -2.867
  603    H    GLY  71           H        GLY  71   9.376  -5.756  -1.431
  604    HA2  GLY  71           HA2      GLY  71   8.885  -3.802  -0.385
  605    HA3  GLY  71           HA3      GLY  71   9.209  -4.566   1.174
  606    H    PHE  72           H        PHE  72  12.022  -4.972  -0.732
  607    HA   PHE  72           HA       PHE  72  13.462  -3.163   0.973
  608    HD1  PHE  72           HD2      PHE  72  15.976  -4.378   1.791
  609    HD2  PHE  72           HD1      PHE  72  16.044  -3.081  -2.321
  610    HE1  PHE  72           HE2      PHE  72  18.232  -3.399   2.132
  611    HE2  PHE  72           HE1      PHE  72  18.298  -2.093  -1.972
  612    HZ   PHE  72           HZ       PHE  72  19.394  -2.253   0.254
  613    HB2  PHE  72           HB2      PHE  72  14.383  -5.284   0.085
  614    HB3  PHE  72           HB3      PHE  72  14.345  -4.621  -1.549
  615    HA   PRO  73           HA       PRO  73  13.096   0.385  -1.852
  616    HB2  PRO  73           HB2      PRO  73  14.712   2.186  -0.644
  617    HB3  PRO  73           HB3      PRO  73  13.153   1.667   0.060
  618    HG2  PRO  73           HG2      PRO  73  15.925   0.631   0.749
  619    HG3  PRO  73           HG3      PRO  73  14.636   1.170   1.870
  620    HD2  PRO  73           HD2      PRO  73  15.045  -1.466   1.215
  621    HD3  PRO  73           HD3      PRO  73  13.419  -0.812   1.572
  622    H    PHE  74           H        PHE  74  14.064  -1.115  -3.413
  623    HA   PHE  74           HA       PHE  74  16.852  -1.401  -3.942
  624    HD1  PHE  74           HD1      PHE  74  17.522  -3.500  -5.361
  625    HD2  PHE  74           HD2      PHE  74  14.881  -1.400  -8.042
  626    HE1  PHE  74           HE1      PHE  74  18.707  -4.489  -7.309
  627    HE2  PHE  74           HE2      PHE  74  16.060  -2.392  -9.982
  628    HZ   PHE  74           HZ       PHE  74  17.940  -3.975  -9.622
  629    HB2  PHE  74           HB2      PHE  74  15.034  -2.777  -4.834
  630    HB3  PHE  74           HB3      PHE  74  14.409  -1.413  -5.753
  631    H    TYR  75           H        TYR  75  14.472   1.025  -4.820
  632    HA   TYR  75           HA       TYR  75  16.437   3.107  -5.129
  633    HD1  TYR  75           HD2      TYR  75  17.707   4.418  -7.099
  634    HD2  TYR  75           HD1      TYR  75  16.191   0.607  -8.436
  635    HE1  TYR  75           HE2      TYR  75  19.927   3.874  -8.049
  636    HE2  TYR  75           HE1      TYR  75  18.413   0.038  -9.362
  637    HH   TYR  75           HH       TYR  75  20.640   0.686  -9.537
  638    HB2  TYR  75           HB2      TYR  75  14.674   2.244  -7.464
  639    HB3  TYR  75           HB3      TYR  75  15.233   3.902  -7.301
  640    H    ASP  76           H        ASP  76  14.328   4.952  -6.045
  641    HA   ASP  76           HA       ASP  76  13.131   5.518  -3.548
  642    HB2  ASP  76           HB2      ASP  76  13.857   7.146  -5.304
  643    HB3  ASP  76           HB3      ASP  76  12.477   6.659  -6.288
  644    H    LYS  77           H        LYS  77  12.260   2.861  -4.669
  645    HA   LYS  77           HA       LYS  77   9.437   3.152  -4.074
  646    HB2  LYS  77           HB2      LYS  77  10.479   2.085  -6.704
  647    HB3  LYS  77           HB3      LYS  77   9.175   1.197  -5.926
  648    HG2  LYS  77           HG2      LYS  77   7.740   3.156  -5.866
  649    HG3  LYS  77           HG3      LYS  77   9.018   4.169  -6.570
  650    HD2  LYS  77           HD2      LYS  77   9.005   2.935  -8.618
  651    HD3  LYS  77           HD3      LYS  77   7.952   1.684  -7.980
  652    HE2  LYS  77           HE2      LYS  77   7.119   4.598  -8.354
  653    HE3  LYS  77           HE3      LYS  77   6.863   3.325  -9.550
  654    HZ1  LYS  77           HZ1      LYS  77   5.656   3.426  -6.856
  655    HZ2  LYS  77           HZ2      LYS  77   4.891   3.547  -8.286
  656    HZ3  LYS  77           HZ3      LYS  77   5.559   2.116  -7.847
  657    HA   PRO  78           HA       PRO  78  10.909  -0.546  -1.867
  658    HB2  PRO  78           HB2      PRO  78   8.555  -1.360  -0.737
  659    HB3  PRO  78           HB3      PRO  78   9.494   0.035  -0.119
  660    HG2  PRO  78           HG2      PRO  78   7.071   0.067  -1.936
  661    HG3  PRO  78           HG3      PRO  78   7.410   1.101  -0.514
  662    HD2  PRO  78           HD2      PRO  78   7.878   1.891  -3.110
  663    HD3  PRO  78           HD3      PRO  78   8.876   2.461  -1.738
  664    H    MET  79           H        MET  79  11.208  -2.490  -2.901
  665    HA   MET  79           HA       MET  79   9.932  -3.069  -5.363
  666    HB2  MET  79           HB2      MET  79  11.500  -4.841  -3.447
  667    HB3  MET  79           HB3      MET  79  11.046  -5.328  -5.089
  668    HG2  MET  79           HG2      MET  79  12.674  -2.840  -4.482
  669    HG3  MET  79           HG3      MET  79  13.385  -4.414  -4.803
  670    HE1  MET  79           HE1      MET  79  14.551  -4.616  -6.788
  671    HE2  MET  79           HE2      MET  79  13.198  -5.673  -7.248
  672    HE3  MET  79           HE3      MET  79  13.863  -4.511  -8.420
  673    H    GLN  80           H        GLN  80   8.479  -4.741  -5.955
  674    HA   GLN  80           HA       GLN  80   7.003  -6.168  -3.831
  675    HB2  GLN  80           HB2      GLN  80   5.754  -4.736  -6.219
  676    HB3  GLN  80           HB3      GLN  80   4.913  -5.893  -5.192
  677    HG2  GLN  80           HG2      GLN  80   6.087  -3.262  -4.168
  678    HG3  GLN  80           HG3      GLN  80   4.428  -3.471  -4.699
  679   HE21  GLN  80          HE22      GLN  80   6.785  -4.445  -2.176
  680   HE22  GLN  80          HE21      GLN  80   5.569  -4.954  -1.019
  681    H    ILE  81           H        ILE  81   7.203  -8.275  -4.305
  682    HA   ILE  81           HA       ILE  81   7.972  -9.071  -7.053
  683    HB   ILE  81           HB       ILE  81   9.379 -10.171  -4.611
  684   HG12  ILE  81          HG12      ILE  81  10.222  -7.608  -6.016
  685   HG13  ILE  81          HG13      ILE  81   9.769  -7.804  -4.313
  686   HG21  ILE  81          HG21      ILE  81  10.290  -9.787  -7.494
  687   HG22  ILE  81          HG22      ILE  81  11.142 -10.689  -6.225
  688   HG23  ILE  81          HG23      ILE  81   9.619 -11.285  -6.856
  689   HD11  ILE  81          HD11      ILE  81  12.276  -8.851  -5.629
  690   HD12  ILE  81          HD12      ILE  81  12.122  -7.596  -4.397
  691   HD13  ILE  81          HD13      ILE  81  11.750  -9.281  -3.981
  692    H    ALA  82           H        ALA  82   7.567 -11.305  -7.520
  693    HA   ALA  82           HA       ALA  82   6.432 -13.072  -5.481
  694    HB1  ALA  82           HB1      ALA  82   4.903 -12.398  -8.051
  695    HB2  ALA  82           HB2      ALA  82   4.458 -13.649  -6.873
  696    HB3  ALA  82           HB3      ALA  82   4.400 -11.941  -6.406
  697    H    TYR  83           H        TYR  83   6.109 -15.306  -6.622
  698    HA   TYR  83           HA       TYR  83   8.467 -15.987  -8.210
  699    HD1  TYR  83           HD1      TYR  83   6.097 -16.764  -5.093
  700    HD2  TYR  83           HD2      TYR  83   4.990 -18.777  -8.734
  701    HE1  TYR  83           HE1      TYR  83   3.791 -17.025  -4.228
  702    HE2  TYR  83           HE2      TYR  83   2.681 -19.075  -7.871
  703    HH   TYR  83           HH       TYR  83   1.643 -17.826  -4.666
  704    HB2  TYR  83           HB2      TYR  83   7.309 -18.238  -8.297
  705    HB3  TYR  83           HB3      TYR  83   7.801 -17.668  -6.716
  706    H    SER  84           H        SER  84   8.396 -16.464 -10.487
  707    HA   SER  84           HA       SER  84   6.838 -14.593 -11.856
  708    HG   SER  84           HG       SER  84   8.248 -17.670 -13.433
  709    HB2  SER  84           HB2      SER  84   7.999 -15.548 -13.870
  710    HB3  SER  84           HB3      SER  84   9.057 -15.140 -12.513
  711    H    LYS  85           H        LYS  85   5.344 -17.283 -10.778
  712    HA   LYS  85           HA       LYS  85   3.794 -17.915 -13.209
  713    HB2  LYS  85           HB2      LYS  85   3.211 -18.514 -10.276
  714    HB3  LYS  85           HB3      LYS  85   2.271 -19.082 -11.655
  715    HG2  LYS  85           HG2      LYS  85   4.263 -20.293 -12.533
  716    HG3  LYS  85           HG3      LYS  85   5.191 -19.791 -11.107
  717    HD2  LYS  85           HD2      LYS  85   3.590 -20.985  -9.635
  718    HD3  LYS  85           HD3      LYS  85   2.648 -21.477 -11.061
  719    HE2  LYS  85           HE2      LYS  85   4.649 -22.662 -11.958
  720    HE3  LYS  85           HE3      LYS  85   5.568 -22.196 -10.522
  721    HZ1  LYS  85           HZ1      LYS  85   4.008 -23.499  -9.187
  722    HZ2  LYS  85           HZ2      LYS  85   3.159 -23.925 -10.519
  723    HZ3  LYS  85           HZ3      LYS  85   4.691 -24.437 -10.330
  724    H    SER  86           H        SER  86   3.881 -15.552 -10.650
  725    HA   SER  86           HA       SER  86   2.440 -13.992  -9.887
  726    HG   SER  86           HG       SER  86   4.698 -12.448 -12.189
  727    HB2  SER  86           HB2      SER  86   2.627 -13.202 -12.783
  728    HB3  SER  86           HB3      SER  86   2.579 -12.155 -11.359
  729    H    ASP  87           H        ASP  87   0.644 -13.153 -12.716
  730    HA   ASP  87           HA       ASP  87  -1.806 -14.525 -11.975
  731    HB2  ASP  87           HB2      ASP  87  -1.468 -12.817 -10.123
  732    HB3  ASP  87           HB3      ASP  87  -1.377 -11.556 -11.350
  733    H    SER  88           H        SER  88  -3.677 -13.327 -13.137
  734    HA   SER  88           HA       SER  88  -3.433 -13.836 -15.727
  735    HG   SER  88           HG       SER  88  -6.612 -13.637 -14.145
  736    HB2  SER  88           HB2      SER  88  -5.325 -11.773 -14.568
  737    HB3  SER  88           HB3      SER  88  -5.584 -12.772 -16.011
  738    H    ASP  89           H        ASP  89  -2.387 -10.726 -14.374
  739    HA   ASP  89           HA       ASP  89  -2.484  -9.230 -16.822
  740    HB2  ASP  89           HB2      ASP  89  -2.217  -8.161 -14.619
  741    HB3  ASP  89           HB3      ASP  89  -0.632  -8.924 -14.431
  742    H    ILE  90           H        ILE  90   0.071 -11.327 -15.388
  743    HA   ILE  90           HA       ILE  90   1.840 -10.727 -17.641
  744    HB   ILE  90           HB       ILE  90   3.417 -12.192 -16.848
  745   HG12  ILE  90          HG12      ILE  90   1.645 -13.397 -14.704
  746   HG13  ILE  90          HG13      ILE  90   1.821 -14.146 -16.282
  747   HG21  ILE  90          HG21      ILE  90   3.883 -11.348 -14.627
  748   HG22  ILE  90          HG22      ILE  90   3.083 -10.083 -15.563
  749   HG23  ILE  90          HG23      ILE  90   2.167 -10.992 -14.344
  750   HD11  ILE  90          HD11      ILE  90   4.225 -14.337 -16.044
  751   HD12  ILE  90          HD12      ILE  90   4.148 -13.610 -14.427
  752   HD13  ILE  90          HD13      ILE  90   3.343 -15.161 -14.747
  753    H    VAL  91           H        VAL  91  -0.646 -13.104 -16.878
  754    HA   VAL  91           HA       VAL  91   0.001 -14.907 -19.002
  755    HB   VAL  91           HB       VAL  91  -2.619 -14.348 -17.568
  756   HG11  VAL  91          HG11      VAL  91  -3.360 -16.547 -18.448
  757   HG12  VAL  91          HG12      VAL  91  -3.097 -15.395 -19.762
  758   HG13  VAL  91          HG13      VAL  91  -1.884 -16.652 -19.435
  759   HG21  VAL  91          HG21      VAL  91  -0.871 -15.209 -16.085
  760   HG22  VAL  91          HG22      VAL  91  -2.098 -16.441 -16.376
  761   HG23  VAL  91          HG23      VAL  91  -0.537 -16.535 -17.218
  762    H    ALA  92           H        ALA  92  -2.067 -11.938 -18.822
  763    HA   ALA  92           HA       ALA  92  -2.703 -11.908 -21.593
  764    HB1  ALA  92           HB1      ALA  92  -3.894 -10.598 -19.835
  765    HB2  ALA  92           HB2      ALA  92  -2.473  -9.537 -19.692
  766    HB3  ALA  92           HB3      ALA  92  -3.383  -9.613 -21.211
  767    H    LYS  93           H        LYS  93   0.179 -10.641 -19.819
  768    HA   LYS  93           HA       LYS  93   1.335  -9.323 -22.065
  769    HB2  LYS  93           HB2      LYS  93   2.711 -10.699 -19.722
  770    HB3  LYS  93           HB3      LYS  93   3.562  -9.869 -20.998
  771    HG2  LYS  93           HG2      LYS  93   2.307  -7.766 -20.465
  772    HG3  LYS  93           HG3      LYS  93   1.593  -8.587 -19.065
  773    HD2  LYS  93           HD2      LYS  93   3.885  -9.004 -18.147
  774    HD3  LYS  93           HD3      LYS  93   4.581  -8.260 -19.587
  775    HE2  LYS  93           HE2      LYS  93   4.715  -6.487 -18.176
  776    HE3  LYS  93           HE3      LYS  93   3.164  -6.159 -18.942
  777    HZ1  LYS  93           HZ1      LYS  93   2.993  -5.875 -16.583
  778    HZ2  LYS  93           HZ2      LYS  93   2.095  -7.174 -16.931
  779    HZ3  LYS  93           HZ3      LYS  93   3.578  -7.362 -16.249
  780    H    ILE  94           H        ILE  94   1.766 -12.798 -21.038
  781    HA   ILE  94           HA       ILE  94   3.402 -13.243 -23.370
  782    HB   ILE  94           HB       ILE  94   3.445 -15.574 -22.772
  783   HG12  ILE  94          HG12      ILE  94   1.424 -14.931 -20.601
  784   HG13  ILE  94          HG13      ILE  94   1.101 -15.895 -22.042
  785   HG21  ILE  94          HG21      ILE  94   3.725 -13.847 -20.273
  786   HG22  ILE  94          HG22      ILE  94   4.626 -15.320 -20.678
  787   HG23  ILE  94          HG23      ILE  94   4.878 -13.856 -21.625
  788   HD11  ILE  94          HD11      ILE  94   1.420 -17.383 -20.189
  789   HD12  ILE  94          HD12      ILE  94   2.817 -17.551 -21.272
  790   HD13  ILE  94          HD13      ILE  94   2.960 -16.630 -19.752
  791    H    LYS  95           H        LYS  95  -0.073 -13.688 -22.787
  792    HA   LYS  95           HA       LYS  95  -0.544 -15.006 -25.334
  793    HB2  LYS  95           HB2      LYS  95  -2.353 -13.514 -23.388
  794    HB3  LYS  95           HB3      LYS  95  -2.959 -14.294 -24.841
  795    HG2  LYS  95           HG2      LYS  95  -1.494 -15.770 -22.607
  796    HG3  LYS  95           HG3      LYS  95  -3.247 -15.635 -22.758
  797    HD2  LYS  95           HD2      LYS  95  -3.134 -16.783 -24.972
  798    HD3  LYS  95           HD3      LYS  95  -1.378 -16.981 -24.760
  799    HE2  LYS  95           HE2      LYS  95  -1.769 -18.252 -22.667
  800    HE3  LYS  95           HE3      LYS  95  -3.515 -18.059 -22.869
  801    HZ1  LYS  95           HZ1      LYS  95  -3.354 -19.342 -24.923
  802    HZ2  LYS  95           HZ2      LYS  95  -1.739 -19.524 -24.737
  803    HZ3  LYS  95           HZ3      LYS  95  -2.767 -20.204 -23.673
  804    H    GLY  96           H        GLY  96   0.070 -11.686 -24.472
  805    HA2  GLY  96           HA2      GLY  96   0.481  -9.967 -26.010
  806    HA3  GLY  96           HA3      GLY  96  -0.428 -10.829 -27.257
  807    H    THR  97           H        THR  97  -2.548 -11.244 -24.832
  808    HA   THR  97           HA       THR  97  -4.305  -9.226 -25.767
  809    HB   THR  97           HB       THR  97  -5.734 -10.239 -23.842
  810    HG1  THR  97           HG1      THR  97  -4.941 -12.161 -23.058
  811   HG21  THR  97          HG21      THR  97  -5.971 -10.832 -26.238
  812   HG22  THR  97          HG22      THR  97  -4.657 -12.019 -26.082
  813   HG23  THR  97          HG23      THR  97  -6.181 -12.247 -25.196
  814    H    PHE  98           H        PHE  98  -1.769  -8.849 -23.564
  815    HA   PHE  98           HA       PHE  98  -2.911  -6.909 -21.816
  816    HD1  PHE  98           HD1      PHE  98   0.280  -8.601 -24.046
  817    HD2  PHE  98           HD2      PHE  98   0.620  -4.645 -22.361
  818    HE1  PHE  98           HE1      PHE  98   2.055  -8.053 -25.684
  819    HE2  PHE  98           HE2      PHE  98   2.424  -4.117 -23.975
  820    HZ   PHE  98           HZ       PHE  98   3.147  -5.816 -25.640
  821    HB2  PHE  98           HB2      PHE  98  -0.749  -6.241 -21.295
  822    HB3  PHE  98           HB3      PHE  98  -0.598  -7.945 -21.633
  823    H    LYS  99           H        LYS  99  -2.200  -6.817 -25.250
  824    HA   LYS  99           HA       LYS  99  -3.406  -4.116 -25.355
  825    HB2  LYS  99           HB2      LYS  99  -1.838  -3.311 -27.006
  826    HB3  LYS  99           HB3      LYS  99  -0.994  -3.726 -25.514
  827    HG2  LYS  99           HG2      LYS  99  -0.233  -5.869 -26.546
  828    HG3  LYS  99           HG3      LYS  99  -1.077  -5.436 -28.045
  829    HD2  LYS  99           HD2      LYS  99   0.328  -3.403 -28.254
  830    HD3  LYS  99           HD3      LYS  99   1.209  -3.868 -26.781
  831    HE2  LYS  99           HE2      LYS  99   1.922  -5.979 -27.858
  832    HE3  LYS  99           HE3      LYS  99   0.988  -5.578 -29.303
  833    HZ1  LYS  99           HZ1      LYS  99   3.319  -5.042 -29.591
  834    HZ2  LYS  99           HZ2      LYS  99   2.441  -3.675 -29.655
  835    HZ3  LYS  99           HZ3      LYS  99   3.314  -4.026 -28.317
  836    H    GLU 100           H        GLU 100  -2.735  -7.232 -26.984
  837    HA   GLU 100           HA       GLU 100  -4.416  -6.689 -29.256
  838    HB2  GLU 100           HB2      GLU 100  -2.672  -8.467 -29.167
  839    HB3  GLU 100           HB3      GLU 100  -3.601  -9.319 -27.937
  840    HG2  GLU 100           HG2      GLU 100  -3.846 -10.351 -30.132
  841    HG3  GLU 100           HG3      GLU 100  -5.387  -9.792 -29.513
  842    H    ARG 101           H        ARG 101  -6.575  -7.764 -29.582
  843    HA   ARG 101           HA       ARG 101  -8.208  -7.830 -27.076
  844    HE   ARG 101           HE       ARG 101  -9.326  -3.342 -30.028
  845    HB2  ARG 101           HB2      ARG 101  -8.623  -6.096 -29.555
  846    HB3  ARG 101           HB3      ARG 101  -9.822  -6.288 -28.273
  847    HG2  ARG 101           HG2      ARG 101  -8.298  -5.308 -26.618
  848    HG3  ARG 101           HG3      ARG 101  -7.035  -5.141 -27.834
  849    HD2  ARG 101           HD2      ARG 101  -9.708  -3.712 -27.823
  850    HD3  ARG 101           HD3      ARG 101  -8.138  -3.001 -27.449
  851   HH11  ARG 101          HH21      ARG 101  -6.013  -3.601 -28.612
  852   HH12  ARG 101          HH22      ARG 101  -5.283  -2.989 -30.043
  853   HH21  ARG 101          HH11      ARG 101  -8.376  -2.644 -31.781
  854   HH22  ARG 101          HH12      ARG 101  -6.637  -2.471 -31.952
  855    HA   PRO 102           HA       PRO 102 -10.206 -11.162 -29.173
  856    HB2  PRO 102           HB2      PRO 102 -12.847 -10.991 -28.375
  857    HB3  PRO 102           HB3      PRO 102 -11.509 -11.556 -27.330
  858    HG2  PRO 102           HG2      PRO 102 -12.721  -8.782 -27.468
  859    HG3  PRO 102           HG3      PRO 102 -12.350  -9.759 -26.011
  860    HD2  PRO 102           HD2      PRO 102 -10.663  -7.825 -26.881
  861    HD3  PRO 102           HD3      PRO 102 -10.025  -9.361 -26.228
  862    H    LYS 103           H        LYS 103 -11.464  -7.899 -29.621
  863    HA   LYS 103           HA       LYS 103 -11.842  -8.430 -32.487
  864    HB2  LYS 103           HB2      LYS 103 -13.869  -6.940 -30.741
  865    HB3  LYS 103           HB3      LYS 103 -13.836  -6.915 -32.507
  866    HG2  LYS 103           HG2      LYS 103 -14.189  -9.386 -32.538
  867    HG3  LYS 103           HG3      LYS 103 -14.317  -9.372 -30.766
  868    HD2  LYS 103           HD2      LYS 103 -16.233  -7.796 -30.924
  869    HD3  LYS 103           HD3      LYS 103 -16.159  -7.872 -32.687
  870    HE2  LYS 103           HE2      LYS 103 -16.643 -10.252 -30.831
  871    HE3  LYS 103           HE3      LYS 103 -17.913  -9.340 -31.648
  872    HZ1  LYS 103           HZ1      LYS 103 -16.969 -10.032 -33.772
  873    HZ2  LYS 103           HZ2      LYS 103 -15.806 -10.906 -33.019
  874    HZ3  LYS 103           HZ3      LYS 103 -17.371 -11.326 -32.872
  875    H    LYS 104           H        LYS 104 -11.049  -6.655 -33.656
  876    HA   LYS 104           HA       LYS 104  -9.109  -5.035 -32.388
  877    HB2  LYS 104           HB2      LYS 104 -10.470  -4.697 -35.094
  878    HB3  LYS 104           HB3      LYS 104  -9.071  -3.766 -34.546
  879    HG2  LYS 104           HG2      LYS 104  -7.772  -5.877 -34.262
  880    HG3  LYS 104           HG3      LYS 104  -9.130  -6.799 -34.917
  881    HD2  LYS 104           HD2      LYS 104  -7.592  -4.621 -36.399
  882    HD3  LYS 104           HD3      LYS 104  -7.348  -6.365 -36.583
  883    HE2  LYS 104           HE2      LYS 104  -9.709  -6.613 -37.346
  884    HE3  LYS 104           HE3      LYS 104  -9.930  -4.864 -37.212
  885    HZ1  LYS 104           HZ1      LYS 104  -8.217  -4.583 -38.907
  886    HZ2  LYS 104           HZ2      LYS 104  -8.015  -6.201 -39.034
  887    HZ3  LYS 104           HZ3      LYS 104  -9.425  -5.516 -39.474
  Start of MODEL    3
    1    HA   MET   1           HA       MET   1   1.148 -18.013   2.691
    2    H1   MET   1           H1       MET   1   1.605 -17.352   4.936
    3    H2   MET   1           H2       MET   1   1.067 -15.837   4.663
    4    H3   MET   1           H3       MET   1   0.020 -17.103   4.607
    5    HB2  MET   1           HB2      MET   1   0.279 -15.103   2.366
    6    HB3  MET   1           HB3      MET   1   0.656 -16.188   1.026
    7    HG2  MET   1           HG2      MET   1  -1.123 -17.745   1.761
    8    HG3  MET   1           HG3      MET   1  -1.555 -16.630   3.064
    9    HE1  MET   1           HE1      MET   1  -4.597 -16.354   0.612
   10    HE2  MET   1           HE2      MET   1  -3.633 -17.805   0.963
   11    HE3  MET   1           HE3      MET   1  -4.074 -16.689   2.277
   12    H    GLU   2           H        GLU   2   2.926 -18.031   1.283
   13    HA   GLU   2           HA       GLU   2   4.904 -15.920   1.320
   14    HB2  GLU   2           HB2      GLU   2   6.777 -17.330   1.991
   15    HB3  GLU   2           HB3      GLU   2   5.612 -17.186   3.299
   16    HG2  GLU   2           HG2      GLU   2   4.691 -19.450   2.691
   17    HG3  GLU   2           HG3      GLU   2   5.937 -19.593   1.453
   18    H    MET   3           H        MET   3   6.751 -16.676  -0.259
   19    HA   MET   3           HA       MET   3   5.501 -17.355  -2.741
   20    HB2  MET   3           HB2      MET   3   7.724 -17.153  -3.672
   21    HB3  MET   3           HB3      MET   3   7.415 -15.818  -2.580
   22    HG2  MET   3           HG2      MET   3   9.166 -18.256  -2.076
   23    HG3  MET   3           HG3      MET   3   9.711 -16.622  -2.379
   24    HE1  MET   3           HE1      MET   3   8.608 -14.849   1.060
   25    HE2  MET   3           HE2      MET   3   9.389 -14.556  -0.508
   26    HE3  MET   3           HE3      MET   3   7.656 -14.942  -0.429
   27    H    LEU   4           H        LEU   4   5.959 -19.113  -4.149
   28    HA   LEU   4           HA       LEU   4   6.592 -21.687  -2.790
   29    HG   LEU   4           HG       LEU   4   4.445 -22.803  -2.912
   30    HB2  LEU   4           HB2      LEU   4   5.029 -20.991  -5.303
   31    HB3  LEU   4           HB3      LEU   4   5.719 -22.584  -5.030
   32   HD11  LEU   4          HD11      LEU   4   3.084 -20.223  -3.779
   33   HD12  LEU   4          HD12      LEU   4   2.436 -21.349  -2.568
   34   HD13  LEU   4          HD13      LEU   4   3.959 -20.524  -2.260
   35   HD21  LEU   4          HD21      LEU   4   2.287 -23.263  -4.022
   36   HD22  LEU   4          HD22      LEU   4   2.772 -22.256  -5.406
   37   HD23  LEU   4          HD23      LEU   4   3.639 -23.765  -5.042
   38    HA   PRO   5           HA       PRO   5  10.575 -21.059  -4.799
   39    HB2  PRO   5           HB2      PRO   5  10.647 -24.074  -4.641
   40    HB3  PRO   5           HB3      PRO   5  11.942 -22.887  -4.284
   41    HG2  PRO   5           HG2      PRO   5  10.539 -23.985  -2.254
   42    HG3  PRO   5           HG3      PRO   5  10.902 -22.227  -2.253
   43    HD2  PRO   5           HD2      PRO   5   8.320 -23.610  -3.025
   44    HD3  PRO   5           HD3      PRO   5   8.572 -22.124  -2.057
   45    H    ASN   6           H        ASN   6  11.075 -20.754  -6.821
   46    HA   ASN   6           HA       ASN   6  10.784 -22.753  -8.870
   47    HB2  ASN   6           HB2      ASN   6   8.582 -21.494  -9.102
   48    HB3  ASN   6           HB3      ASN   6   9.513 -20.004  -9.328
   49   HD21  ASN   6          HD22      ASN   6   8.813 -23.234 -10.725
   50   HD22  ASN   6          HD21      ASN   6   9.532 -22.931 -12.287
   51    H    GLN   7           H        GLN   7  12.299 -22.089 -10.669
   52    HA   GLN   7           HA       GLN   7  14.600 -20.821  -9.546
   53    HB2  GLN   7           HB2      GLN   7  14.412 -22.713 -11.303
   54    HB3  GLN   7           HB3      GLN   7  14.175 -21.422 -12.496
   55    HG2  GLN   7           HG2      GLN   7  16.351 -20.436 -11.820
   56    HG3  GLN   7           HG3      GLN   7  16.542 -21.669 -10.577
   57   HE21  GLN   7          HE22      GLN   7  18.596 -21.462 -12.130
   58   HE22  GLN   7          HE21      GLN   7  18.698 -22.750 -13.329
   59    H    THR   8           H        THR   8  11.851 -19.491 -11.216
   60    HA   THR   8           HA       THR   8  13.295 -16.994 -11.908
   61    HB   THR   8           HB       THR   8  10.599 -18.010 -12.819
   62    HG1  THR   8           HG1      THR   8  11.407 -19.088 -14.329
   63   HG21  THR   8          HG21      THR   8  10.991 -16.538 -14.793
   64   HG22  THR   8          HG22      THR   8  10.943 -15.629 -13.292
   65   HG23  THR   8          HG23      THR   8  12.506 -15.969 -14.052
   66    H    ILE   9           H        ILE   9  12.375 -15.004 -11.299
   67    HA   ILE   9           HA       ILE   9   9.902 -15.022  -9.699
   68    HB   ILE   9           HB       ILE   9  10.684 -13.670  -7.989
   69   HG12  ILE   9          HG12      ILE   9  13.087 -13.037  -9.692
   70   HG13  ILE   9          HG13      ILE   9  11.811 -11.948  -9.172
   71   HG21  ILE   9          HG21      ILE   9  11.515 -16.014  -7.806
   72   HG22  ILE   9          HG22      ILE   9  13.078 -15.492  -8.480
   73   HG23  ILE   9          HG23      ILE   9  12.527 -14.864  -6.932
   74   HD11  ILE   9          HD11      ILE   9  12.579 -12.207  -6.795
   75   HD12  ILE   9          HD12      ILE   9  13.970 -13.122  -7.380
   76   HD13  ILE   9          HD13      ILE   9  13.758 -11.440  -7.884
   77    H    TYR  10           H        TYR  10   8.927 -12.872  -9.656
   78    HA   TYR  10           HA       TYR  10   9.212 -11.368 -12.220
   79    HD1  TYR  10           HD2      TYR  10   7.790 -10.139 -13.544
   80    HD2  TYR  10           HD1      TYR  10   4.563 -12.181 -11.529
   81    HE1  TYR  10           HE2      TYR  10   6.162  -8.810 -14.818
   82    HE2  TYR  10           HE1      TYR  10   2.920 -10.857 -12.817
   83    HH   TYR  10           HH       TYR  10   3.914  -8.320 -15.157
   84    HB2  TYR  10           HB2      TYR  10   7.424 -13.007 -12.395
   85    HB3  TYR  10           HB3      TYR  10   6.785 -12.560 -10.822
   86    H    ILE  11           H        ILE  11   9.478  -9.283 -11.774
   87    HA   ILE  11           HA       ILE  11   8.938  -8.229  -9.032
   88    HB   ILE  11           HB       ILE  11  10.938  -7.519 -11.230
   89   HG12  ILE  11          HG12      ILE  11  11.482  -8.395  -8.356
   90   HG13  ILE  11          HG13      ILE  11  11.370  -9.547  -9.682
   91   HG21  ILE  11          HG21      ILE  11  10.535  -6.107  -8.551
   92   HG22  ILE  11          HG22      ILE  11  11.804  -5.766  -9.759
   93   HG23  ILE  11          HG23      ILE  11  10.125  -5.441 -10.147
   94   HD11  ILE  11          HD11      ILE  11  13.260  -8.400 -10.832
   95   HD12  ILE  11          HD12      ILE  11  13.463  -7.373  -9.388
   96   HD13  ILE  11          HD13      ILE  11  13.672  -9.134  -9.272
   97    H    ASN  12           H        ASN  12   7.405  -6.580  -8.929
   98    HA   ASN  12           HA       ASN  12   6.317  -5.585 -11.517
   99    HB2  ASN  12           HB2      ASN  12   5.240  -7.735 -10.339
  100    HB3  ASN  12           HB3      ASN  12   4.453  -6.519  -9.331
  101   HD21  ASN  12          HD22      ASN  12   5.231  -7.271 -12.759
  102   HD22  ASN  12          HD21      ASN  12   3.746  -6.690 -13.446
  103    H    ASN  13           H        ASN  13   7.740  -4.244  -9.043
  104    HA   ASN  13           HA       ASN  13   6.109  -1.874  -9.398
  105    HB2  ASN  13           HB2      ASN  13   5.313  -2.861  -7.199
  106    HB3  ASN  13           HB3      ASN  13   6.943  -2.592  -6.566
  107   HD21  ASN  13          HD22      ASN  13   6.477  -0.900  -5.066
  108   HD22  ASN  13          HD21      ASN  13   5.716   0.608  -5.536
  109    H    LEU  14           H        LEU  14   8.297  -2.510 -10.711
  110    HA   LEU  14           HA       LEU  14  10.806  -1.627  -9.505
  111    HG   LEU  14           HG       LEU  14  12.535  -3.091 -10.882
  112    HB2  LEU  14           HB2      LEU  14  10.213  -3.385 -11.406
  113    HB3  LEU  14           HB3      LEU  14  10.171  -1.983 -12.442
  114   HD11  LEU  14          HD11      LEU  14  11.906  -2.902 -13.865
  115   HD12  LEU  14          HD12      LEU  14  13.353  -3.629 -13.155
  116   HD13  LEU  14          HD13      LEU  14  11.780  -4.362 -12.861
  117   HD21  LEU  14          HD21      LEU  14  13.012  -0.747 -10.929
  118   HD22  LEU  14          HD22      LEU  14  13.939  -1.471 -12.235
  119   HD23  LEU  14          HD23      LEU  14  12.449  -0.590 -12.614
  120    H    ASN  15           H        ASN  15  11.775   0.471  -9.982
  121    HA   ASN  15           HA       ASN  15   9.857   2.597 -10.531
  122    HB2  ASN  15           HB2      ASN  15  11.715   2.760  -8.842
  123    HB3  ASN  15           HB3      ASN  15  12.867   2.846 -10.182
  124   HD21  ASN  15          HD22      ASN  15  12.093   4.878  -8.056
  125   HD22  ASN  15          HD21      ASN  15  11.574   6.289  -8.959
  126    H    GLU  16           H        GLU  16   9.252   3.109 -12.529
  127    HA   GLU  16           HA       GLU  16  10.395   2.127 -14.864
  128    HB2  GLU  16           HB2      GLU  16   8.852   3.621 -16.037
  129    HB3  GLU  16           HB3      GLU  16   8.071   2.815 -14.677
  130    HG2  GLU  16           HG2      GLU  16   8.310   4.876 -13.305
  131    HG3  GLU  16           HG3      GLU  16   9.136   5.678 -14.639
  132    H    LYS  17           H        LYS  17  11.575   4.893 -13.065
  133    HA   LYS  17           HA       LYS  17  12.706   6.324 -15.249
  134    HB2  LYS  17           HB2      LYS  17  13.906   7.556 -13.758
  135    HB3  LYS  17           HB3      LYS  17  12.405   7.153 -12.930
  136    HG2  LYS  17           HG2      LYS  17  13.692   5.308 -11.706
  137    HG3  LYS  17           HG3      LYS  17  15.171   5.916 -12.480
  138    HD2  LYS  17           HD2      LYS  17  14.746   8.159 -11.574
  139    HD3  LYS  17           HD3      LYS  17  13.279   7.567 -10.769
  140    HE2  LYS  17           HE2      LYS  17  14.628   5.998  -9.408
  141    HE3  LYS  17           HE3      LYS  17  16.101   6.503 -10.250
  142    HZ1  LYS  17           HZ1      LYS  17  15.880   7.623  -8.122
  143    HZ2  LYS  17           HZ2      LYS  17  15.802   8.721  -9.318
  144    HZ3  LYS  17           HZ3      LYS  17  14.441   8.268  -8.537
  145    H    ILE  18           H        ILE  18  13.616   3.296 -13.794
  146    HA   ILE  18           HA       ILE  18  16.426   3.371 -14.460
  147    HB   ILE  18           HB       ILE  18  14.531   1.106 -13.697
  148   HG12  ILE  18          HG12      ILE  18  14.637   2.768 -11.912
  149   HG13  ILE  18          HG13      ILE  18  15.492   1.325 -11.430
  150   HG21  ILE  18          HG21      ILE  18  16.553  -0.134 -12.949
  151   HG22  ILE  18          HG22      ILE  18  16.472   0.078 -14.693
  152   HG23  ILE  18          HG23      ILE  18  17.575   1.086 -13.727
  153   HD11  ILE  18          HD11      ILE  18  17.666   2.451 -11.845
  154   HD12  ILE  18          HD12      ILE  18  16.811   3.908 -12.414
  155   HD13  ILE  18          HD13      ILE  18  16.652   3.396 -10.745
  156    H    LYS  19           H        LYS  19  17.393   1.770 -15.956
  157    HA   LYS  19           HA       LYS  19  15.967   1.561 -18.556
  158    HB2  LYS  19           HB2      LYS  19  17.411   3.622 -18.336
  159    HB3  LYS  19           HB3      LYS  19  18.802   2.590 -18.014
  160    HG2  LYS  19           HG2      LYS  19  18.635   1.649 -20.304
  161    HG3  LYS  19           HG3      LYS  19  17.181   2.632 -20.602
  162    HD2  LYS  19           HD2      LYS  19  18.516   4.697 -20.213
  163    HD3  LYS  19           HD3      LYS  19  19.959   3.708 -19.916
  164    HE2  LYS  19           HE2      LYS  19  19.804   2.804 -22.231
  165    HE3  LYS  19           HE3      LYS  19  18.373   3.808 -22.521
  166    HZ1  LYS  19           HZ1      LYS  19  20.374   4.851 -23.377
  167    HZ2  LYS  19           HZ2      LYS  19  19.760   5.768 -22.181
  168    HZ3  LYS  19           HZ3      LYS  19  21.082   4.845 -21.912
  169    H    LYS  20           H        LYS  20  17.250  -0.145 -19.957
  170    HA   LYS  20           HA       LYS  20  17.178  -2.530 -18.478
  171    HB2  LYS  20           HB2      LYS  20  16.900  -2.327 -20.974
  172    HB3  LYS  20           HB3      LYS  20  18.662  -2.113 -21.109
  173    HG2  LYS  20           HG2      LYS  20  18.928  -4.381 -19.985
  174    HG3  LYS  20           HG3      LYS  20  17.169  -4.558 -20.030
  175    HD2  LYS  20           HD2      LYS  20  17.237  -4.421 -22.518
  176    HD3  LYS  20           HD3      LYS  20  18.993  -4.165 -22.454
  177    HE2  LYS  20           HE2      LYS  20  19.249  -6.376 -21.307
  178    HE3  LYS  20           HE3      LYS  20  17.510  -6.642 -21.463
  179    HZ1  LYS  20           HZ1      LYS  20  18.732  -7.736 -23.229
  180    HZ2  LYS  20           HZ2      LYS  20  17.793  -6.578 -23.883
  181    HZ3  LYS  20           HZ3      LYS  20  19.404  -6.340 -23.725
  182    H    GLU  21           H        GLU  21  20.067  -0.696 -19.555
  183    HA   GLU  21           HA       GLU  21  21.986  -2.540 -18.579
  184    HB2  GLU  21           HB2      GLU  21  22.464  -0.821 -20.212
  185    HB3  GLU  21           HB3      GLU  21  22.080   0.467 -19.063
  186    HG2  GLU  21           HG2      GLU  21  23.996  -0.116 -17.665
  187    HG3  GLU  21           HG3      GLU  21  24.343  -1.536 -18.663
  188    H    GLU  22           H        GLU  22  20.392   0.276 -17.014
  189    HA   GLU  22           HA       GLU  22  21.946   0.094 -14.614
  190    HB2  GLU  22           HB2      GLU  22  19.391   1.524 -15.376
  191    HB3  GLU  22           HB3      GLU  22  20.008   1.584 -13.725
  192    HG2  GLU  22           HG2      GLU  22  21.811   2.314 -16.060
  193    HG3  GLU  22           HG3      GLU  22  20.645   3.466 -15.412
  194    H    LEU  23           H        LEU  23  18.817  -1.251 -15.627
  195    HA   LEU  23           HA       LEU  23  18.050  -2.439 -13.150
  196    HG   LEU  23           HG       LEU  23  15.447  -4.237 -15.386
  197    HB2  LEU  23           HB2      LEU  23  16.480  -2.199 -14.950
  198    HB3  LEU  23           HB3      LEU  23  17.493  -3.043 -16.090
  199   HD11  LEU  23          HD11      LEU  23  16.337  -6.417 -15.281
  200   HD12  LEU  23          HD12      LEU  23  17.418  -5.457 -16.310
  201   HD13  LEU  23          HD13      LEU  23  17.884  -5.863 -14.653
  202   HD21  LEU  23          HD21      LEU  23  15.263  -5.259 -13.203
  203   HD22  LEU  23          HD22      LEU  23  16.862  -4.657 -12.725
  204   HD23  LEU  23          HD23      LEU  23  15.545  -3.515 -12.976
  205    H    LYS  24           H        LYS  24  19.919  -3.775 -15.934
  206    HA   LYS  24           HA       LYS  24  20.409  -6.301 -14.766
  207    HB2  LYS  24           HB2      LYS  24  20.696  -5.686 -17.160
  208    HB3  LYS  24           HB3      LYS  24  22.125  -4.730 -16.751
  209    HG2  LYS  24           HG2      LYS  24  23.308  -6.759 -16.009
  210    HG3  LYS  24           HG3      LYS  24  21.832  -7.710 -16.193
  211    HD2  LYS  24           HD2      LYS  24  23.256  -8.169 -18.083
  212    HD3  LYS  24           HD3      LYS  24  21.821  -7.309 -18.617
  213    HE2  LYS  24           HE2      LYS  24  23.668  -6.405 -19.823
  214    HE3  LYS  24           HE3      LYS  24  23.154  -5.171 -18.676
  215    HZ1  LYS  24           HZ1      LYS  24  25.040  -5.825 -17.260
  216    HZ2  LYS  24           HZ2      LYS  24  25.477  -6.990 -18.323
  217    HZ3  LYS  24           HZ3      LYS  24  25.565  -5.425 -18.748
  218    H    LYS  25           H        LYS  25  22.423  -3.343 -14.736
  219    HA   LYS  25           HA       LYS  25  24.531  -4.242 -13.100
  220    HB2  LYS  25           HB2      LYS  25  24.706  -2.231 -14.307
  221    HB3  LYS  25           HB3      LYS  25  23.233  -1.557 -13.652
  222    HG2  LYS  25           HG2      LYS  25  25.636  -2.034 -11.855
  223    HG3  LYS  25           HG3      LYS  25  25.527  -0.641 -12.927
  224    HD2  LYS  25           HD2      LYS  25  23.140  -0.279 -11.800
  225    HD3  LYS  25           HD3      LYS  25  23.812  -1.294 -10.524
  226    HE2  LYS  25           HE2      LYS  25  24.116   1.012  -9.946
  227    HE3  LYS  25           HE3      LYS  25  25.703   0.300 -10.256
  228    HZ1  LYS  25           HZ1      LYS  25  25.766   1.411 -12.357
  229    HZ2  LYS  25           HZ2      LYS  25  24.197   1.863 -12.293
  230    HZ3  LYS  25           HZ3      LYS  25  25.301   2.534 -11.272
  231    H    SER  26           H        SER  26  21.399  -2.721 -12.075
  232    HA   SER  26           HA       SER  26  22.064  -2.746  -9.325
  233    HG   SER  26           HG       SER  26  20.469  -1.058 -11.416
  234    HB2  SER  26           HB2      SER  26  19.320  -2.753 -10.622
  235    HB3  SER  26           HB3      SER  26  19.705  -2.258  -8.958
  236    H    LEU  27           H        LEU  27  20.270  -5.108 -11.302
  237    HA   LEU  27           HA       LEU  27  19.551  -6.850  -9.165
  238    HG   LEU  27           HG       LEU  27  17.798  -6.132 -11.397
  239    HB2  LEU  27           HB2      LEU  27  19.935  -7.187 -12.150
  240    HB3  LEU  27           HB3      LEU  27  19.574  -8.570 -11.139
  241   HD11  LEU  27          HD11      LEU  27  17.425  -8.992 -12.394
  242   HD12  LEU  27          HD12      LEU  27  16.312  -7.627 -12.651
  243   HD13  LEU  27          HD13      LEU  27  17.916  -7.622 -13.397
  244   HD21  LEU  27          HD21      LEU  27  17.427  -8.738  -9.876
  245   HD22  LEU  27          HD22      LEU  27  17.403  -7.074  -9.229
  246   HD23  LEU  27          HD23      LEU  27  16.099  -7.623 -10.270
  247    H    TYR  28           H        TYR  28  22.457  -6.969 -11.370
  248    HA   TYR  28           HA       TYR  28  23.606  -9.147  -9.883
  249    HD1  TYR  28           HD2      TYR  28  25.487 -10.685 -10.950
  250    HD2  TYR  28           HD1      TYR  28  23.704  -8.048 -13.857
  251    HE1  TYR  28           HE2      TYR  28  25.122 -12.614 -12.468
  252    HE2  TYR  28           HE1      TYR  28  23.403  -9.952 -15.408
  253    HH   TYR  28           HH       TYR  28  23.642 -12.253 -15.721
  254    HB2  TYR  28           HB2      TYR  28  24.701  -7.126 -11.849
  255    HB3  TYR  28           HB3      TYR  28  25.800  -8.144 -10.933
  256    H    ALA  29           H        ALA  29  23.653  -5.634  -9.346
  257    HA   ALA  29           HA       ALA  29  25.820  -5.646  -7.500
  258    HB1  ALA  29           HB1      ALA  29  25.058  -3.402  -6.873
  259    HB2  ALA  29           HB2      ALA  29  25.067  -3.595  -8.631
  260    HB3  ALA  29           HB3      ALA  29  23.529  -3.650  -7.728
  261    H    ILE  30           H        ILE  30  22.282  -6.122  -6.957
  262    HA   ILE  30           HA       ILE  30  23.017  -6.825  -4.136
  263    HB   ILE  30           HB       ILE  30  20.741  -5.824  -3.519
  264   HG12  ILE  30          HG12      ILE  30  21.274  -4.080  -5.956
  265   HG13  ILE  30          HG13      ILE  30  19.992  -5.298  -5.854
  266   HG21  ILE  30          HG21      ILE  30  23.019  -5.048  -2.798
  267   HG22  ILE  30          HG22      ILE  30  23.050  -3.943  -4.189
  268   HG23  ILE  30          HG23      ILE  30  21.846  -3.742  -2.897
  269   HD11  ILE  30          HD11      ILE  30  18.994  -4.039  -3.944
  270   HD12  ILE  30          HD12      ILE  30  20.245  -2.789  -4.137
  271   HD13  ILE  30          HD13      ILE  30  19.095  -3.079  -5.436
  272    H    PHE  31           H        PHE  31  20.519  -7.503  -6.676
  273    HA   PHE  31           HA       PHE  31  19.168  -9.386  -4.981
  274    HD1  PHE  31           HD2      PHE  31  18.107  -6.718  -6.736
  275    HD2  PHE  31           HD1      PHE  31  16.369 -10.666  -6.708
  276    HE1  PHE  31           HE2      PHE  31  15.866  -5.738  -6.352
  277    HE2  PHE  31           HE1      PHE  31  14.136  -9.679  -6.310
  278    HZ   PHE  31           HZ       PHE  31  13.874  -7.216  -6.141
  279    HB2  PHE  31           HB2      PHE  31  19.178  -8.861  -7.934
  280    HB3  PHE  31           HB3      PHE  31  18.591 -10.406  -7.377
  281    H    SER  32           H        SER  32  21.938  -9.856  -7.286
  282    HA   SER  32           HA       SER  32  22.157 -12.635  -6.884
  283    HG   SER  32           HG       SER  32  24.054 -11.436  -9.484
  284    HB2  SER  32           HB2      SER  32  24.252 -10.511  -7.433
  285    HB3  SER  32           HB3      SER  32  24.639 -12.245  -7.347
  286    H    GLN  33           H        GLN  33  23.144 -10.004  -4.672
  287    HA   GLN  33           HA       GLN  33  24.754 -11.795  -3.038
  288    HB2  GLN  33           HB2      GLN  33  23.903  -8.893  -2.850
  289    HB3  GLN  33           HB3      GLN  33  24.626  -9.704  -1.467
  290    HG2  GLN  33           HG2      GLN  33  26.303  -8.485  -2.809
  291    HG3  GLN  33           HG3      GLN  33  26.650 -10.203  -2.656
  292   HE21  GLN  33          HE22      GLN  33  25.441  -7.687  -4.946
  293   HE22  GLN  33          HE21      GLN  33  25.711  -8.629  -6.391
  294    H    PHE  34           H        PHE  34  21.466 -11.722  -3.494
  295    HA   PHE  34           HA       PHE  34  21.050 -12.979  -0.832
  296    HD1  PHE  34           HD1      PHE  34  20.340 -11.547   1.103
  297    HD2  PHE  34           HD2      PHE  34  19.526  -9.066  -2.331
  298    HE1  PHE  34           HE1      PHE  34  21.015  -9.537   2.390
  299    HE2  PHE  34           HE2      PHE  34  20.202  -7.062  -1.042
  300    HZ   PHE  34           HZ       PHE  34  20.949  -7.289   1.323
  301    HB2  PHE  34           HB2      PHE  34  19.036 -11.376  -2.446
  302    HB3  PHE  34           HB3      PHE  34  18.716 -12.205  -0.927
  303    H    GLY  35           H        GLY  35  21.618 -13.889  -3.942
  304    HA2  GLY  35           HA2      GLY  35  20.534 -16.441  -3.488
  305    HA3  GLY  35           HA3      GLY  35  19.339 -15.575  -4.450
  306    H    GLN  36           H        GLN  36  22.584 -14.719  -5.232
  307    HA   GLN  36           HA       GLN  36  23.458 -14.540  -7.231
  308    HB2  GLN  36           HB2      GLN  36  24.729 -16.285  -6.130
  309    HB3  GLN  36           HB3      GLN  36  23.734 -17.530  -6.895
  310    HG2  GLN  36           HG2      GLN  36  25.920 -17.160  -8.056
  311    HG3  GLN  36           HG3      GLN  36  24.538 -16.902  -9.105
  312   HE21  GLN  36          HE22      GLN  36  24.523 -15.003 -10.322
  313   HE22  GLN  36          HE21      GLN  36  25.456 -13.578  -9.925
  314    H    ILE  37           H        ILE  37  22.514 -13.804  -8.929
  315    HA   ILE  37           HA       ILE  37  20.356 -14.980 -10.360
  316    HB   ILE  37           HB       ILE  37  22.412 -12.824 -10.933
  317   HG12  ILE  37          HG12      ILE  37  19.448 -12.783 -10.169
  318   HG13  ILE  37          HG13      ILE  37  20.773 -12.488  -9.051
  319   HG21  ILE  37          HG21      ILE  37  21.683 -13.624 -13.127
  320   HG22  ILE  37          HG22      ILE  37  19.976 -13.431 -12.640
  321   HG23  ILE  37          HG23      ILE  37  21.075 -12.036 -12.783
  322   HD11  ILE  37          HD11      ILE  37  19.880 -10.392  -9.618
  323   HD12  ILE  37          HD12      ILE  37  21.454 -10.510 -10.433
  324   HD13  ILE  37          HD13      ILE  37  19.941 -10.737 -11.351
  325    H    LEU  38           H        LEU  38  20.327 -15.895 -12.374
  326    HA   LEU  38           HA       LEU  38  22.792 -17.089 -13.509
  327    HG   LEU  38           HG       LEU  38  20.950 -18.794 -15.543
  328    HB2  LEU  38           HB2      LEU  38  21.374 -18.830 -12.512
  329    HB3  LEU  38           HB3      LEU  38  19.955 -18.186 -13.342
  330   HD11  LEU  38          HD11      LEU  38  23.133 -20.110 -13.863
  331   HD12  LEU  38          HD12      LEU  38  22.907 -20.310 -15.614
  332   HD13  LEU  38          HD13      LEU  38  23.361 -18.731 -14.970
  333   HD21  LEU  38          HD21      LEU  38  20.784 -21.066 -13.526
  334   HD22  LEU  38          HD22      LEU  38  19.421 -20.314 -14.389
  335   HD23  LEU  38          HD23      LEU  38  20.641 -21.221 -15.294
  336    H    ASP  39           H        ASP  39  19.539 -15.515 -14.074
  337    HA   ASP  39           HA       ASP  39  20.619 -14.309 -16.484
  338    HB2  ASP  39           HB2      ASP  39  19.856 -16.531 -17.354
  339    HB3  ASP  39           HB3      ASP  39  18.235 -16.183 -16.762
  340    H    ILE  40           H        ILE  40  18.973 -12.729 -17.446
  341    HA   ILE  40           HA       ILE  40  17.011 -11.699 -15.471
  342    HB   ILE  40           HB       ILE  40  19.375 -10.187 -16.667
  343   HG12  ILE  40          HG12      ILE  40  18.598 -10.597 -13.746
  344   HG13  ILE  40          HG13      ILE  40  19.836 -11.519 -14.591
  345   HG21  ILE  40          HG21      ILE  40  17.027  -9.055 -15.091
  346   HG22  ILE  40          HG22      ILE  40  18.492  -8.157 -15.571
  347   HG23  ILE  40          HG23      ILE  40  17.404  -8.735 -16.800
  348   HD11  ILE  40          HD11      ILE  40  21.149  -9.468 -14.956
  349   HD12  ILE  40          HD12      ILE  40  19.983  -8.556 -13.973
  350   HD13  ILE  40          HD13      ILE  40  20.930  -9.850 -13.245
  351    H    VAL  41           H        VAL  41  15.287 -10.625 -16.513
  352    HA   VAL  41           HA       VAL  41  15.417 -10.278 -19.456
  353    HB   VAL  41           HB       VAL  41  13.133 -11.644 -17.987
  354   HG11  VAL  41          HG11      VAL  41  12.381 -10.319 -19.936
  355   HG12  VAL  41          HG12      VAL  41  13.576 -11.141 -20.964
  356   HG13  VAL  41          HG13      VAL  41  12.226 -12.048 -20.247
  357   HG21  VAL  41          HG21      VAL  41  13.717 -13.666 -19.298
  358   HG22  VAL  41          HG22      VAL  41  15.191 -12.856 -19.872
  359   HG23  VAL  41          HG23      VAL  41  14.977 -13.235 -18.147
  360    H    ALA  42           H        ALA  42  15.456  -8.105 -19.435
  361    HA   ALA  42           HA       ALA  42  12.977  -6.730 -18.788
  362    HB1  ALA  42           HB1      ALA  42  14.176  -4.810 -17.784
  363    HB2  ALA  42           HB2      ALA  42  14.399  -6.265 -16.794
  364    HB3  ALA  42           HB3      ALA  42  15.705  -5.706 -17.875
  365    H    LEU  43           H        LEU  43  13.176  -4.496 -19.961
  366    HA   LEU  43           HA       LEU  43  14.934  -4.451 -22.304
  367    HG   LEU  43           HG       LEU  43  12.951  -6.866 -22.496
  368    HB2  LEU  43           HB2      LEU  43  11.891  -4.571 -22.525
  369    HB3  LEU  43           HB3      LEU  43  12.958  -4.127 -23.835
  370   HD11  LEU  43          HD11      LEU  43  10.828  -6.439 -23.636
  371   HD12  LEU  43          HD12      LEU  43  11.690  -5.960 -25.114
  372   HD13  LEU  43          HD13      LEU  43  11.783  -7.635 -24.516
  373   HD21  LEU  43          HD21      LEU  43  14.269  -5.881 -25.074
  374   HD22  LEU  43          HD22      LEU  43  15.114  -6.332 -23.575
  375   HD23  LEU  43          HD23      LEU  43  14.242  -7.561 -24.492
  376    H    LYS  44           H        LYS  44  14.554  -2.271 -23.438
  377    HA   LYS  44           HA       LYS  44  14.346  -0.257 -21.345
  378    HB2  LYS  44           HB2      LYS  44  14.865   0.032 -24.333
  379    HB3  LYS  44           HB3      LYS  44  14.954   1.341 -23.143
  380    HG2  LYS  44           HG2      LYS  44  16.657  -0.043 -21.861
  381    HG3  LYS  44           HG3      LYS  44  16.725  -1.142 -23.241
  382    HD2  LYS  44           HD2      LYS  44  17.397   1.825 -23.217
  383    HD3  LYS  44           HD3      LYS  44  18.569   0.512 -23.261
  384    HE2  LYS  44           HE2      LYS  44  16.504   1.100 -25.429
  385    HE3  LYS  44           HE3      LYS  44  18.172   1.674 -25.448
  386    HZ1  LYS  44           HZ1      LYS  44  18.916  -0.633 -25.508
  387    HZ2  LYS  44           HZ2      LYS  44  17.372  -1.179 -25.529
  388    HZ3  LYS  44           HZ3      LYS  44  17.950  -0.307 -26.772
  389    H    THR  45           H        THR  45  11.893  -1.749 -23.106
  390    HA   THR  45           HA       THR  45  10.183   0.524 -23.601
  391    HB   THR  45           HB       THR  45   8.480  -1.424 -23.656
  392    HG1  THR  45           HG1      THR  45   9.422  -3.484 -23.766
  393   HG21  THR  45          HG21      THR  45   9.529  -0.488 -25.700
  394   HG22  THR  45          HG22      THR  45  10.907  -1.594 -25.504
  395   HG23  THR  45          HG23      THR  45   9.283  -2.235 -25.834
  396    H    LEU  46           H        LEU  46   8.474   1.266 -22.236
  397    HA   LEU  46           HA       LEU  46   9.016   1.328 -19.474
  398    HG   LEU  46           HG       LEU  46   7.414   2.555 -18.120
  399    HB2  LEU  46           HB2      LEU  46   7.748   3.002 -20.721
  400    HB3  LEU  46           HB3      LEU  46   6.386   1.903 -20.907
  401   HD11  LEU  46          HD11      LEU  46   5.571   4.336 -19.771
  402   HD12  LEU  46          HD12      LEU  46   5.927   4.526 -18.039
  403   HD13  LEU  46          HD13      LEU  46   7.217   4.734 -19.227
  404   HD21  LEU  46          HD21      LEU  46   4.605   2.027 -19.221
  405   HD22  LEU  46          HD22      LEU  46   5.573   0.885 -18.270
  406   HD23  LEU  46          HD23      LEU  46   5.003   2.369 -17.525
  407    H    LYS  47           H        LYS  47   6.806  -0.794 -21.308
  408    HA   LYS  47           HA       LYS  47   5.673  -2.132 -19.085
  409    HB2  LYS  47           HB2      LYS  47   4.935  -3.814 -20.657
  410    HB3  LYS  47           HB3      LYS  47   4.712  -2.207 -21.338
  411    HG2  LYS  47           HG2      LYS  47   6.745  -2.498 -22.730
  412    HG3  LYS  47           HG3      LYS  47   7.013  -4.104 -22.024
  413    HD2  LYS  47           HD2      LYS  47   4.830  -4.862 -22.924
  414    HD3  LYS  47           HD3      LYS  47   4.567  -3.256 -23.638
  415    HE2  LYS  47           HE2      LYS  47   6.623  -3.529 -25.007
  416    HE3  LYS  47           HE3      LYS  47   6.893  -5.125 -24.291
  417    HZ1  LYS  47           HZ1      LYS  47   5.809  -5.291 -26.440
  418    HZ2  LYS  47           HZ2      LYS  47   4.804  -5.853 -25.290
  419    HZ3  LYS  47           HZ3      LYS  47   4.552  -4.378 -25.952
  420    H    MET  48           H        MET  48   8.958  -2.241 -19.940
  421    HA   MET  48           HA       MET  48   9.281  -4.627 -18.211
  422    HB2  MET  48           HB2      MET  48  10.681  -3.964 -20.805
  423    HB3  MET  48           HB3      MET  48  11.370  -5.087 -19.631
  424    HG2  MET  48           HG2      MET  48   8.571  -5.652 -20.513
  425    HG3  MET  48           HG3      MET  48   9.868  -5.888 -21.668
  426    HE1  MET  48           HE1      MET  48   9.778  -6.630 -17.664
  427    HE2  MET  48           HE2      MET  48   8.207  -7.084 -18.370
  428    HE3  MET  48           HE3      MET  48   9.317  -8.331 -17.761
  429    H    ARG  49           H        ARG  49   9.289  -1.585 -17.912
  430    HA   ARG  49           HA       ARG  49  11.782  -1.507 -16.268
  431    HE   ARG  49           HE       ARG  49  12.718   2.701 -17.774
  432    HB2  ARG  49           HB2      ARG  49  10.421   0.710 -17.833
  433    HB3  ARG  49           HB3      ARG  49  11.546   1.038 -16.511
  434    HG2  ARG  49           HG2      ARG  49  13.401   0.166 -17.626
  435    HG3  ARG  49           HG3      ARG  49  12.428  -0.812 -18.724
  436    HD2  ARG  49           HD2      ARG  49  13.462   1.138 -19.849
  437    HD3  ARG  49           HD3      ARG  49  11.690   1.067 -19.962
  438   HH11  ARG  49          HH11      ARG  49  12.087   2.763 -21.276
  439   HH12  ARG  49          HH12      ARG  49  11.615   4.429 -21.294
  440   HH21  ARG  49          HH21      ARG  49  11.890   4.783 -17.751
  441   HH22  ARG  49          HH22      ARG  49  11.594   5.664 -19.226
  442    H    GLY  50           H        GLY  50   8.253  -1.089 -16.425
  443    HA2  GLY  50           HA2      GLY  50   8.098  -0.306 -13.603
  444    HA3  GLY  50           HA3      GLY  50   6.768  -0.774 -14.676
  445    H    GLN  51           H        GLN  51   8.663  -3.227 -15.364
  446    HA   GLN  51           HA       GLN  51   8.420  -4.936 -13.035
  447    HB2  GLN  51           HB2      GLN  51   7.016  -6.592 -14.279
  448    HB3  GLN  51           HB3      GLN  51   6.148  -5.100 -13.910
  449    HG2  GLN  51           HG2      GLN  51   6.412  -4.319 -16.216
  450    HG3  GLN  51           HG3      GLN  51   7.420  -5.710 -16.607
  451   HE21  GLN  51          HE21      GLN  51   5.637  -5.608 -18.347
  452   HE22  GLN  51          HE22      GLN  51   4.237  -6.641 -18.060
  453    H    ALA  52           H        ALA  52   9.364  -7.156 -13.671
  454    HA   ALA  52           HA       ALA  52  11.002  -7.435 -16.020
  455    HB1  ALA  52           HB1      ALA  52  12.402  -6.837 -13.366
  456    HB2  ALA  52           HB2      ALA  52  13.193  -7.423 -14.844
  457    HB3  ALA  52           HB3      ALA  52  12.452  -5.819 -14.828
  458    H    PHE  53           H        PHE  53  12.435  -9.498 -15.663
  459    HA   PHE  53           HA       PHE  53  11.437 -11.229 -13.475
  460    HD1  PHE  53           HD1      PHE  53  10.048 -10.599 -17.224
  461    HD2  PHE  53           HD2      PHE  53   9.251 -13.575 -14.200
  462    HE1  PHE  53           HE1      PHE  53   7.622 -10.480 -17.744
  463    HE2  PHE  53           HE2      PHE  53   6.834 -13.480 -14.755
  464    HZ   PHE  53           HZ       PHE  53   6.013 -11.928 -16.516
  465    HB2  PHE  53           HB2      PHE  53  11.826 -12.162 -16.342
  466    HB3  PHE  53           HB3      PHE  53  11.494 -13.185 -14.969
  467    H    VAL  54           H        VAL  54  13.038 -12.849 -12.883
  468    HA   VAL  54           HA       VAL  54  15.654 -12.771 -14.127
  469    HB   VAL  54           HB       VAL  54  16.055 -10.861 -12.919
  470   HG11  VAL  54          HG11      VAL  54  14.081 -10.789 -11.399
  471   HG12  VAL  54          HG12      VAL  54  14.874 -12.002 -10.370
  472   HG13  VAL  54          HG13      VAL  54  15.587 -10.399 -10.577
  473   HG21  VAL  54          HG21      VAL  54  17.100 -13.053 -11.104
  474   HG22  VAL  54          HG22      VAL  54  17.867 -12.430 -12.569
  475   HG23  VAL  54          HG23      VAL  54  17.669 -11.377 -11.168
  476    H    ILE  55           H        ILE  55  16.939 -14.488 -13.489
  477    HA   ILE  55           HA       ILE  55  15.474 -16.802 -12.356
  478    HB   ILE  55           HB       ILE  55  17.354 -16.707 -14.757
  479   HG12  ILE  55          HG12      ILE  55  15.417 -17.543 -16.113
  480   HG13  ILE  55          HG13      ILE  55  14.338 -17.137 -14.791
  481   HG21  ILE  55          HG21      ILE  55  15.709 -19.014 -13.646
  482   HG22  ILE  55          HG22      ILE  55  16.735 -19.071 -15.094
  483   HG23  ILE  55          HG23      ILE  55  17.480 -18.837 -13.523
  484   HD11  ILE  55          HD11      ILE  55  14.531 -15.532 -16.804
  485   HD12  ILE  55          HD12      ILE  55  14.615 -14.788 -15.217
  486   HD13  ILE  55          HD13      ILE  55  16.108 -15.059 -16.154
  487    H    PHE  56           H        PHE  56  16.828 -18.125 -11.053
  488    HA   PHE  56           HA       PHE  56  19.532 -17.013 -10.405
  489    HD1  PHE  56           HD1      PHE  56  15.751 -16.375  -9.473
  490    HD2  PHE  56           HD2      PHE  56  19.507 -15.240  -7.683
  491    HE1  PHE  56           HE1      PHE  56  14.974 -14.036  -9.284
  492    HE2  PHE  56           HE2      PHE  56  18.681 -12.921  -7.413
  493    HZ   PHE  56           HZ       PHE  56  16.417 -12.309  -8.248
  494    HB2  PHE  56           HB2      PHE  56  17.417 -18.102  -8.530
  495    HB3  PHE  56           HB3      PHE  56  19.017 -17.562  -8.070
  496    H    LYS  57           H        LYS  57  20.774 -18.643  -8.951
  497    HA   LYS  57           HA       LYS  57  21.323 -20.899 -10.593
  498    HB2  LYS  57           HB2      LYS  57  22.101 -20.287  -7.709
  499    HB3  LYS  57           HB3      LYS  57  22.781 -21.621  -8.636
  500    HG2  LYS  57           HG2      LYS  57  22.983 -18.716  -9.515
  501    HG3  LYS  57           HG3      LYS  57  24.191 -19.530  -8.523
  502    HD2  LYS  57           HD2      LYS  57  24.664 -21.119 -10.314
  503    HD3  LYS  57           HD3      LYS  57  23.376 -20.424 -11.327
  504    HE2  LYS  57           HE2      LYS  57  24.499 -18.265 -11.398
  505    HE3  LYS  57           HE3      LYS  57  25.719 -18.811 -10.243
  506    HZ1  LYS  57           HZ1      LYS  57  26.521 -20.390 -11.885
  507    HZ2  LYS  57           HZ2      LYS  57  25.399 -19.919 -12.975
  508    HZ3  LYS  57           HZ3      LYS  57  26.566 -18.885 -12.500
  509    H    GLU  58           H        GLU  58  19.102 -20.668  -7.792
  510    HA   GLU  58           HA       GLU  58  18.193 -23.386  -8.328
  511    HB2  GLU  58           HB2      GLU  58  20.194 -22.893  -6.308
  512    HB3  GLU  58           HB3      GLU  58  18.688 -23.192  -5.455
  513    HG2  GLU  58           HG2      GLU  58  19.827 -25.024  -7.612
  514    HG3  GLU  58           HG3      GLU  58  20.138 -25.204  -5.891
  515    H    ILE  59           H        ILE  59  16.226 -23.879  -7.090
  516    HA   ILE  59           HA       ILE  59  14.445 -21.660  -7.141
  517    HB   ILE  59           HB       ILE  59  12.741 -23.200  -6.474
  518   HG12  ILE  59          HG12      ILE  59  14.941 -25.156  -5.679
  519   HG13  ILE  59          HG13      ILE  59  13.760 -24.399  -4.613
  520   HG21  ILE  59          HG21      ILE  59  12.826 -24.694  -8.282
  521   HG22  ILE  59          HG22      ILE  59  13.845 -23.340  -8.784
  522   HG23  ILE  59          HG23      ILE  59  14.596 -24.837  -8.221
  523   HD11  ILE  59          HD11      ILE  59  13.059 -26.646  -4.973
  524   HD12  ILE  59          HD12      ILE  59  11.933 -25.607  -5.869
  525   HD13  ILE  59          HD13      ILE  59  13.207 -26.503  -6.730
  526    H    GLY  60           H        GLY  60  16.123 -23.211  -4.391
  527    HA2  GLY  60           HA2      GLY  60  14.652 -21.793  -2.351
  528    HA3  GLY  60           HA3      GLY  60  16.225 -22.599  -2.172
  529    H    SER  61           H        SER  61  17.619 -21.149  -4.250
  530    HA   SER  61           HA       SER  61  18.458 -18.838  -2.795
  531    HG   SER  61           HG       SER  61  20.300 -20.716  -3.539
  532    HB2  SER  61           HB2      SER  61  19.064 -19.362  -5.715
  533    HB3  SER  61           HB3      SER  61  20.104 -18.675  -4.452
  534    H    ALA  62           H        ALA  62  16.504 -19.329  -5.780
  535    HA   ALA  62           HA       ALA  62  15.877 -16.634  -6.348
  536    HB1  ALA  62           HB1      ALA  62  15.335 -18.577  -7.833
  537    HB2  ALA  62           HB2      ALA  62  14.141 -19.128  -6.644
  538    HB3  ALA  62           HB3      ALA  62  13.900 -17.593  -7.490
  539    H    SER  63           H        SER  63  14.183 -19.003  -4.206
  540    HA   SER  63           HA       SER  63  12.128 -17.252  -3.373
  541    HG   SER  63           HG       SER  63  12.736 -20.295  -3.780
  542    HB2  SER  63           HB2      SER  63  13.381 -19.524  -1.776
  543    HB3  SER  63           HB3      SER  63  11.775 -18.814  -1.542
  544    H    ASN  64           H        ASN  64  15.376 -17.799  -2.000
  545    HA   ASN  64           HA       ASN  64  15.015 -16.157   0.295
  546    HB2  ASN  64           HB2      ASN  64  16.872 -17.819  -0.026
  547    HB3  ASN  64           HB3      ASN  64  17.629 -16.710  -1.174
  548   HD21  ASN  64          HD22      ASN  64  18.695 -14.822  -0.347
  549   HD22  ASN  64          HD21      ASN  64  18.872 -14.525   1.376
  550    H    ALA  65           H        ALA  65  16.327 -15.376  -2.954
  551    HA   ALA  65           HA       ALA  65  16.832 -12.632  -2.497
  552    HB1  ALA  65           HB1      ALA  65  15.936 -14.007  -5.084
  553    HB2  ALA  65           HB2      ALA  65  16.724 -12.425  -4.946
  554    HB3  ALA  65           HB3      ALA  65  17.616 -13.891  -4.501
  555    H    LEU  66           H        LEU  66  13.927 -14.271  -3.831
  556    HA   LEU  66           HA       LEU  66  12.296 -12.060  -4.264
  557    HG   LEU  66           HG       LEU  66  10.118 -12.910  -5.278
  558    HB2  LEU  66           HB2      LEU  66  11.969 -14.500  -4.865
  559    HB3  LEU  66           HB3      LEU  66  11.382 -14.784  -3.240
  560   HD11  LEU  66          HD11      LEU  66   9.543 -15.784  -4.489
  561   HD12  LEU  66          HD12      LEU  66   8.363 -14.770  -5.329
  562   HD13  LEU  66          HD13      LEU  66   9.915 -15.139  -6.090
  563   HD21  LEU  66          HD21      LEU  66   9.068 -13.867  -2.586
  564   HD22  LEU  66          HD22      LEU  66   9.417 -12.186  -3.055
  565   HD23  LEU  66          HD23      LEU  66   8.090 -13.042  -3.814
  566    H    ARG  67           H        ARG  67  12.388 -14.118  -1.280
  567    HA   ARG  67           HA       ARG  67  10.529 -12.556   0.164
  568    HE   ARG  67           HE       ARG  67  13.564 -13.286   3.918
  569    HB2  ARG  67           HB2      ARG  67  11.333 -14.885   0.767
  570    HB3  ARG  67           HB3      ARG  67  12.878 -14.193   1.214
  571    HG2  ARG  67           HG2      ARG  67  11.387 -12.669   2.855
  572    HG3  ARG  67           HG3      ARG  67  10.167 -13.895   2.569
  573    HD2  ARG  67           HD2      ARG  67  11.444 -14.408   4.601
  574    HD3  ARG  67           HD3      ARG  67  11.771 -15.636   3.374
  575   HH11  ARG  67          HH21      ARG  67  13.294 -16.814   3.591
  576   HH12  ARG  67          HH22      ARG  67  14.983 -17.042   3.303
  577   HH21  ARG  67          HH11      ARG  67  15.765 -13.602   3.262
  578   HH22  ARG  67          HH12      ARG  67  16.386 -15.209   3.149
  579    H    THR  68           H        THR  68  14.175 -12.417   0.189
  580    HA   THR  68           HA       THR  68  14.232 -10.469   2.257
  581    HB   THR  68           HB       THR  68  16.394 -11.031   0.184
  582    HG1  THR  68           HG1      THR  68  15.972 -12.945   1.009
  583   HG21  THR  68          HG21      THR  68  16.974  -9.123   1.603
  584   HG22  THR  68          HG22      THR  68  16.498 -10.019   3.065
  585   HG23  THR  68          HG23      THR  68  17.910 -10.533   2.120
  586    H    MET  69           H        MET  69  14.072 -10.133  -1.302
  587    HA   MET  69           HA       MET  69  14.398  -7.224  -1.113
  588    HB2  MET  69           HB2      MET  69  13.907  -9.059  -3.487
  589    HB3  MET  69           HB3      MET  69  14.241  -7.330  -3.571
  590    HG2  MET  69           HG2      MET  69  16.108  -9.501  -2.522
  591    HG3  MET  69           HG3      MET  69  16.286  -8.602  -4.009
  592    HE1  MET  69           HE1      MET  69  17.269  -5.007  -2.721
  593    HE2  MET  69           HE2      MET  69  17.170  -6.045  -4.153
  594    HE3  MET  69           HE3      MET  69  15.690  -5.609  -3.267
  595    H    GLN  70           H        GLN  70  11.732  -9.371  -0.807
  596    HA   GLN  70           HA       GLN  70   9.655  -7.921  -1.995
  597    HB2  GLN  70           HB2      GLN  70   9.583 -10.223  -0.876
  598    HB3  GLN  70           HB3      GLN  70   9.602  -9.396   0.680
  599    HG2  GLN  70           HG2      GLN  70   7.398 -10.055   0.249
  600    HG3  GLN  70           HG3      GLN  70   7.422  -8.301   0.035
  601   HE21  GLN  70          HE22      GLN  70   6.772 -11.377  -1.510
  602   HE22  GLN  70          HE21      GLN  70   6.428 -10.757  -3.113
  603    H    GLY  71           H        GLY  71   8.852  -5.907  -1.634
  604    HA2  GLY  71           HA2      GLY  71   8.288  -3.968  -0.601
  605    HA3  GLY  71           HA3      GLY  71   8.665  -4.700   0.961
  606    H    PHE  72           H        PHE  72  11.474  -4.998  -0.968
  607    HA   PHE  72           HA       PHE  72  12.861  -3.094   0.679
  608    HD1  PHE  72           HD1      PHE  72  15.541  -4.191   1.366
  609    HD2  PHE  72           HD2      PHE  72  15.245  -2.824  -2.712
  610    HE1  PHE  72           HE1      PHE  72  17.752  -3.082   1.574
  611    HE2  PHE  72           HE2      PHE  72  17.459  -1.707  -2.496
  612    HZ   PHE  72           HZ       PHE  72  18.713  -1.838  -0.355
  613    HB2  PHE  72           HB2      PHE  72  13.885  -5.152  -0.216
  614    HB3  PHE  72           HB3      PHE  72  13.734  -4.528  -1.859
  615    HA   PRO  73           HA       PRO  73  12.102   0.413  -2.086
  616    HB2  PRO  73           HB2      PRO  73  13.631   2.339  -0.954
  617    HB3  PRO  73           HB3      PRO  73  12.145   1.696  -0.193
  618    HG2  PRO  73           HG2      PRO  73  15.015   0.891   0.389
  619    HG3  PRO  73           HG3      PRO  73  13.725   1.310   1.557
  620    HD2  PRO  73           HD2      PRO  73  14.335  -1.278   0.868
  621    HD3  PRO  73           HD3      PRO  73  12.672  -0.768   1.285
  622    H    PHE  74           H        PHE  74  13.037  -0.750  -3.875
  623    HA   PHE  74           HA       PHE  74  15.855  -1.125  -4.229
  624    HD1  PHE  74           HD1      PHE  74  16.746  -3.082  -5.602
  625    HD2  PHE  74           HD2      PHE  74  14.020  -1.300  -8.428
  626    HE1  PHE  74           HE1      PHE  74  18.068  -4.027  -7.482
  627    HE2  PHE  74           HE2      PHE  74  15.348  -2.243 -10.299
  628    HZ   PHE  74           HZ       PHE  74  17.350  -3.634  -9.832
  629    HB2  PHE  74           HB2      PHE  74  14.154  -2.537  -5.185
  630    HB3  PHE  74           HB3      PHE  74  13.504  -1.216  -6.150
  631    H    TYR  75           H        TYR  75  13.576   1.235  -5.598
  632    HA   TYR  75           HA       TYR  75  15.655   3.271  -5.734
  633    HD1  TYR  75           HD1      TYR  75  17.280   4.358  -7.503
  634    HD2  TYR  75           HD2      TYR  75  15.802   0.564  -8.928
  635    HE1  TYR  75           HE1      TYR  75  19.576   3.717  -8.170
  636    HE2  TYR  75           HE2      TYR  75  18.087  -0.091  -9.591
  637    HH   TYR  75           HH       TYR  75  20.314   0.537  -9.681
  638    HB2  TYR  75           HB2      TYR  75  14.245   2.255  -8.225
  639    HB3  TYR  75           HB3      TYR  75  14.808   3.917  -8.096
  640    H    ASP  76           H        ASP  76  14.324   3.566  -3.892
  641    HA   ASP  76           HA       ASP  76  12.844   4.581  -2.608
  642    HB2  ASP  76           HB2      ASP  76  13.160   6.549  -3.988
  643    HB3  ASP  76           HB3      ASP  76  11.900   6.016  -5.103
  644    H    LYS  77           H        LYS  77  11.342   3.151  -5.525
  645    HA   LYS  77           HA       LYS  77   8.767   2.838  -4.271
  646    HB2  LYS  77           HB2      LYS  77  10.021   1.423  -6.670
  647    HB3  LYS  77           HB3      LYS  77   8.379   1.139  -6.092
  648    HG2  LYS  77           HG2      LYS  77   7.960   3.651  -6.343
  649    HG3  LYS  77           HG3      LYS  77   9.503   3.729  -7.219
  650    HD2  LYS  77           HD2      LYS  77   8.624   1.969  -8.793
  651    HD3  LYS  77           HD3      LYS  77   7.077   2.016  -7.962
  652    HE2  LYS  77           HE2      LYS  77   8.373   4.415  -9.345
  653    HE3  LYS  77           HE3      LYS  77   7.153   3.367 -10.079
  654    HZ1  LYS  77           HZ1      LYS  77   5.603   4.045  -8.339
  655    HZ2  LYS  77           HZ2      LYS  77   6.718   5.042  -7.672
  656    HZ3  LYS  77           HZ3      LYS  77   6.141   5.337  -9.165
  657    HA   PRO  78           HA       PRO  78  10.049  -0.832  -1.904
  658    HB2  PRO  78           HB2      PRO  78   7.609  -1.568  -0.901
  659    HB3  PRO  78           HB3      PRO  78   8.568  -0.210  -0.236
  660    HG2  PRO  78           HG2      PRO  78   6.241  -0.088  -2.168
  661    HG3  PRO  78           HG3      PRO  78   6.556   0.941  -0.737
  662    HD2  PRO  78           HD2      PRO  78   7.173   1.692  -3.311
  663    HD3  PRO  78           HD3      PRO  78   8.129   2.233  -1.898
  664    H    MET  79           H        MET  79  10.491  -2.612  -3.107
  665    HA   MET  79           HA       MET  79   9.228  -3.252  -5.535
  666    HB2  MET  79           HB2      MET  79  10.902  -4.930  -3.631
  667    HB3  MET  79           HB3      MET  79  10.458  -5.470  -5.257
  668    HG2  MET  79           HG2      MET  79  11.915  -2.863  -4.734
  669    HG3  MET  79           HG3      MET  79  12.745  -4.391  -4.979
  670    HE1  MET  79           HE1      MET  79  13.348  -4.508  -8.571
  671    HE2  MET  79           HE2      MET  79  13.985  -4.514  -6.915
  672    HE3  MET  79           HE3      MET  79  12.773  -5.718  -7.400
  673    H    GLN  80           H        GLN  80   7.915  -5.045  -6.150
  674    HA   GLN  80           HA       GLN  80   6.470  -6.527  -4.041
  675    HB2  GLN  80           HB2      GLN  80   5.208  -5.201  -6.488
  676    HB3  GLN  80           HB3      GLN  80   4.405  -6.387  -5.462
  677    HG2  GLN  80           HG2      GLN  80   5.406  -3.679  -4.455
  678    HG3  GLN  80           HG3      GLN  80   3.775  -3.989  -5.024
  679   HE21  GLN  80          HE22      GLN  80   6.117  -4.792  -2.426
  680   HE22  GLN  80          HE21      GLN  80   4.900  -5.345  -1.290
  681    H    ILE  81           H        ILE  81   6.795  -8.644  -4.496
  682    HA   ILE  81           HA       ILE  81   7.699  -9.382  -7.222
  683    HB   ILE  81           HB       ILE  81   9.090 -10.439  -4.751
  684   HG12  ILE  81          HG12      ILE  81   9.809  -7.823  -6.130
  685   HG13  ILE  81          HG13      ILE  81   9.378  -8.076  -4.426
  686   HG21  ILE  81          HG21      ILE  81  10.907 -10.864  -6.348
  687   HG22  ILE  81          HG22      ILE  81   9.423 -11.539  -6.987
  688   HG23  ILE  81          HG23      ILE  81  10.022 -10.007  -7.625
  689   HD11  ILE  81          HD11      ILE  81  11.719  -7.721  -4.538
  690   HD12  ILE  81          HD12      ILE  81  11.452  -9.431  -4.135
  691   HD13  ILE  81          HD13      ILE  81  11.935  -8.951  -5.784
  692    H    ALA  82           H        ALA  82   7.406 -11.566  -7.750
  693    HA   ALA  82           HA       ALA  82   6.009 -13.386  -5.900
  694    HB1  ALA  82           HB1      ALA  82   4.956 -12.645  -8.676
  695    HB2  ALA  82           HB2      ALA  82   4.304 -13.919  -7.623
  696    HB3  ALA  82           HB3      ALA  82   4.184 -12.221  -7.129
  697    H    TYR  83           H        TYR  83   5.923 -15.616  -7.038
  698    HA   TYR  83           HA       TYR  83   8.510 -16.176  -8.355
  699    HD1  TYR  83           HD1      TYR  83   5.759 -17.031  -5.366
  700    HD2  TYR  83           HD2      TYR  83   5.793 -19.490  -8.914
  701    HE1  TYR  83           HE1      TYR  83   3.437 -17.741  -4.886
  702    HE2  TYR  83           HE2      TYR  83   3.472 -20.215  -8.435
  703    HH   TYR  83           HH       TYR  83   1.614 -19.011  -5.605
  704    HB2  TYR  83           HB2      TYR  83   7.863 -18.524  -8.049
  705    HB3  TYR  83           HB3      TYR  83   7.891 -17.633  -6.543
  706    H    SER  84           H        SER  84   8.326 -17.758 -10.293
  707    HA   SER  84           HA       SER  84   6.045 -17.065 -12.086
  708    HG   SER  84           HG       SER  84   7.599 -14.882 -11.767
  709    HB2  SER  84           HB2      SER  84   8.848 -17.009 -13.147
  710    HB3  SER  84           HB3      SER  84   7.415 -16.153 -13.712
  711    H    LYS  85           H        LYS  85   6.856 -18.275 -14.381
  712    HA   LYS  85           HA       LYS  85   6.966 -21.155 -13.719
  713    HB2  LYS  85           HB2      LYS  85   6.933 -19.719 -16.414
  714    HB3  LYS  85           HB3      LYS  85   6.774 -21.451 -16.161
  715    HG2  LYS  85           HG2      LYS  85   4.743 -19.335 -15.316
  716    HG3  LYS  85           HG3      LYS  85   4.644 -20.412 -16.694
  717    HD2  LYS  85           HD2      LYS  85   3.267 -21.491 -15.234
  718    HD3  LYS  85           HD3      LYS  85   4.778 -22.357 -14.949
  719    HE2  LYS  85           HE2      LYS  85   5.167 -20.920 -12.920
  720    HE3  LYS  85           HE3      LYS  85   3.670 -20.053 -13.266
  721    HZ1  LYS  85           HZ1      LYS  85   2.461 -22.127 -12.923
  722    HZ2  LYS  85           HZ2      LYS  85   3.844 -22.940 -12.612
  723    HZ3  LYS  85           HZ3      LYS  85   3.337 -21.768 -11.600
  724    H    SER  86           H        SER  86   8.624 -22.506 -14.703
  725    HA   SER  86           HA       SER  86  11.210 -21.606 -14.045
  726    HG   SER  86           HG       SER  86  10.144 -25.053 -13.709
  727    HB2  SER  86           HB2      SER  86  10.436 -24.021 -15.729
  728    HB3  SER  86           HB3      SER  86  11.858 -23.844 -14.681
  729    H    ASP  87           H        ASP  87  13.108 -21.729 -15.420
  730    HA   ASP  87           HA       ASP  87  13.436 -20.157 -17.630
  731    HB2  ASP  87           HB2      ASP  87  15.303 -21.053 -16.449
  732    HB3  ASP  87           HB3      ASP  87  14.810 -22.715 -16.773
  733    H    SER  88           H        SER  88  12.561 -23.640 -17.670
  734    HA   SER  88           HA       SER  88  12.726 -24.113 -20.349
  735    HG   SER  88           HG       SER  88  12.324 -26.662 -17.784
  736    HB2  SER  88           HB2      SER  88  10.644 -25.297 -18.468
  737    HB3  SER  88           HB3      SER  88  11.401 -26.090 -19.861
  738    H    ASP  89           H        ASP  89  10.162 -22.297 -18.761
  739    HA   ASP  89           HA       ASP  89   8.397 -22.610 -21.157
  740    HB2  ASP  89           HB2      ASP  89   7.446 -23.428 -19.047
  741    HB3  ASP  89           HB3      ASP  89   7.756 -21.864 -18.289
  742    H    ILE  90           H        ILE  90   9.844 -20.218 -18.924
  743    HA   ILE  90           HA       ILE  90   8.503 -17.986 -20.087
  744    HB   ILE  90           HB       ILE  90  10.146 -16.572 -19.001
  745   HG12  ILE  90          HG12      ILE  90  11.680 -19.144 -18.502
  746   HG13  ILE  90          HG13      ILE  90  12.214 -17.732 -19.416
  747   HG21  ILE  90          HG21      ILE  90   9.328 -18.884 -17.197
  748   HG22  ILE  90          HG22      ILE  90   9.603 -17.198 -16.722
  749   HG23  ILE  90          HG23      ILE  90   8.237 -17.601 -17.763
  750   HD11  ILE  90          HD11      ILE  90  11.848 -17.942 -16.426
  751   HD12  ILE  90          HD12      ILE  90  13.345 -17.710 -17.334
  752   HD13  ILE  90          HD13      ILE  90  12.143 -16.401 -17.278
  753    H    VAL  91           H        VAL  91  11.556 -19.636 -21.071
  754    HA   VAL  91           HA       VAL  91  12.202 -17.597 -22.974
  755    HB   VAL  91           HB       VAL  91  13.091 -20.501 -22.910
  756   HG11  VAL  91          HG11      VAL  91  14.169 -18.058 -24.411
  757   HG12  VAL  91          HG12      VAL  91  15.035 -19.597 -24.246
  758   HG13  VAL  91          HG13      VAL  91  13.511 -19.544 -25.128
  759   HG21  VAL  91          HG21      VAL  91  14.430 -17.948 -21.874
  760   HG22  VAL  91          HG22      VAL  91  13.733 -19.217 -20.855
  761   HG23  VAL  91          HG23      VAL  91  15.134 -19.579 -21.856
  762    H    ALA  92           H        ALA  92  10.140 -20.532 -23.153
  763    HA   ALA  92           HA       ALA  92   9.590 -20.318 -25.958
  764    HB1  ALA  92           HB1      ALA  92   7.824 -21.458 -23.754
  765    HB2  ALA  92           HB2      ALA  92   7.647 -21.717 -25.496
  766    HB3  ALA  92           HB3      ALA  92   9.071 -22.346 -24.655
  767    H    LYS  93           H        LYS  93   8.124 -18.847 -23.046
  768    HA   LYS  93           HA       LYS  93   5.941 -17.618 -24.334
  769    HB2  LYS  93           HB2      LYS  93   6.708 -17.860 -21.746
  770    HB3  LYS  93           HB3      LYS  93   7.315 -16.243 -22.014
  771    HG2  LYS  93           HG2      LYS  93   5.126 -16.065 -21.077
  772    HG3  LYS  93           HG3      LYS  93   5.039 -15.511 -22.741
  773    HD2  LYS  93           HD2      LYS  93   3.084 -16.916 -22.035
  774    HD3  LYS  93           HD3      LYS  93   3.917 -17.534 -23.449
  775    HE2  LYS  93           HE2      LYS  93   3.362 -19.399 -22.013
  776    HE3  LYS  93           HE3      LYS  93   5.111 -19.201 -22.047
  777    HZ1  LYS  93           HZ1      LYS  93   4.574 -19.542 -19.835
  778    HZ2  LYS  93           HZ2      LYS  93   4.805 -17.935 -19.889
  779    HZ3  LYS  93           HZ3      LYS  93   3.274 -18.523 -19.843
  780    H    ILE  94           H        ILE  94   9.229 -16.272 -23.670
  781    HA   ILE  94           HA       ILE  94   8.465 -13.798 -25.012
  782    HB   ILE  94           HB       ILE  94  10.569 -12.918 -24.316
  783   HG12  ILE  94          HG12      ILE  94  11.324 -15.747 -23.531
  784   HG13  ILE  94          HG13      ILE  94  12.086 -14.744 -24.754
  785   HG21  ILE  94          HG21      ILE  94  10.232 -12.980 -21.940
  786   HG22  ILE  94          HG22      ILE  94   8.651 -13.132 -22.703
  787   HG23  ILE  94          HG23      ILE  94   9.443 -14.566 -22.016
  788   HD11  ILE  94          HD11      ILE  94  12.184 -14.312 -21.745
  789   HD12  ILE  94          HD12      ILE  94  13.507 -14.785 -22.821
  790   HD13  ILE  94          HD13      ILE  94  12.813 -13.155 -22.949
  791    H    LYS  95           H        LYS  95  10.077 -16.726 -26.071
  792    HA   LYS  95           HA       LYS  95  10.715 -15.396 -28.665
  793    HB2  LYS  95           HB2      LYS  95  12.737 -15.348 -27.210
  794    HB3  LYS  95           HB3      LYS  95  12.630 -17.095 -27.005
  795    HG2  LYS  95           HG2      LYS  95  12.847 -17.271 -29.580
  796    HG3  LYS  95           HG3      LYS  95  13.170 -15.537 -29.568
  797    HD2  LYS  95           HD2      LYS  95  15.272 -16.655 -29.651
  798    HD3  LYS  95           HD3      LYS  95  15.126 -15.996 -28.013
  799    HE2  LYS  95           HE2      LYS  95  14.440 -18.234 -27.170
  800    HE3  LYS  95           HE3      LYS  95  14.469 -18.877 -28.815
  801    HZ1  LYS  95           HZ1      LYS  95  16.830 -17.886 -27.331
  802    HZ2  LYS  95           HZ2      LYS  95  16.469 -19.456 -27.643
  803    HZ3  LYS  95           HZ3      LYS  95  16.857 -18.448 -28.868
  804    H    GLY  96           H        GLY  96  11.122 -18.636 -27.076
  805    HA2  GLY  96           HA2      GLY  96   9.380 -20.272 -28.383
  806    HA3  GLY  96           HA3      GLY  96  10.608 -19.943 -29.621
  807    H    THR  97           H        THR  97  10.791 -22.409 -29.197
  808    HA   THR  97           HA       THR  97  11.914 -24.185 -28.472
  809    HB   THR  97           HB       THR  97  14.123 -22.359 -27.476
  810    HG1  THR  97           HG1      THR  97  14.776 -22.180 -29.571
  811   HG21  THR  97          HG21      THR  97  14.380 -24.823 -27.139
  812   HG22  THR  97          HG22      THR  97  14.109 -25.084 -28.872
  813   HG23  THR  97          HG23      THR  97  15.543 -24.194 -28.316
  814    H    PHE  98           H        PHE  98  10.278 -24.706 -26.976
  815    HA   PHE  98           HA       PHE  98  10.348 -24.064 -24.184
  816    HD1  PHE  98           HD1      PHE  98   7.713 -24.373 -23.013
  817    HD2  PHE  98           HD2      PHE  98   9.687 -28.134 -23.789
  818    HE1  PHE  98           HE1      PHE  98   7.089 -25.172 -20.751
  819    HE2  PHE  98           HE2      PHE  98   9.070 -28.920 -21.519
  820    HZ   PHE  98           HZ       PHE  98   7.773 -27.442 -19.993
  821    HB2  PHE  98           HB2      PHE  98   8.366 -25.053 -25.325
  822    HB3  PHE  98           HB3      PHE  98   9.277 -26.537 -25.610
  823    H    LYS  99           H        LYS  99  11.378 -25.060 -22.579
  824    HA   LYS  99           HA       LYS  99  13.240 -25.614 -21.638
  825    HB2  LYS  99           HB2      LYS  99  12.043 -27.901 -21.921
  826    HB3  LYS  99           HB3      LYS  99  13.397 -28.297 -22.960
  827    HG2  LYS  99           HG2      LYS  99  13.310 -27.758 -19.995
  828    HG3  LYS  99           HG3      LYS  99  14.009 -29.103 -20.858
  829    HD2  LYS  99           HD2      LYS  99  15.821 -28.000 -19.908
  830    HD3  LYS  99           HD3      LYS  99  15.891 -27.506 -21.597
  831    HE2  LYS  99           HE2      LYS  99  14.871 -25.315 -20.994
  832    HE3  LYS  99           HE3      LYS  99  14.636 -25.864 -19.331
  833    HZ1  LYS  99           HZ1      LYS  99  16.500 -24.438 -19.516
  834    HZ2  LYS  99           HZ2      LYS  99  17.104 -25.938 -19.186
  835    HZ3  LYS  99           HZ3      LYS  99  17.176 -25.312 -20.725
  836    H    GLU 100           H        GLU 100  14.040 -23.846 -23.152
  837    HA   GLU 100           HA       GLU 100  15.708 -24.257 -25.320
  838    HB2  GLU 100           HB2      GLU 100  14.946 -22.063 -24.553
  839    HB3  GLU 100           HB3      GLU 100  15.882 -22.216 -23.066
  840    HG2  GLU 100           HG2      GLU 100  17.009 -20.713 -24.598
  841    HG3  GLU 100           HG3      GLU 100  17.983 -22.143 -24.357
  842    H    ARG 101           H        ARG 101  17.918 -24.524 -25.600
  843    HA   ARG 101           HA       ARG 101  19.635 -25.450 -23.377
  844    HE   ARG 101           HE       ARG 101  20.377 -29.493 -24.910
  845    HB2  ARG 101           HB2      ARG 101  18.738 -27.174 -25.726
  846    HB3  ARG 101           HB3      ARG 101  20.284 -27.411 -24.914
  847    HG2  ARG 101           HG2      ARG 101  19.233 -27.924 -22.806
  848    HG3  ARG 101           HG3      ARG 101  17.641 -27.492 -23.438
  849    HD2  ARG 101           HD2      ARG 101  17.883 -29.898 -23.350
  850    HD3  ARG 101           HD3      ARG 101  17.695 -29.351 -25.022
  851   HH11  ARG 101          HH21      ARG 101  17.885 -31.853 -23.965
  852   HH12  ARG 101          HH22      ARG 101  18.892 -33.223 -24.243
  853   HH21  ARG 101          HH11      ARG 101  21.742 -31.288 -25.169
  854   HH22  ARG 101          HH12      ARG 101  21.120 -32.898 -24.979
  855    HA   PRO 102           HA       PRO 102  21.093 -22.453 -26.473
  856    HB2  PRO 102           HB2      PRO 102  23.061 -21.784 -24.278
  857    HB3  PRO 102           HB3      PRO 102  22.141 -20.674 -25.337
  858    HG2  PRO 102           HG2      PRO 102  21.346 -21.114 -22.780
  859    HG3  PRO 102           HG3      PRO 102  20.137 -21.035 -24.100
  860    HD2  PRO 102           HD2      PRO 102  21.330 -23.490 -22.787
  861    HD3  PRO 102           HD3      PRO 102  19.627 -23.151 -23.199
  862    H    LYS 103           H        LYS 103  23.197 -24.550 -24.523
  863    HA   LYS 103           HA       LYS 103  24.866 -25.247 -26.838
  864    HB2  LYS 103           HB2      LYS 103  26.973 -24.658 -25.666
  865    HB3  LYS 103           HB3      LYS 103  26.003 -23.263 -26.103
  866    HG2  LYS 103           HG2      LYS 103  25.280 -22.925 -23.807
  867    HG3  LYS 103           HG3      LYS 103  25.968 -24.465 -23.301
  868    HD2  LYS 103           HD2      LYS 103  27.422 -22.662 -22.577
  869    HD3  LYS 103           HD3      LYS 103  28.233 -23.675 -23.760
  870    HE2  LYS 103           HE2      LYS 103  28.806 -21.415 -24.253
  871    HE3  LYS 103           HE3      LYS 103  27.741 -21.976 -25.539
  872    HZ1  LYS 103           HZ1      LYS 103  26.918 -20.273 -23.251
  873    HZ2  LYS 103           HZ2      LYS 103  27.171 -19.752 -24.769
  874    HZ3  LYS 103           HZ3      LYS 103  25.927 -20.755 -24.463
  875    H    LYS 104           H        LYS 104  23.000 -26.857 -25.506
  876    HA   LYS 104           HA       LYS 104  24.675 -28.775 -23.983
  877    HB2  LYS 104           HB2      LYS 104  23.462 -27.380 -22.337
  878    HB3  LYS 104           HB3      LYS 104  21.930 -27.722 -23.156
  879    HG2  LYS 104           HG2      LYS 104  22.165 -30.130 -22.623
  880    HG3  LYS 104           HG3      LYS 104  23.735 -29.807 -21.855
  881    HD2  LYS 104           HD2      LYS 104  22.599 -28.356 -20.173
  882    HD3  LYS 104           HD3      LYS 104  21.056 -28.629 -20.987
  883    HE2  LYS 104           HE2      LYS 104  21.110 -30.062 -19.076
  884    HE3  LYS 104           HE3      LYS 104  21.240 -31.074 -20.516
  885    HZ1  LYS 104           HZ1      LYS 104  23.631 -31.243 -20.089
  886    HZ2  LYS 104           HZ2      LYS 104  23.507 -30.277 -18.773
  887    HZ3  LYS 104           HZ3      LYS 104  22.794 -31.738 -18.785
  Start of MODEL    4
    1    HA   MET   1           HA       MET   1   0.922 -17.173   1.757
    2    H1   MET   1           H1       MET   1   0.622 -19.299   0.815
    3    H2   MET   1           H2       MET   1   1.062 -20.064   2.184
    4    H3   MET   1           H3       MET   1  -0.325 -19.177   2.147
    5    HB2  MET   1           HB2      MET   1   1.781 -16.813   3.972
    6    HB3  MET   1           HB3      MET   1   0.294 -17.743   4.076
    7    HG2  MET   1           HG2      MET   1   1.629 -19.817   4.440
    8    HG3  MET   1           HG3      MET   1   3.118 -18.869   4.330
    9    HE1  MET   1           HE1      MET   1   2.459 -20.846   6.723
   10    HE2  MET   1           HE2      MET   1   3.953 -19.886   6.605
   11    HE3  MET   1           HE3      MET   1   3.002 -19.871   8.106
   12    H    GLU   2           H        GLU   2   3.022 -16.092   1.882
   13    HA   GLU   2           HA       GLU   2   5.034 -15.677   1.041
   14    HB2  GLU   2           HB2      GLU   2   5.791 -18.477   1.959
   15    HB3  GLU   2           HB3      GLU   2   6.900 -17.212   1.445
   16    HG2  GLU   2           HG2      GLU   2   6.137 -15.751   3.288
   17    HG3  GLU   2           HG3      GLU   2   5.047 -17.026   3.848
   18    H    MET   3           H        MET   3   6.871 -16.683  -0.531
   19    HA   MET   3           HA       MET   3   5.538 -17.241  -3.050
   20    HB2  MET   3           HB2      MET   3   7.714 -17.105  -4.003
   21    HB3  MET   3           HB3      MET   3   7.587 -15.813  -2.826
   22    HG2  MET   3           HG2      MET   3   9.111 -18.438  -2.558
   23    HG3  MET   3           HG3      MET   3   9.796 -16.840  -2.759
   24    HE1  MET   3           HE1      MET   3   9.119 -15.207   0.785
   25    HE2  MET   3           HE2      MET   3   9.839 -14.955  -0.823
   26    HE3  MET   3           HE3      MET   3   8.075 -15.082  -0.642
   27    H    LEU   4           H        LEU   4   6.432 -19.058  -4.451
   28    HA   LEU   4           HA       LEU   4   6.758 -21.583  -2.902
   29    HG   LEU   4           HG       LEU   4   3.861 -20.521  -4.203
   30    HB2  LEU   4           HB2      LEU   4   5.621 -21.237  -5.701
   31    HB3  LEU   4           HB3      LEU   4   5.841 -22.748  -4.827
   32   HD11  LEU   4          HD11      LEU   4   3.447 -23.446  -4.959
   33   HD12  LEU   4          HD12      LEU   4   2.183 -22.219  -4.708
   34   HD13  LEU   4          HD13      LEU   4   3.304 -22.068  -6.069
   35   HD21  LEU   4          HD21      LEU   4   4.589 -21.360  -2.045
   36   HD22  LEU   4          HD22      LEU   4   2.990 -22.011  -2.396
   37   HD23  LEU   4          HD23      LEU   4   4.424 -23.047  -2.591
   38    HA   PRO   5           HA       PRO   5  10.884 -21.454  -4.763
   39    HB2  PRO   5           HB2      PRO   5  10.442 -24.444  -4.580
   40    HB3  PRO   5           HB3      PRO   5  11.939 -23.498  -4.269
   41    HG2  PRO   5           HG2      PRO   5  10.438 -24.225  -2.175
   42    HG3  PRO   5           HG3      PRO   5  11.022 -22.527  -2.298
   43    HD2  PRO   5           HD2      PRO   5   8.279 -23.623  -3.011
   44    HD3  PRO   5           HD3      PRO   5   8.706 -22.150  -2.082
   45    H    ASN   6           H        ASN   6  11.314 -21.039  -6.757
   46    HA   ASN   6           HA       ASN   6  10.483 -22.594  -9.088
   47    HB2  ASN   6           HB2      ASN   6   8.528 -21.065  -8.481
   48    HB3  ASN   6           HB3      ASN   6   9.627 -19.694  -8.591
   49   HD21  ASN   6          HD22      ASN   6   7.271 -21.288 -10.278
   50   HD22  ASN   6          HD21      ASN   6   7.676 -20.634 -11.842
   51    H    GLN   7           H        GLN   7  12.091 -22.014 -10.784
   52    HA   GLN   7           HA       GLN   7  14.484 -20.922  -9.616
   53    HB2  GLN   7           HB2      GLN   7  14.340 -22.799 -11.297
   54    HB3  GLN   7           HB3      GLN   7  14.019 -21.584 -12.552
   55    HG2  GLN   7           HG2      GLN   7  16.190 -20.534 -12.133
   56    HG3  GLN   7           HG3      GLN   7  16.455 -21.543 -10.710
   57   HE21  GLN   7          HE22      GLN   7  18.494 -21.573 -12.201
   58   HE22  GLN   7          HE21      GLN   7  18.626 -22.994 -13.234
   59    H    THR   8           H        THR   8  11.818 -19.331 -11.096
   60    HA   THR   8           HA       THR   8  13.473 -16.931 -11.660
   61    HB   THR   8           HB       THR   8  11.046 -17.844 -13.241
   62    HG1  THR   8           HG1      THR   8  12.206 -19.199 -14.173
   63   HG21  THR   8          HG21      THR   8  13.288 -15.885 -13.892
   64   HG22  THR   8          HG22      THR   8  11.965 -16.327 -14.981
   65   HG23  THR   8          HG23      THR   8  11.629 -15.438 -13.492
   66    H    ILE   9           H        ILE   9  12.454 -14.942 -11.267
   67    HA   ILE   9           HA       ILE   9   9.880 -15.025  -9.808
   68    HB   ILE   9           HB       ILE   9  10.560 -13.674  -8.058
   69   HG12  ILE   9          HG12      ILE   9  13.006 -12.970  -9.660
   70   HG13  ILE   9          HG13      ILE   9  11.718 -11.921  -9.105
   71   HG21  ILE   9          HG21      ILE   9  12.343 -14.887  -6.922
   72   HG22  ILE   9          HG22      ILE   9  11.365 -16.016  -7.861
   73   HG23  ILE   9          HG23      ILE   9  12.966 -15.501  -8.447
   74   HD11  ILE   9          HD11      ILE   9  12.466 -12.283  -6.732
   75   HD12  ILE   9          HD12      ILE   9  13.862 -13.171  -7.346
   76   HD13  ILE   9          HD13      ILE   9  13.654 -11.467  -7.772
   77    H    TYR  10           H        TYR  10   8.882 -12.882  -9.753
   78    HA   TYR  10           HA       TYR  10   9.281 -11.395 -12.298
   79    HD1  TYR  10           HD2      TYR  10   8.102 -10.607 -14.029
   80    HD2  TYR  10           HD1      TYR  10   4.627 -11.711 -11.717
   81    HE1  TYR  10           HE2      TYR  10   6.694  -9.211 -15.490
   82    HE2  TYR  10           HE1      TYR  10   3.205 -10.339 -13.199
   83    HH   TYR  10           HH       TYR  10   3.132  -8.988 -15.105
   84    HB2  TYR  10           HB2      TYR  10   7.487 -13.093 -12.469
   85    HB3  TYR  10           HB3      TYR  10   6.735 -12.465 -11.013
   86    H    ILE  11           H        ILE  11   9.631  -9.345 -11.828
   87    HA   ILE  11           HA       ILE  11   9.004  -8.246  -9.126
   88    HB   ILE  11           HB       ILE  11  11.021  -7.518 -11.304
   89   HG12  ILE  11          HG12      ILE  11  11.528  -8.434  -8.432
   90   HG13  ILE  11          HG13      ILE  11  11.450  -9.562  -9.778
   91   HG21  ILE  11          HG21      ILE  11  10.592  -6.144  -8.608
   92   HG22  ILE  11          HG22      ILE  11  11.869  -5.777  -9.792
   93   HG23  ILE  11          HG23      ILE  11  10.189  -5.456 -10.197
   94   HD11  ILE  11          HD11      ILE  11  13.737  -9.149  -9.317
   95   HD12  ILE  11          HD12      ILE  11  13.356  -8.386 -10.872
   96   HD13  ILE  11          HD13      ILE  11  13.525  -7.387  -9.404
   97    H    ASN  12           H        ASN  12   7.426  -6.678  -9.052
   98    HA   ASN  12           HA       ASN  12   6.246  -5.845 -11.666
   99    HB2  ASN  12           HB2      ASN  12   5.254  -7.884 -10.275
  100    HB3  ASN  12           HB3      ASN  12   4.547  -6.608  -9.281
  101   HD21  ASN  12          HD22      ASN  12   4.987  -7.668 -12.686
  102   HD22  ASN  12          HD21      ASN  12   3.544  -6.909 -13.318
  103    H    ASN  13           H        ASN  13   7.652  -4.387  -9.095
  104    HA   ASN  13           HA       ASN  13   6.106  -1.986  -9.661
  105    HB2  ASN  13           HB2      ASN  13   5.145  -2.919  -7.504
  106    HB3  ASN  13           HB3      ASN  13   6.731  -2.655  -6.761
  107   HD21  ASN  13          HD22      ASN  13   6.482  -0.810  -5.445
  108   HD22  ASN  13          HD21      ASN  13   5.619   0.632  -5.936
  109    H    LEU  14           H        LEU  14   8.352  -2.656 -10.829
  110    HA   LEU  14           HA       LEU  14  10.810  -1.891  -9.501
  111    HG   LEU  14           HG       LEU  14  12.531  -3.155 -10.765
  112    HB2  LEU  14           HB2      LEU  14  10.199  -3.431 -11.600
  113    HB3  LEU  14           HB3      LEU  14  10.340  -1.930 -12.497
  114   HD11  LEU  14          HD11      LEU  14  11.886  -4.598 -12.649
  115   HD12  LEU  14          HD12      LEU  14  12.050  -3.237 -13.782
  116   HD13  LEU  14          HD13      LEU  14  13.469  -3.886 -12.948
  117   HD21  LEU  14          HD21      LEU  14  12.593  -0.852 -12.773
  118   HD22  LEU  14          HD22      LEU  14  13.006  -0.787 -11.042
  119   HD23  LEU  14          HD23      LEU  14  14.040  -1.672 -12.156
  120    H    ASN  15           H        ASN  15  11.741   0.230  -9.518
  121    HA   ASN  15           HA       ASN  15  10.058   2.477 -10.282
  122    HB2  ASN  15           HB2      ASN  15  11.738   2.606  -8.427
  123    HB3  ASN  15           HB3      ASN  15  13.035   2.517  -9.625
  124   HD21  ASN  15          HD22      ASN  15  12.496   4.754  -7.780
  125   HD22  ASN  15          HD21      ASN  15  12.058   6.133  -8.771
  126    H    GLU  16           H        GLU  16   9.613   2.725 -12.404
  127    HA   GLU  16           HA       GLU  16  11.143   1.601 -14.438
  128    HB2  GLU  16           HB2      GLU  16   9.613   2.682 -15.989
  129    HB3  GLU  16           HB3      GLU  16   8.785   1.966 -14.627
  130    HG2  GLU  16           HG2      GLU  16   7.658   3.973 -15.013
  131    HG3  GLU  16           HG3      GLU  16   8.615   4.267 -13.576
  132    H    LYS  17           H        LYS  17  11.976   4.564 -12.825
  133    HA   LYS  17           HA       LYS  17  13.168   5.863 -15.055
  134    HB2  LYS  17           HB2      LYS  17  14.291   7.245 -13.565
  135    HB3  LYS  17           HB3      LYS  17  12.768   6.854 -12.772
  136    HG2  LYS  17           HG2      LYS  17  14.039   5.107 -11.405
  137    HG3  LYS  17           HG3      LYS  17  15.531   5.695 -12.156
  138    HD2  LYS  17           HD2      LYS  17  15.087   7.970 -11.316
  139    HD3  LYS  17           HD3      LYS  17  13.600   7.397 -10.532
  140    HE2  LYS  17           HE2      LYS  17  14.909   5.858  -9.115
  141    HE3  LYS  17           HE3      LYS  17  16.402   6.329  -9.941
  142    HZ1  LYS  17           HZ1      LYS  17  14.727   8.155  -8.308
  143    HZ2  LYS  17           HZ2      LYS  17  16.151   7.508  -7.846
  144    HZ3  LYS  17           HZ3      LYS  17  16.107   8.574  -9.074
  145    H    ILE  18           H        ILE  18  14.112   2.991 -13.336
  146    HA   ILE  18           HA       ILE  18  16.941   3.110 -13.905
  147    HB   ILE  18           HB       ILE  18  15.097   0.838 -13.049
  148   HG12  ILE  18          HG12      ILE  18  15.028   2.593 -11.370
  149   HG13  ILE  18          HG13      ILE  18  15.956   1.244 -10.761
  150   HG21  ILE  18          HG21      ILE  18  18.130   0.992 -12.904
  151   HG22  ILE  18          HG22      ILE  18  17.114  -0.294 -12.221
  152   HG23  ILE  18          HG23      ILE  18  17.169  -0.050 -13.970
  153   HD11  ILE  18          HD11      ILE  18  18.062   2.482 -11.144
  154   HD12  ILE  18          HD12      ILE  18  17.157   3.832 -11.873
  155   HD13  ILE  18          HD13      ILE  18  16.933   3.444 -10.174
  156    H    LYS  19           H        LYS  19  17.859   2.803 -15.803
  157    HA   LYS  19           HA       LYS  19  16.427   1.945 -18.164
  158    HB2  LYS  19           HB2      LYS  19  18.417   3.566 -17.901
  159    HB3  LYS  19           HB3      LYS  19  19.446   2.133 -17.772
  160    HG2  LYS  19           HG2      LYS  19  18.726   1.435 -20.050
  161    HG3  LYS  19           HG3      LYS  19  17.681   2.858 -20.154
  162    HD2  LYS  19           HD2      LYS  19  20.728   2.874 -19.874
  163    HD3  LYS  19           HD3      LYS  19  19.821   3.123 -21.360
  164    HE2  LYS  19           HE2      LYS  19  19.814   5.305 -20.972
  165    HE3  LYS  19           HE3      LYS  19  18.686   5.021 -19.651
  166    HZ1  LYS  19           HZ1      LYS  19  21.641   5.130 -19.402
  167    HZ2  LYS  19           HZ2      LYS  19  20.605   6.293 -18.937
  168    HZ3  LYS  19           HZ3      LYS  19  20.625   4.869 -18.138
  169    H    LYS  20           H        LYS  20  17.191   0.015 -19.532
  170    HA   LYS  20           HA       LYS  20  16.987  -2.426 -18.159
  171    HB2  LYS  20           HB2      LYS  20  16.597  -2.042 -20.621
  172    HB3  LYS  20           HB3      LYS  20  18.354  -1.938 -20.843
  173    HG2  LYS  20           HG2      LYS  20  18.540  -4.298 -19.920
  174    HG3  LYS  20           HG3      LYS  20  16.785  -4.338 -19.786
  175    HD2  LYS  20           HD2      LYS  20  17.429  -5.503 -21.789
  176    HD3  LYS  20           HD3      LYS  20  16.638  -3.998 -22.279
  177    HE2  LYS  20           HE2      LYS  20  18.853  -2.956 -22.685
  178    HE3  LYS  20           HE3      LYS  20  19.657  -4.428 -22.126
  179    HZ1  LYS  20           HZ1      LYS  20  17.922  -4.242 -24.525
  180    HZ2  LYS  20           HZ2      LYS  20  19.546  -4.345 -24.531
  181    HZ3  LYS  20           HZ3      LYS  20  18.661  -5.605 -24.004
  182    H    GLU  21           H        GLU  21  19.980  -0.794 -19.336
  183    HA   GLU  21           HA       GLU  21  21.758  -2.841 -18.459
  184    HB2  GLU  21           HB2      GLU  21  22.358  -1.198 -20.122
  185    HB3  GLU  21           HB3      GLU  21  22.132   0.137 -18.983
  186    HG2  GLU  21           HG2      GLU  21  24.020  -0.574 -17.643
  187    HG3  GLU  21           HG3      GLU  21  24.186  -2.074 -18.573
  188    H    GLU  22           H        GLU  22  20.419   0.027 -16.823
  189    HA   GLU  22           HA       GLU  22  22.095  -0.149 -14.488
  190    HB2  GLU  22           HB2      GLU  22  19.424   1.185 -15.015
  191    HB3  GLU  22           HB3      GLU  22  20.370   1.423 -13.540
  192    HG2  GLU  22           HG2      GLU  22  22.081   2.593 -14.640
  193    HG3  GLU  22           HG3      GLU  22  21.658   1.967 -16.227
  194    H    LEU  23           H        LEU  23  18.878  -1.413 -15.381
  195    HA   LEU  23           HA       LEU  23  18.177  -2.625 -12.905
  196    HG   LEU  23           HG       LEU  23  15.398  -4.241 -15.038
  197    HB2  LEU  23           HB2      LEU  23  16.549  -2.273 -14.609
  198    HB3  LEU  23           HB3      LEU  23  17.462  -3.116 -15.823
  199   HD11  LEU  23          HD11      LEU  23  16.201  -6.461 -15.117
  200   HD12  LEU  23          HD12      LEU  23  17.216  -5.480 -16.187
  201   HD13  LEU  23          HD13      LEU  23  17.820  -5.989 -14.602
  202   HD21  LEU  23          HD21      LEU  23  16.978  -4.892 -12.517
  203   HD22  LEU  23          HD22      LEU  23  15.685  -3.693 -12.599
  204   HD23  LEU  23          HD23      LEU  23  15.334  -5.408 -12.919
  205    H    LYS  24           H        LYS  24  19.903  -3.965 -15.789
  206    HA   LYS  24           HA       LYS  24  20.452  -6.506 -14.664
  207    HB2  LYS  24           HB2      LYS  24  21.925  -4.824 -16.732
  208    HB3  LYS  24           HB3      LYS  24  22.450  -6.450 -16.281
  209    HG2  LYS  24           HG2      LYS  24  20.422  -7.452 -17.067
  210    HG3  LYS  24           HG3      LYS  24  19.614  -5.894 -17.241
  211    HD2  LYS  24           HD2      LYS  24  20.278  -6.831 -19.411
  212    HD3  LYS  24           HD3      LYS  24  21.047  -5.268 -19.099
  213    HE2  LYS  24           HE2      LYS  24  23.155  -6.361 -18.495
  214    HE3  LYS  24           HE3      LYS  24  22.404  -7.960 -18.616
  215    HZ1  LYS  24           HZ1      LYS  24  23.678  -7.431 -20.589
  216    HZ2  LYS  24           HZ2      LYS  24  22.108  -7.569 -20.993
  217    HZ3  LYS  24           HZ3      LYS  24  22.804  -6.090 -20.883
  218    H    LYS  25           H        LYS  25  22.465  -3.526 -14.602
  219    HA   LYS  25           HA       LYS  25  24.579  -4.570 -13.060
  220    HB2  LYS  25           HB2      LYS  25  24.606  -2.417 -14.288
  221    HB3  LYS  25           HB3      LYS  25  23.461  -1.728 -13.127
  222    HG2  LYS  25           HG2      LYS  25  25.109  -1.993 -11.309
  223    HG3  LYS  25           HG3      LYS  25  26.243  -2.771 -12.436
  224    HD2  LYS  25           HD2      LYS  25  26.324  -0.685 -13.783
  225    HD3  LYS  25           HD3      LYS  25  25.186   0.086 -12.653
  226    HE2  LYS  25           HE2      LYS  25  26.808  -0.252 -10.797
  227    HE3  LYS  25           HE3      LYS  25  27.936  -1.023 -11.918
  228    HZ1  LYS  25           HZ1      LYS  25  28.489   1.296 -11.565
  229    HZ2  LYS  25           HZ2      LYS  25  28.072   1.081 -13.124
  230    HZ3  LYS  25           HZ3      LYS  25  27.029   1.794 -12.084
  231    H    SER  26           H        SER  26  21.537  -2.972 -11.939
  232    HA   SER  26           HA       SER  26  22.248  -2.997  -9.202
  233    HG   SER  26           HG       SER  26  20.632  -1.302 -11.251
  234    HB2  SER  26           HB2      SER  26  19.481  -3.009 -10.460
  235    HB3  SER  26           HB3      SER  26  19.881  -2.517  -8.798
  236    H    LEU  27           H        LEU  27  20.370  -5.373 -11.120
  237    HA   LEU  27           HA       LEU  27  19.781  -7.112  -8.923
  238    HG   LEU  27           HG       LEU  27  18.071  -6.310 -11.160
  239    HB2  LEU  27           HB2      LEU  27  20.129  -7.597 -11.896
  240    HB3  LEU  27           HB3      LEU  27  19.662  -8.886 -10.788
  241   HD11  LEU  27          HD11      LEU  27  18.110  -7.675 -13.201
  242   HD12  LEU  27          HD12      LEU  27  17.571  -9.092 -12.282
  243   HD13  LEU  27          HD13      LEU  27  16.501  -7.683 -12.470
  244   HD21  LEU  27          HD21      LEU  27  17.568  -7.274  -9.032
  245   HD22  LEU  27          HD22      LEU  27  16.238  -7.681 -10.107
  246   HD23  LEU  27          HD23      LEU  27  17.460  -8.915  -9.718
  247    H    TYR  28           H        TYR  28  22.526  -7.077 -11.255
  248    HA   TYR  28           HA       TYR  28  23.918  -9.259 -10.080
  249    HD1  TYR  28           HD1      TYR  28  25.319 -10.599 -12.022
  250    HD2  TYR  28           HD2      TYR  28  27.345  -6.917 -11.029
  251    HE1  TYR  28           HE1      TYR  28  27.492 -11.793 -12.039
  252    HE2  TYR  28           HE2      TYR  28  29.518  -8.099 -11.044
  253    HH   TYR  28           HH       TYR  28  30.610 -10.135 -11.352
  254    HB2  TYR  28           HB2      TYR  28  24.269  -8.300 -12.363
  255    HB3  TYR  28           HB3      TYR  28  25.016  -6.886 -11.637
  256    H    ALA  29           H        ALA  29  23.739  -5.846  -9.115
  257    HA   ALA  29           HA       ALA  29  26.089  -5.978  -7.433
  258    HB1  ALA  29           HB1      ALA  29  25.420  -3.714  -6.755
  259    HB2  ALA  29           HB2      ALA  29  25.374  -3.888  -8.518
  260    HB3  ALA  29           HB3      ALA  29  23.862  -3.903  -7.577
  261    H    ILE  30           H        ILE  30  22.539  -6.190  -6.792
  262    HA   ILE  30           HA       ILE  30  23.225  -6.736  -3.929
  263    HB   ILE  30           HB       ILE  30  21.080  -5.561  -3.376
  264   HG12  ILE  30          HG12      ILE  30  21.481  -4.063  -5.984
  265   HG13  ILE  30          HG13      ILE  30  20.262  -5.331  -5.783
  266   HG21  ILE  30          HG21      ILE  30  22.262  -3.419  -3.149
  267   HG22  ILE  30          HG22      ILE  30  23.392  -4.744  -2.889
  268   HG23  ILE  30          HG23      ILE  30  23.397  -3.874  -4.436
  269   HD11  ILE  30          HD11      ILE  30  20.399  -2.725  -4.212
  270   HD12  ILE  30          HD12      ILE  30  19.257  -3.143  -5.490
  271   HD13  ILE  30          HD13      ILE  30  19.213  -4.026  -3.950
  272    H    PHE  31           H        PHE  31  20.681  -7.438  -6.418
  273    HA   PHE  31           HA       PHE  31  19.301  -9.283  -4.688
  274    HD1  PHE  31           HD1      PHE  31  18.333  -6.706  -6.441
  275    HD2  PHE  31           HD2      PHE  31  16.515 -10.607  -6.760
  276    HE1  PHE  31           HE1      PHE  31  16.084  -5.682  -6.274
  277    HE2  PHE  31           HE2      PHE  31  14.274  -9.575  -6.553
  278    HZ   PHE  31           HZ       PHE  31  14.051  -7.117  -6.321
  279    HB2  PHE  31           HB2      PHE  31  19.427  -8.950  -7.683
  280    HB3  PHE  31           HB3      PHE  31  18.796 -10.430  -7.018
  281    H    SER  32           H        SER  32  22.144  -9.620  -6.807
  282    HA   SER  32           HA       SER  32  22.673 -12.320  -6.769
  283    HG   SER  32           HG       SER  32  25.068  -9.122  -7.062
  284    HB2  SER  32           HB2      SER  32  25.079 -11.562  -6.831
  285    HB3  SER  32           HB3      SER  32  24.006 -10.738  -7.983
  286    H    GLN  33           H        GLN  33  23.102 -10.018  -4.089
  287    HA   GLN  33           HA       GLN  33  24.810 -11.719  -2.527
  288    HB2  GLN  33           HB2      GLN  33  23.147  -9.349  -1.581
  289    HB3  GLN  33           HB3      GLN  33  24.580 -10.023  -0.811
  290    HG2  GLN  33           HG2      GLN  33  24.474  -8.546  -3.477
  291    HG3  GLN  33           HG3      GLN  33  25.148  -7.952  -1.970
  292   HE21  GLN  33          HE22      GLN  33  25.848  -9.613  -4.903
  293   HE22  GLN  33          HE21      GLN  33  27.463 -10.150  -4.485
  294    H    PHE  34           H        PHE  34  21.426 -11.810  -3.100
  295    HA   PHE  34           HA       PHE  34  21.041 -13.530  -0.708
  296    HD1  PHE  34           HD1      PHE  34  20.619 -11.992   1.335
  297    HD2  PHE  34           HD2      PHE  34  19.331  -9.488  -1.939
  298    HE1  PHE  34           HE1      PHE  34  21.400  -9.978   2.558
  299    HE2  PHE  34           HE2      PHE  34  20.104  -7.485  -0.710
  300    HZ   PHE  34           HZ       PHE  34  21.142  -7.720   1.541
  301    HB2  PHE  34           HB2      PHE  34  18.925 -11.798  -2.046
  302    HB3  PHE  34           HB3      PHE  34  18.759 -12.678  -0.532
  303    H    GLY  35           H        GLY  35  20.803 -13.297  -4.154
  304    HA2  GLY  35           HA2      GLY  35  20.484 -16.171  -4.191
  305    HA3  GLY  35           HA3      GLY  35  19.161 -15.285  -4.991
  306    H    GLN  36           H        GLN  36  22.326 -16.477  -5.360
  307    HA   GLN  36           HA       GLN  36  23.429 -14.653  -7.174
  308    HB2  GLN  36           HB2      GLN  36  24.744 -16.459  -6.286
  309    HB3  GLN  36           HB3      GLN  36  23.737 -17.667  -7.083
  310    HG2  GLN  36           HG2      GLN  36  25.919 -17.278  -8.243
  311    HG3  GLN  36           HG3      GLN  36  24.531 -16.996  -9.274
  312   HE21  GLN  36          HE22      GLN  36  24.728 -15.190 -10.566
  313   HE22  GLN  36          HE21      GLN  36  25.642 -13.753 -10.148
  314    H    ILE  37           H        ILE  37  22.902 -13.965  -9.033
  315    HA   ILE  37           HA       ILE  37  20.606 -14.580 -10.558
  316    HB   ILE  37           HB       ILE  37  23.193 -13.210 -11.422
  317   HG12  ILE  37          HG12      ILE  37  22.635 -12.125  -9.351
  318   HG13  ILE  37          HG13      ILE  37  22.312 -11.050 -10.690
  319   HG21  ILE  37          HG21      ILE  37  20.345 -12.777 -12.391
  320   HG22  ILE  37          HG22      ILE  37  21.786 -11.843 -12.876
  321   HG23  ILE  37          HG23      ILE  37  21.676 -13.533 -13.292
  322   HD11  ILE  37          HD11      ILE  37  20.579 -10.931  -8.934
  323   HD12  ILE  37          HD12      ILE  37  19.909 -11.431 -10.491
  324   HD13  ILE  37          HD13      ILE  37  20.171 -12.634  -9.202
  325    H    LEU  38           H        LEU  38  20.380 -15.699 -12.511
  326    HA   LEU  38           HA       LEU  38  22.742 -17.068 -13.668
  327    HG   LEU  38           HG       LEU  38  20.706 -18.797 -15.564
  328    HB2  LEU  38           HB2      LEU  38  21.344 -18.731 -12.574
  329    HB3  LEU  38           HB3      LEU  38  19.896 -18.085 -13.354
  330   HD11  LEU  38          HD11      LEU  38  22.702 -20.286 -15.741
  331   HD12  LEU  38          HD12      LEU  38  23.144 -18.642 -15.283
  332   HD13  LEU  38          HD13      LEU  38  23.112 -19.916 -14.052
  333   HD21  LEU  38          HD21      LEU  38  20.821 -21.001 -13.464
  334   HD22  LEU  38          HD22      LEU  38  19.355 -20.322 -14.201
  335   HD23  LEU  38          HD23      LEU  38  20.503 -21.221 -15.201
  336    H    ASP  39           H        ASP  39  19.527 -15.425 -14.203
  337    HA   ASP  39           HA       ASP  39  20.656 -14.187 -16.568
  338    HB2  ASP  39           HB2      ASP  39  19.864 -16.358 -17.536
  339    HB3  ASP  39           HB3      ASP  39  18.241 -16.008 -16.956
  340    H    ILE  40           H        ILE  40  18.990 -12.560 -17.499
  341    HA   ILE  40           HA       ILE  40  17.043 -11.573 -15.492
  342    HB   ILE  40           HB       ILE  40  19.477 -10.079 -16.567
  343   HG12  ILE  40          HG12      ILE  40  18.615 -10.583 -13.687
  344   HG13  ILE  40          HG13      ILE  40  19.842 -11.521 -14.522
  345   HG21  ILE  40          HG21      ILE  40  17.119  -8.957 -14.997
  346   HG22  ILE  40          HG22      ILE  40  18.612  -8.074 -15.407
  347   HG23  ILE  40          HG23      ILE  40  17.543  -8.572 -16.682
  348   HD11  ILE  40          HD11      ILE  40  20.831  -9.870 -13.007
  349   HD12  ILE  40          HD12      ILE  40  21.333  -9.632 -14.693
  350   HD13  ILE  40          HD13      ILE  40  20.128  -8.563 -13.941
  351    H    VAL  41           H        VAL  41  15.339 -10.439 -16.526
  352    HA   VAL  41           HA       VAL  41  15.611  -9.814 -19.407
  353    HB   VAL  41           HB       VAL  41  13.259 -11.372 -18.269
  354   HG11  VAL  41          HG11      VAL  41  13.957 -10.586 -21.131
  355   HG12  VAL  41          HG12      VAL  41  12.572 -11.580 -20.631
  356   HG13  VAL  41          HG13      VAL  41  12.653  -9.886 -20.148
  357   HG21  VAL  41          HG21      VAL  41  13.988 -13.259 -19.694
  358   HG22  VAL  41          HG22      VAL  41  15.494 -12.392 -20.060
  359   HG23  VAL  41          HG23      VAL  41  15.136 -12.926 -18.402
  360    H    ALA  42           H        ALA  42  15.301  -7.690 -19.444
  361    HA   ALA  42           HA       ALA  42  12.767  -6.548 -18.612
  362    HB1  ALA  42           HB1      ALA  42  15.440  -5.302 -17.797
  363    HB2  ALA  42           HB2      ALA  42  13.837  -4.560 -17.609
  364    HB3  ALA  42           HB3      ALA  42  14.250  -6.008 -16.675
  365    H    LEU  43           H        LEU  43  12.708  -4.284 -19.781
  366    HA   LEU  43           HA       LEU  43  14.399  -4.198 -22.227
  367    HG   LEU  43           HG       LEU  43  12.157  -6.447 -22.125
  368    HB2  LEU  43           HB2      LEU  43  11.363  -4.021 -22.246
  369    HB3  LEU  43           HB3      LEU  43  12.407  -3.809 -23.630
  370   HD11  LEU  43          HD11      LEU  43  10.829  -5.563 -24.718
  371   HD12  LEU  43          HD12      LEU  43  10.760  -7.186 -23.996
  372   HD13  LEU  43          HD13      LEU  43  10.013  -5.820 -23.161
  373   HD21  LEU  43          HD21      LEU  43  13.219  -7.400 -24.139
  374   HD22  LEU  43          HD22      LEU  43  13.365  -5.779 -24.854
  375   HD23  LEU  43          HD23      LEU  43  14.284  -6.205 -23.396
  376    H    LYS  44           H        LYS  44  13.994  -2.025 -23.369
  377    HA   LYS  44           HA       LYS  44  13.745   0.149 -21.411
  378    HB2  LYS  44           HB2      LYS  44  14.027   0.153 -24.453
  379    HB3  LYS  44           HB3      LYS  44  13.934   1.608 -23.453
  380    HG2  LYS  44           HG2      LYS  44  15.977   0.948 -22.229
  381    HG3  LYS  44           HG3      LYS  44  16.072  -0.551 -23.159
  382    HD2  LYS  44           HD2      LYS  44  17.652   1.020 -24.061
  383    HD3  LYS  44           HD3      LYS  44  16.371   0.748 -25.250
  384    HE2  LYS  44           HE2      LYS  44  15.286   2.885 -24.557
  385    HE3  LYS  44           HE3      LYS  44  16.556   3.140 -23.354
  386    HZ1  LYS  44           HZ1      LYS  44  18.159   3.261 -25.179
  387    HZ2  LYS  44           HZ2      LYS  44  16.980   3.024 -26.286
  388    HZ3  LYS  44           HZ3      LYS  44  16.990   4.376 -25.379
  389    H    THR  45           H        THR  45  11.595  -1.582 -23.611
  390    HA   THR  45           HA       THR  45   9.453   0.125 -23.901
  391    HB   THR  45           HB       THR  45   9.249  -2.828 -23.189
  392    HG1  THR  45           HG1      THR  45   9.863  -3.270 -25.330
  393   HG21  THR  45          HG21      THR  45   7.852  -1.220 -25.372
  394   HG22  THR  45          HG22      THR  45   7.507  -2.895 -24.861
  395   HG23  THR  45          HG23      THR  45   7.157  -1.545 -23.772
  396    H    LEU  46           H        LEU  46   8.080   1.103 -22.411
  397    HA   LEU  46           HA       LEU  46   8.638   1.178 -19.721
  398    HG   LEU  46           HG       LEU  46   5.639   1.475 -18.632
  399    HB2  LEU  46           HB2      LEU  46   7.264   2.861 -20.830
  400    HB3  LEU  46           HB3      LEU  46   5.982   1.682 -21.112
  401   HD11  LEU  46          HD11      LEU  46   7.632   3.779 -18.463
  402   HD12  LEU  46          HD12      LEU  46   6.612   3.186 -17.138
  403   HD13  LEU  46          HD13      LEU  46   7.866   2.142 -17.805
  404   HD21  LEU  46          HD21      LEU  46   4.253   2.950 -19.967
  405   HD22  LEU  46          HD22      LEU  46   4.521   3.624 -18.353
  406   HD23  LEU  46          HD23      LEU  46   5.411   4.287 -19.748
  407    H    LYS  47           H        LYS  47   6.098  -0.854 -21.248
  408    HA   LYS  47           HA       LYS  47   5.069  -1.879 -18.851
  409    HB2  LYS  47           HB2      LYS  47   3.934  -3.531 -20.158
  410    HB3  LYS  47           HB3      LYS  47   3.936  -2.011 -21.050
  411    HG2  LYS  47           HG2      LYS  47   5.900  -2.890 -22.396
  412    HG3  LYS  47           HG3      LYS  47   5.716  -4.443 -21.584
  413    HD2  LYS  47           HD2      LYS  47   3.595  -3.077 -23.297
  414    HD3  LYS  47           HD3      LYS  47   4.665  -4.383 -23.825
  415    HE2  LYS  47           HE2      LYS  47   3.711  -5.875 -22.068
  416    HE3  LYS  47           HE3      LYS  47   2.608  -4.581 -21.577
  417    HZ1  LYS  47           HZ1      LYS  47   2.639  -5.868 -24.245
  418    HZ2  LYS  47           HZ2      LYS  47   1.535  -6.128 -23.076
  419    HZ3  LYS  47           HZ3      LYS  47   1.623  -4.668 -23.793
  420    H    MET  48           H        MET  48   8.148  -2.622 -20.241
  421    HA   MET  48           HA       MET  48   8.435  -4.835 -18.304
  422    HB2  MET  48           HB2      MET  48   8.310  -5.390 -20.953
  423    HB3  MET  48           HB3      MET  48  10.021  -4.970 -20.831
  424    HG2  MET  48           HG2      MET  48   9.879  -7.307 -20.431
  425    HG3  MET  48           HG3      MET  48  10.142  -6.558 -18.846
  426    HE1  MET  48           HE1      MET  48   9.162  -8.051 -17.050
  427    HE2  MET  48           HE2      MET  48   7.979  -9.311 -17.456
  428    HE3  MET  48           HE3      MET  48   9.505  -9.200 -18.369
  429    H    ARG  49           H        ARG  49   8.947  -1.908 -18.301
  430    HA   ARG  49           HA       ARG  49  11.745  -2.047 -17.289
  431    HE   ARG  49           HE       ARG  49  11.858   1.841 -20.431
  432    HB2  ARG  49           HB2      ARG  49  11.435  -0.504 -19.197
  433    HB3  ARG  49           HB3      ARG  49  10.176   0.356 -18.312
  434    HG2  ARG  49           HG2      ARG  49  11.691   1.248 -16.755
  435    HG3  ARG  49           HG3      ARG  49  12.949   0.069 -17.126
  436    HD2  ARG  49           HD2      ARG  49  13.343   2.443 -17.996
  437    HD3  ARG  49           HD3      ARG  49  13.562   1.111 -19.123
  438   HH11  ARG  49          HH21      ARG  49  11.633   3.624 -17.383
  439   HH12  ARG  49          HH22      ARG  49  10.265   4.566 -17.844
  440   HH21  ARG  49          HH11      ARG  49  10.242   3.197 -21.178
  441   HH22  ARG  49          HH12      ARG  49   9.571   4.434 -20.168
  442    H    GLY  50           H        GLY  50   8.325  -1.187 -16.675
  443    HA2  GLY  50           HA2      GLY  50   8.837  -0.642 -13.828
  444    HA3  GLY  50           HA3      GLY  50   7.277  -0.706 -14.662
  445    H    GLN  51           H        GLN  51   8.710  -3.461 -15.750
  446    HA   GLN  51           HA       GLN  51   8.091  -5.210 -13.476
  447    HB2  GLN  51           HB2      GLN  51   7.020  -5.681 -16.298
  448    HB3  GLN  51           HB3      GLN  51   6.717  -6.662 -14.866
  449    HG2  GLN  51           HG2      GLN  51   5.436  -4.750 -13.860
  450    HG3  GLN  51           HG3      GLN  51   5.677  -3.833 -15.351
  451   HE21  GLN  51          HE21      GLN  51   5.017  -5.239 -17.451
  452   HE22  GLN  51          HE22      GLN  51   3.452  -6.021 -17.304
  453    H    ALA  52           H        ALA  52   9.385  -7.221 -13.709
  454    HA   ALA  52           HA       ALA  52  11.080  -7.571 -16.079
  455    HB1  ALA  52           HB1      ALA  52  12.325  -6.925 -13.365
  456    HB2  ALA  52           HB2      ALA  52  13.200  -7.459 -14.813
  457    HB3  ALA  52           HB3      ALA  52  12.383  -5.889 -14.816
  458    H    PHE  53           H        PHE  53  12.491  -9.561 -15.764
  459    HA   PHE  53           HA       PHE  53  11.483 -11.415 -13.667
  460    HD1  PHE  53           HD1      PHE  53   9.610 -13.384 -14.159
  461    HD2  PHE  53           HD2      PHE  53  10.443 -11.477 -17.934
  462    HE1  PHE  53           HE1      PHE  53   7.228 -13.673 -14.837
  463    HE2  PHE  53           HE2      PHE  53   8.066 -11.753 -18.598
  464    HZ   PHE  53           HZ       PHE  53   6.458 -12.852 -17.051
  465    HB2  PHE  53           HB2      PHE  53  12.236 -12.164 -16.518
  466    HB3  PHE  53           HB3      PHE  53  11.934 -13.293 -15.225
  467    H    VAL  54           H        VAL  54  13.146 -12.826 -12.880
  468    HA   VAL  54           HA       VAL  54  15.776 -12.696 -14.078
  469    HB   VAL  54           HB       VAL  54  16.187 -10.847 -12.810
  470   HG11  VAL  54          HG11      VAL  54  14.195 -10.756 -11.347
  471   HG12  VAL  54          HG12      VAL  54  14.883 -12.055 -10.351
  472   HG13  VAL  54          HG13      VAL  54  15.678 -10.478 -10.438
  473   HG21  VAL  54          HG21      VAL  54  17.152 -13.106 -11.021
  474   HG22  VAL  54          HG22      VAL  54  17.954 -12.495 -12.475
  475   HG23  VAL  54          HG23      VAL  54  17.769 -11.445 -11.064
  476    H    ILE  55           H        ILE  55  16.921 -14.455 -13.705
  477    HA   ILE  55           HA       ILE  55  15.468 -16.833 -12.673
  478    HB   ILE  55           HB       ILE  55  17.518 -16.545 -14.921
  479   HG12  ILE  55          HG12      ILE  55  15.810 -17.252 -16.541
  480   HG13  ILE  55          HG13      ILE  55  14.558 -17.119 -15.332
  481   HG21  ILE  55          HG21      ILE  55  17.601 -18.730 -13.814
  482   HG22  ILE  55          HG22      ILE  55  15.852 -18.944 -14.072
  483   HG23  ILE  55          HG23      ILE  55  16.975 -18.897 -15.448
  484   HD11  ILE  55          HD11      ILE  55  14.691 -15.257 -17.028
  485   HD12  ILE  55          HD12      ILE  55  14.727 -14.686 -15.368
  486   HD13  ILE  55          HD13      ILE  55  16.233 -14.764 -16.315
  487    H    PHE  56           H        PHE  56  16.751 -18.134 -11.307
  488    HA   PHE  56           HA       PHE  56  19.380 -16.987 -10.453
  489    HD1  PHE  56           HD1      PHE  56  15.518 -16.463  -9.660
  490    HD2  PHE  56           HD2      PHE  56  19.257 -15.519  -7.753
  491    HE1  PHE  56           HE1      PHE  56  14.779 -14.122  -9.331
  492    HE2  PHE  56           HE2      PHE  56  18.484 -13.189  -7.369
  493    HZ   PHE  56           HZ       PHE  56  16.236 -12.490  -8.171
  494    HB2  PHE  56           HB2      PHE  56  17.131 -18.273  -8.864
  495    HB3  PHE  56           HB3      PHE  56  18.683 -17.805  -8.193
  496    H    LYS  57           H        LYS  57  20.747 -18.574  -9.227
  497    HA   LYS  57           HA       LYS  57  21.332 -20.869 -10.785
  498    HB2  LYS  57           HB2      LYS  57  22.009 -20.101  -7.916
  499    HB3  LYS  57           HB3      LYS  57  22.627 -21.577  -8.625
  500    HG2  LYS  57           HG2      LYS  57  23.104 -18.980 -10.112
  501    HG3  LYS  57           HG3      LYS  57  24.010 -19.317  -8.640
  502    HD2  LYS  57           HD2      LYS  57  25.303 -19.978 -10.560
  503    HD3  LYS  57           HD3      LYS  57  24.924 -21.366  -9.535
  504    HE2  LYS  57           HE2      LYS  57  23.130 -22.050 -11.099
  505    HE3  LYS  57           HE3      LYS  57  23.461 -20.627 -12.103
  506    HZ1  LYS  57           HZ1      LYS  57  25.372 -22.839 -11.591
  507    HZ2  LYS  57           HZ2      LYS  57  24.541 -22.619 -12.972
  508    HZ3  LYS  57           HZ3      LYS  57  25.677 -21.537 -12.530
  509    H    GLU  58           H        GLU  58  19.111 -20.558  -7.998
  510    HA   GLU  58           HA       GLU  58  18.289 -23.356  -8.317
  511    HB2  GLU  58           HB2      GLU  58  20.367 -23.265  -6.824
  512    HB3  GLU  58           HB3      GLU  58  19.428 -22.294  -5.688
  513    HG2  GLU  58           HG2      GLU  58  17.829 -24.164  -5.415
  514    HG3  GLU  58           HG3      GLU  58  18.719 -25.104  -6.620
  515    H    ILE  59           H        ILE  59  16.279 -23.750  -7.244
  516    HA   ILE  59           HA       ILE  59  14.461 -21.602  -7.155
  517    HB   ILE  59           HB       ILE  59  12.870 -23.233  -6.351
  518   HG12  ILE  59          HG12      ILE  59  15.236 -25.096  -5.839
  519   HG13  ILE  59          HG13      ILE  59  14.154 -24.410  -4.626
  520   HG21  ILE  59          HG21      ILE  59  13.742 -23.249  -8.752
  521   HG22  ILE  59          HG22      ILE  59  14.666 -24.693  -8.319
  522   HG23  ILE  59          HG23      ILE  59  12.894 -24.696  -8.211
  523   HD11  ILE  59          HD11      ILE  59  13.514 -26.684  -4.971
  524   HD12  ILE  59          HD12      ILE  59  12.246 -25.673  -5.693
  525   HD13  ILE  59          HD13      ILE  59  13.444 -26.487  -6.728
  526    H    GLY  60           H        GLY  60  16.425 -22.994  -4.528
  527    HA2  GLY  60           HA2      GLY  60  15.007 -21.683  -2.381
  528    HA3  GLY  60           HA3      GLY  60  16.646 -22.362  -2.326
  529    H    SER  61           H        SER  61  17.895 -20.868  -4.379
  530    HA   SER  61           HA       SER  61  18.553 -18.425  -3.084
  531    HG   SER  61           HG       SER  61  21.016 -20.004  -5.117
  532    HB2  SER  61           HB2      SER  61  18.987 -19.242  -5.993
  533    HB3  SER  61           HB3      SER  61  19.896 -18.028  -5.088
  534    H    ALA  62           H        ALA  62  16.436 -19.178  -5.901
  535    HA   ALA  62           HA       ALA  62  15.612 -16.543  -6.509
  536    HB1  ALA  62           HB1      ALA  62  13.637 -17.660  -7.503
  537    HB2  ALA  62           HB2      ALA  62  15.111 -18.564  -7.900
  538    HB3  ALA  62           HB3      ALA  62  14.023 -19.146  -6.624
  539    H    SER  63           H        SER  63  14.117 -18.957  -4.269
  540    HA   SER  63           HA       SER  63  12.011 -17.294  -3.404
  541    HG   SER  63           HG       SER  63  12.766 -20.337  -3.763
  542    HB2  SER  63           HB2      SER  63  13.417 -19.484  -1.816
  543    HB3  SER  63           HB3      SER  63  11.783 -18.854  -1.542
  544    H    ASN  64           H        ASN  64  15.306 -17.683  -2.089
  545    HA   ASN  64           HA       ASN  64  14.824 -16.024   0.192
  546    HB2  ASN  64           HB2      ASN  64  16.651 -17.718   0.047
  547    HB3  ASN  64           HB3      ASN  64  17.484 -16.690  -1.121
  548   HD21  ASN  64          HD22      ASN  64  18.984 -15.304  -0.210
  549   HD22  ASN  64          HD21      ASN  64  18.951 -14.736   1.455
  550    H    ALA  65           H        ALA  65  16.231 -15.306  -3.031
  551    HA   ALA  65           HA       ALA  65  16.786 -12.556  -2.615
  552    HB1  ALA  65           HB1      ALA  65  16.581 -12.384  -5.073
  553    HB2  ALA  65           HB2      ALA  65  17.518 -13.817  -4.626
  554    HB3  ALA  65           HB3      ALA  65  15.827 -13.985  -5.152
  555    H    LEU  66           H        LEU  66  13.832 -14.200  -3.858
  556    HA   LEU  66           HA       LEU  66  12.233 -11.939  -4.211
  557    HG   LEU  66           HG       LEU  66  10.058 -12.640  -5.185
  558    HB2  LEU  66           HB2      LEU  66  11.832 -14.353  -4.876
  559    HB3  LEU  66           HB3      LEU  66  11.253 -14.666  -3.252
  560   HD11  LEU  66          HD11      LEU  66   8.225 -14.422  -5.349
  561   HD12  LEU  66          HD12      LEU  66   9.759 -14.786  -6.153
  562   HD13  LEU  66          HD13      LEU  66   9.389 -15.534  -4.602
  563   HD21  LEU  66          HD21      LEU  66   9.378 -12.020  -2.938
  564   HD22  LEU  66          HD22      LEU  66   8.022 -12.795  -3.728
  565   HD23  LEU  66          HD23      LEU  66   8.979 -13.709  -2.547
  566    H    ARG  67           H        ARG  67  12.391 -14.062  -1.261
  567    HA   ARG  67           HA       ARG  67  10.562 -12.515   0.202
  568    HE   ARG  67           HE       ARG  67   9.827 -16.172   3.502
  569    HB2  ARG  67           HB2      ARG  67  11.472 -14.850   0.783
  570    HB3  ARG  67           HB3      ARG  67  12.920 -14.062   1.399
  571    HG2  ARG  67           HG2      ARG  67  11.479 -12.730   2.984
  572    HG3  ARG  67           HG3      ARG  67  10.061 -13.597   2.400
  573    HD2  ARG  67           HD2      ARG  67  12.506 -14.880   3.728
  574    HD3  ARG  67           HD3      ARG  67  11.015 -14.452   4.558
  575   HH11  ARG  67          HH21      ARG  67  13.279 -16.352   2.596
  576   HH12  ARG  67          HH22      ARG  67  13.153 -17.993   2.074
  577   HH21  ARG  67          HH11      ARG  67   9.678 -18.167   2.890
  578   HH22  ARG  67          HH12      ARG  67  11.004 -19.100   2.213
  579    H    THR  68           H        THR  68  14.183 -12.299   0.131
  580    HA   THR  68           HA       THR  68  14.331 -10.348   2.189
  581    HB   THR  68           HB       THR  68  16.334 -10.837  -0.062
  582    HG1  THR  68           HG1      THR  68  16.001 -12.766   0.859
  583   HG21  THR  68          HG21      THR  68  17.985 -10.210   1.732
  584   HG22  THR  68          HG22      THR  68  16.935  -8.873   1.255
  585   HG23  THR  68          HG23      THR  68  16.630  -9.741   2.777
  586    H    MET  69           H        MET  69  14.016 -10.027  -1.371
  587    HA   MET  69           HA       MET  69  14.309  -7.119  -1.176
  588    HB2  MET  69           HB2      MET  69  13.878  -8.938  -3.570
  589    HB3  MET  69           HB3      MET  69  14.235  -7.213  -3.629
  590    HG2  MET  69           HG2      MET  69  16.040  -9.430  -2.566
  591    HG3  MET  69           HG3      MET  69  16.275  -8.499  -4.021
  592    HE1  MET  69           HE1      MET  69  15.715  -5.512  -3.204
  593    HE2  MET  69           HE2      MET  69  17.293  -4.954  -2.601
  594    HE3  MET  69           HE3      MET  69  17.208  -5.945  -4.065
  595    H    GLN  70           H        GLN  70  11.673  -9.280  -0.890
  596    HA   GLN  70           HA       GLN  70   9.582  -7.861  -2.094
  597    HB2  GLN  70           HB2      GLN  70   9.502 -10.162  -0.998
  598    HB3  GLN  70           HB3      GLN  70   9.545  -9.363   0.569
  599    HG2  GLN  70           HG2      GLN  70   7.318  -9.994   0.137
  600    HG3  GLN  70           HG3      GLN  70   7.361  -8.239  -0.037
  601   HE21  GLN  70          HE22      GLN  70   6.605 -11.249  -1.628
  602   HE22  GLN  70          HE21      GLN  70   6.289 -10.594  -3.223
  603    H    GLY  71           H        GLY  71   8.754  -5.859  -1.736
  604    HA2  GLY  71           HA2      GLY  71   8.160  -3.924  -0.696
  605    HA3  GLY  71           HA3      GLY  71   8.503  -4.674   0.863
  606    H    PHE  72           H        PHE  72  11.354  -4.947  -0.999
  607    HA   PHE  72           HA       PHE  72  12.679  -3.126   0.775
  608    HD1  PHE  72           HD1      PHE  72  15.225  -4.328   1.633
  609    HD2  PHE  72           HD2      PHE  72  15.336  -2.845  -2.413
  610    HE1  PHE  72           HE1      PHE  72  17.436  -3.287   2.072
  611    HE2  PHE  72           HE2      PHE  72  17.546  -1.793  -1.966
  612    HZ   PHE  72           HZ       PHE  72  18.597  -2.016   0.276
  613    HB2  PHE  72           HB2      PHE  72  13.690  -5.190  -0.124
  614    HB3  PHE  72           HB3      PHE  72  13.687  -4.498  -1.747
  615    HA   PRO  73           HA       PRO  73  12.193   0.476  -1.897
  616    HB2  PRO  73           HB2      PRO  73  13.655   2.334  -0.593
  617    HB3  PRO  73           HB3      PRO  73  12.148   1.644   0.076
  618    HG2  PRO  73           HG2      PRO  73  15.000   0.790   0.700
  619    HG3  PRO  73           HG3      PRO  73  13.688   1.182   1.857
  620    HD2  PRO  73           HD2      PRO  73  14.260  -1.383   1.075
  621    HD3  PRO  73           HD3      PRO  73  12.594  -0.854   1.450
  622    H    PHE  74           H        PHE  74  13.335  -0.960  -3.473
  623    HA   PHE  74           HA       PHE  74  16.071  -1.185  -3.900
  624    HD1  PHE  74           HD1      PHE  74  16.845  -3.175  -5.658
  625    HD2  PHE  74           HD2      PHE  74  14.209  -0.698  -8.010
  626    HE1  PHE  74           HE1      PHE  74  18.028  -3.871  -7.729
  627    HE2  PHE  74           HE2      PHE  74  15.406  -1.382 -10.070
  628    HZ   PHE  74           HZ       PHE  74  17.290  -2.990  -9.941
  629    HB2  PHE  74           HB2      PHE  74  14.426  -2.520  -4.972
  630    HB3  PHE  74           HB3      PHE  74  13.691  -1.132  -5.769
  631    H    TYR  75           H        TYR  75  13.917   1.318  -5.266
  632    HA   TYR  75           HA       TYR  75  16.083   3.273  -5.195
  633    HD1  TYR  75           HD2      TYR  75  17.678   4.672  -6.897
  634    HD2  TYR  75           HD1      TYR  75  16.735   0.692  -8.266
  635    HE1  TYR  75           HE2      TYR  75  20.071   4.275  -7.367
  636    HE2  TYR  75           HE1      TYR  75  19.125   0.280  -8.735
  637    HH   TYR  75           HH       TYR  75  21.664   2.763  -8.134
  638    HB2  TYR  75           HB2      TYR  75  14.943   2.272  -7.811
  639    HB3  TYR  75           HB3      TYR  75  15.351   3.971  -7.637
  640    H    ASP  76           H        ASP  76  14.677   3.831  -3.471
  641    HA   ASP  76           HA       ASP  76  13.057   4.973  -2.430
  642    HB2  ASP  76           HB2      ASP  76  14.342   6.711  -3.640
  643    HB3  ASP  76           HB3      ASP  76  13.146   6.676  -4.937
  644    H    LYS  77           H        LYS  77  12.054   2.720  -3.956
  645    HA   LYS  77           HA       LYS  77   9.207   3.348  -3.834
  646    HB2  LYS  77           HB2      LYS  77   9.841   3.800  -6.204
  647    HB3  LYS  77           HB3      LYS  77  10.513   2.168  -6.339
  648    HG2  LYS  77           HG2      LYS  77   8.298   1.188  -5.924
  649    HG3  LYS  77           HG3      LYS  77   7.592   2.790  -5.695
  650    HD2  LYS  77           HD2      LYS  77   8.863   1.739  -8.257
  651    HD3  LYS  77           HD3      LYS  77   7.137   1.795  -7.949
  652    HE2  LYS  77           HE2      LYS  77   8.963   4.241  -8.112
  653    HE3  LYS  77           HE3      LYS  77   7.934   3.642  -9.414
  654    HZ1  LYS  77           HZ1      LYS  77   6.860   5.434  -8.247
  655    HZ2  LYS  77           HZ2      LYS  77   5.998   4.076  -8.019
  656    HZ3  LYS  77           HZ3      LYS  77   6.941   4.668  -6.816
  657    HA   PRO  78           HA       PRO  78   9.987  -0.688  -1.965
  658    HB2  PRO  78           HB2      PRO  78   7.418  -1.467  -1.355
  659    HB3  PRO  78           HB3      PRO  78   8.329  -0.238  -0.423
  660    HG2  PRO  78           HG2      PRO  78   6.263   0.210  -2.591
  661    HG3  PRO  78           HG3      PRO  78   6.416   1.041  -1.012
  662    HD2  PRO  78           HD2      PRO  78   7.362   2.114  -3.343
  663    HD3  PRO  78           HD3      PRO  78   8.195   2.373  -1.782
  664    H    MET  79           H        MET  79  10.520  -2.414  -3.187
  665    HA   MET  79           HA       MET  79   9.360  -3.059  -5.721
  666    HB2  MET  79           HB2      MET  79  10.971  -4.713  -3.732
  667    HB3  MET  79           HB3      MET  79  10.609  -5.240  -5.383
  668    HG2  MET  79           HG2      MET  79  12.061  -2.652  -4.740
  669    HG3  MET  79           HG3      MET  79  12.880  -4.185  -4.990
  670    HE1  MET  79           HE1      MET  79  14.144  -4.425  -6.937
  671    HE2  MET  79           HE2      MET  79  12.835  -5.535  -7.400
  672    HE3  MET  79           HE3      MET  79  13.500  -4.396  -8.594
  673    H    GLN  80           H        GLN  80   8.028  -4.905  -6.276
  674    HA   GLN  80           HA       GLN  80   6.640  -6.315  -4.113
  675    HB2  GLN  80           HB2      GLN  80   5.164  -4.439  -4.912
  676    HB3  GLN  80           HB3      GLN  80   5.289  -5.076  -6.564
  677    HG2  GLN  80           HG2      GLN  80   4.258  -7.174  -5.879
  678    HG3  GLN  80           HG3      GLN  80   4.229  -6.650  -4.187
  679   HE21  GLN  80          HE22      GLN  80   2.929  -4.573  -3.725
  680   HE22  GLN  80          HE21      GLN  80   1.474  -4.323  -4.654
  681    H    ILE  81           H        ILE  81   6.800  -8.478  -4.606
  682    HA   ILE  81           HA       ILE  81   7.676  -9.239  -7.337
  683    HB   ILE  81           HB       ILE  81   9.018 -10.393  -4.886
  684   HG12  ILE  81          HG12      ILE  81   9.841  -7.765  -6.160
  685   HG13  ILE  81          HG13      ILE  81   9.419  -8.089  -4.464
  686   HG21  ILE  81          HG21      ILE  81   9.319 -11.470  -7.120
  687   HG22  ILE  81          HG22      ILE  81   9.930  -9.944  -7.767
  688   HG23  ILE  81          HG23      ILE  81  10.831 -10.825  -6.525
  689   HD11  ILE  81          HD11      ILE  81  11.770  -7.804  -4.603
  690   HD12  ILE  81          HD12      ILE  81  11.444  -9.518  -4.259
  691   HD13  ILE  81          HD13      ILE  81  11.930  -8.993  -5.894
  692    H    ALA  82           H        ALA  82   7.300 -11.419  -7.860
  693    HA   ALA  82           HA       ALA  82   5.846 -13.171  -5.990
  694    HB1  ALA  82           HB1      ALA  82   4.838 -12.457  -8.791
  695    HB2  ALA  82           HB2      ALA  82   4.156 -13.707  -7.730
  696    HB3  ALA  82           HB3      ALA  82   4.053 -12.001  -7.260
  697    H    TYR  83           H        TYR  83   5.802 -15.448  -7.037
  698    HA   TYR  83           HA       TYR  83   8.405 -15.972  -8.318
  699    HD1  TYR  83           HD1      TYR  83   5.240 -17.117  -5.698
  700    HD2  TYR  83           HD2      TYR  83   6.163 -19.433  -9.223
  701    HE1  TYR  83           HE1      TYR  83   2.991 -18.148  -5.610
  702    HE2  TYR  83           HE2      TYR  83   3.932 -20.491  -9.123
  703    HH   TYR  83           HH       TYR  83   1.900 -20.616  -7.986
  704    HB2  TYR  83           HB2      TYR  83   7.907 -18.278  -8.028
  705    HB3  TYR  83           HB3      TYR  83   7.610 -17.448  -6.518
  706    H    SER  84           H        SER  84   8.536 -17.039 -10.436
  707    HA   SER  84           HA       SER  84   6.693 -15.957 -12.341
  708    HG   SER  84           HG       SER  84   8.794 -15.214 -13.341
  709    HB2  SER  84           HB2      SER  84   8.975 -17.935 -12.556
  710    HB3  SER  84           HB3      SER  84   8.121 -17.237 -13.952
  711    H    LYS  85           H        LYS  85   4.662 -16.780 -11.656
  712    HA   LYS  85           HA       LYS  85   3.843 -19.462 -11.621
  713    HB2  LYS  85           HB2      LYS  85   2.398 -16.902 -12.412
  714    HB3  LYS  85           HB3      LYS  85   1.566 -18.451 -12.240
  715    HG2  LYS  85           HG2      LYS  85   2.064 -18.627  -9.925
  716    HG3  LYS  85           HG3      LYS  85   3.251 -17.314  -9.974
  717    HD2  LYS  85           HD2      LYS  85   1.473 -15.693 -10.496
  718    HD3  LYS  85           HD3      LYS  85   0.250 -16.966 -10.401
  719    HE2  LYS  85           HE2      LYS  85   2.161 -16.298  -8.107
  720    HE3  LYS  85           HE3      LYS  85   0.623 -15.456  -8.336
  721    HZ1  LYS  85           HZ1      LYS  85   0.306 -17.225  -6.802
  722    HZ2  LYS  85           HZ2      LYS  85  -0.498 -17.626  -8.155
  723    HZ3  LYS  85           HZ3      LYS  85   0.931 -18.354  -7.797
  724    H    SER  86           H        SER  86   4.924 -17.724 -14.410
  725    HA   SER  86           HA       SER  86   3.896 -19.875 -16.197
  726    HG   SER  86           HG       SER  86   2.308 -16.787 -17.114
  727    HB2  SER  86           HB2      SER  86   4.591 -17.007 -16.928
  728    HB3  SER  86           HB3      SER  86   3.866 -18.237 -17.978
  729    H    ASP  87           H        ASP  87   6.418 -19.753 -14.491
  730    HA   ASP  87           HA       ASP  87   8.750 -19.181 -15.853
  731    HB2  ASP  87           HB2      ASP  87   8.746 -19.884 -13.565
  732    HB3  ASP  87           HB3      ASP  87   8.133 -21.484 -13.985
  733    H    SER  88           H        SER  88   6.885 -22.278 -16.073
  734    HA   SER  88           HA       SER  88   8.651 -23.650 -17.716
  735    HG   SER  88           HG       SER  88   5.872 -25.282 -16.062
  736    HB2  SER  88           HB2      SER  88   5.619 -23.843 -17.846
  737    HB3  SER  88           HB3      SER  88   6.805 -25.124 -18.153
  738    H    ASP  89           H        ASP  89   6.214 -21.194 -18.652
  739    HA   ASP  89           HA       ASP  89   6.342 -21.854 -21.494
  740    HB2  ASP  89           HB2      ASP  89   4.297 -20.909 -20.520
  741    HB3  ASP  89           HB3      ASP  89   5.177 -19.461 -20.020
  742    H    ILE  90           H        ILE  90   7.696 -19.291 -19.374
  743    HA   ILE  90           HA       ILE  90   9.010 -18.006 -21.616
  744    HB   ILE  90           HB       ILE  90  10.203 -16.642 -20.004
  745   HG12  ILE  90          HG12      ILE  90   8.872 -18.328 -17.860
  746   HG13  ILE  90          HG13      ILE  90  10.609 -18.264 -18.204
  747   HG21  ILE  90          HG21      ILE  90   7.852 -16.188 -20.765
  748   HG22  ILE  90          HG22      ILE  90   7.265 -16.920 -19.254
  749   HG23  ILE  90          HG23      ILE  90   8.259 -15.446 -19.217
  750   HD11  ILE  90          HD11      ILE  90  10.116 -16.958 -16.234
  751   HD12  ILE  90          HD12      ILE  90  10.623 -15.861 -17.538
  752   HD13  ILE  90          HD13      ILE  90   8.903 -16.001 -17.087
  753    H    VAL  91           H        VAL  91  10.050 -20.518 -19.265
  754    HA   VAL  91           HA       VAL  91  12.723 -20.593 -20.226
  755    HB   VAL  91           HB       VAL  91  10.981 -22.636 -18.813
  756   HG11  VAL  91          HG11      VAL  91  13.052 -23.959 -18.401
  757   HG12  VAL  91          HG12      VAL  91  12.581 -23.972 -20.101
  758   HG13  VAL  91          HG13      VAL  91  13.924 -22.937 -19.566
  759   HG21  VAL  91          HG21      VAL  91  11.792 -20.607 -17.542
  760   HG22  VAL  91          HG22      VAL  91  12.459 -22.116 -16.916
  761   HG23  VAL  91          HG23      VAL  91  13.456 -21.057 -17.937
  762    H    ALA  92           H        ALA  92   9.723 -22.371 -21.281
  763    HA   ALA  92           HA       ALA  92  11.020 -23.783 -23.358
  764    HB1  ALA  92           HB1      ALA  92   8.769 -24.099 -24.292
  765    HB2  ALA  92           HB2      ALA  92   8.756 -24.340 -22.540
  766    HB3  ALA  92           HB3      ALA  92   8.125 -22.827 -23.235
  767    H    LYS  93           H        LYS  93   9.720 -20.455 -23.282
  768    HA   LYS  93           HA       LYS  93   9.962 -19.940 -26.052
  769    HB2  LYS  93           HB2      LYS  93   8.721 -18.531 -24.406
  770    HB3  LYS  93           HB3      LYS  93  10.275 -17.918 -23.810
  771    HG2  LYS  93           HG2      LYS  93  10.793 -17.028 -26.073
  772    HG3  LYS  93           HG3      LYS  93   9.292 -17.727 -26.695
  773    HD2  LYS  93           HD2      LYS  93   8.967 -15.372 -26.354
  774    HD3  LYS  93           HD3      LYS  93   7.983 -16.251 -25.175
  775    HE2  LYS  93           HE2      LYS  93   9.693 -15.825 -23.422
  776    HE3  LYS  93           HE3      LYS  93  10.720 -15.012 -24.610
  777    HZ1  LYS  93           HZ1      LYS  93   9.456 -13.426 -23.301
  778    HZ2  LYS  93           HZ2      LYS  93   8.996 -13.327 -24.859
  779    HZ3  LYS  93           HZ3      LYS  93   8.036 -14.075 -23.769
  780    H    ILE  94           H        ILE  94  12.345 -19.245 -23.390
  781    HA   ILE  94           HA       ILE  94  14.282 -18.356 -25.316
  782    HB   ILE  94           HB       ILE  94  15.874 -18.247 -23.529
  783   HG12  ILE  94          HG12      ILE  94  13.853 -19.680 -21.778
  784   HG13  ILE  94          HG13      ILE  94  15.382 -20.357 -22.341
  785   HG21  ILE  94          HG21      ILE  94  14.765 -16.585 -22.187
  786   HG22  ILE  94          HG22      ILE  94  14.041 -16.523 -23.792
  787   HG23  ILE  94          HG23      ILE  94  13.174 -17.314 -22.456
  788   HD11  ILE  94          HD11      ILE  94  15.652 -19.667 -20.060
  789   HD12  ILE  94          HD12      ILE  94  16.595 -18.562 -21.081
  790   HD13  ILE  94          HD13      ILE  94  15.031 -18.046 -20.397
  791    H    LYS  95           H        LYS  95  13.617 -21.553 -23.933
  792    HA   LYS  95           HA       LYS  95  16.006 -22.801 -24.916
  793    HB2  LYS  95           HB2      LYS  95  14.589 -23.683 -23.091
  794    HB3  LYS  95           HB3      LYS  95  13.279 -23.995 -24.237
  795    HG2  LYS  95           HG2      LYS  95  14.649 -25.658 -25.408
  796    HG3  LYS  95           HG3      LYS  95  16.054 -25.249 -24.401
  797    HD2  LYS  95           HD2      LYS  95  14.847 -26.051 -22.382
  798    HD3  LYS  95           HD3      LYS  95  13.419 -26.381 -23.363
  799    HE2  LYS  95           HE2      LYS  95  14.522 -28.468 -22.998
  800    HE3  LYS  95           HE3      LYS  95  14.722 -28.043 -24.698
  801    HZ1  LYS  95           HZ1      LYS  95  16.782 -27.691 -22.590
  802    HZ2  LYS  95           HZ2      LYS  95  16.774 -28.864 -23.716
  803    HZ3  LYS  95           HZ3      LYS  95  16.987 -27.316 -24.171
  804    H    GLY  96           H        GLY  96  12.747 -22.338 -26.336
  805    HA2  GLY  96           HA2      GLY  96  12.556 -22.076 -28.755
  806    HA3  GLY  96           HA3      GLY  96  13.754 -23.358 -28.963
  807    H    THR  97           H        THR  97  12.199 -24.667 -26.435
  808    HA   THR  97           HA       THR  97  10.772 -26.556 -27.971
  809    HB   THR  97           HB       THR  97   9.861 -27.068 -25.539
  810    HG1  THR  97           HG1      THR  97  11.076 -26.158 -23.961
  811   HG21  THR  97          HG21      THR  97  11.540 -28.430 -26.718
  812   HG22  THR  97          HG22      THR  97  12.816 -27.267 -26.294
  813   HG23  THR  97          HG23      THR  97  12.002 -28.213 -25.025
  814    H    PHE  98           H        PHE  98   9.736 -23.419 -26.734
  815    HA   PHE  98           HA       PHE  98   6.968 -23.816 -26.652
  816    HD1  PHE  98           HD1      PHE  98  10.351 -21.553 -27.789
  817    HD2  PHE  98           HD2      PHE  98   6.372 -20.079 -28.570
  818    HE1  PHE  98           HE1      PHE  98  11.260 -19.993 -29.478
  819    HE2  PHE  98           HE2      PHE  98   7.287 -18.537 -30.278
  820    HZ   PHE  98           HZ       PHE  98   9.733 -18.477 -30.728
  821    HB2  PHE  98           HB2      PHE  98   6.706 -21.536 -26.769
  822    HB3  PHE  98           HB3      PHE  98   8.284 -21.714 -26.051
  823    H    LYS  99           H        LYS  99   9.058 -23.759 -29.472
  824    HA   LYS  99           HA       LYS  99   6.676 -24.082 -31.244
  825    HB2  LYS  99           HB2      LYS  99   7.909 -22.972 -33.024
  826    HB3  LYS  99           HB3      LYS  99   7.662 -21.900 -31.645
  827    HG2  LYS  99           HG2      LYS  99   9.985 -22.253 -30.902
  828    HG3  LYS  99           HG3      LYS  99  10.277 -23.387 -32.219
  829    HD2  LYS  99           HD2      LYS  99   9.502 -20.471 -32.638
  830    HD3  LYS  99           HD3      LYS  99  11.172 -21.064 -32.571
  831    HE2  LYS  99           HE2      LYS  99  10.702 -22.616 -34.452
  832    HE3  LYS  99           HE3      LYS  99   9.051 -21.991 -34.558
  833    HZ1  LYS  99           HZ1      LYS  99  11.508 -20.393 -35.010
  834    HZ2  LYS  99           HZ2      LYS  99  10.498 -20.929 -36.169
  835    HZ3  LYS  99           HZ3      LYS  99   9.982 -19.813 -35.103
  836    H    GLU 100           H        GLU 100   9.943 -25.223 -30.382
  837    HA   GLU 100           HA       GLU 100  10.072 -27.067 -32.585
  838    HB2  GLU 100           HB2      GLU 100  12.001 -26.089 -31.324
  839    HB3  GLU 100           HB3      GLU 100  11.601 -27.122 -29.949
  840    HG2  GLU 100           HG2      GLU 100  12.011 -29.133 -31.282
  841    HG3  GLU 100           HG3      GLU 100  12.205 -28.170 -32.749
  842    H    ARG 101           H        ARG 101   8.700 -27.259 -29.288
  843    HA   ARG 101           HA       ARG 101   7.450 -29.845 -29.932
  844    HE   ARG 101           HE       ARG 101  11.662 -33.357 -28.858
  845    HB2  ARG 101           HB2      ARG 101   9.190 -29.440 -27.456
  846    HB3  ARG 101           HB3      ARG 101   8.059 -30.782 -27.692
  847    HG2  ARG 101           HG2      ARG 101   9.333 -31.549 -29.663
  848    HG3  ARG 101           HG3      ARG 101  10.462 -30.202 -29.457
  849    HD2  ARG 101           HD2      ARG 101  11.017 -31.103 -27.151
  850    HD3  ARG 101           HD3      ARG 101  10.011 -32.505 -27.523
  851   HH11  ARG 101          HH21      ARG 101  12.483 -29.982 -28.170
  852   HH12  ARG 101          HH22      ARG 101  13.778 -29.898 -29.320
  853   HH21  ARG 101          HH11      ARG 101  13.599 -33.355 -30.139
  854   HH22  ARG 101          HH12      ARG 101  14.570 -31.934 -30.240
  855    HA   PRO 102           HA       PRO 102   4.922 -26.592 -27.872
  856    HB2  PRO 102           HB2      PRO 102   2.726 -26.640 -29.557
  857    HB3  PRO 102           HB3      PRO 102   4.182 -25.636 -29.833
  858    HG2  PRO 102           HG2      PRO 102   3.541 -28.354 -31.013
  859    HG3  PRO 102           HG3      PRO 102   4.142 -26.891 -31.857
  860    HD2  PRO 102           HD2      PRO 102   5.819 -28.892 -31.090
  861    HD3  PRO 102           HD3      PRO 102   6.318 -27.179 -30.998
  862    H    LYS 103           H        LYS 103   4.318 -29.875 -28.960
  863    HA   LYS 103           HA       LYS 103   3.083 -30.503 -26.386
  864    HB2  LYS 103           HB2      LYS 103   1.167 -30.173 -27.985
  865    HB3  LYS 103           HB3      LYS 103   1.868 -31.398 -29.051
  866    HG2  LYS 103           HG2      LYS 103   1.634 -33.093 -27.248
  867    HG3  LYS 103           HG3      LYS 103   0.976 -31.852 -26.164
  868    HD2  LYS 103           HD2      LYS 103  -0.933 -31.513 -27.713
  869    HD3  LYS 103           HD3      LYS 103  -0.268 -32.752 -28.803
  870    HE2  LYS 103           HE2      LYS 103  -0.440 -34.437 -26.983
  871    HE3  LYS 103           HE3      LYS 103  -1.103 -33.206 -25.900
  872    HZ1  LYS 103           HZ1      LYS 103  -2.389 -34.146 -28.399
  873    HZ2  LYS 103           HZ2      LYS 103  -2.847 -34.544 -26.889
  874    HZ3  LYS 103           HZ3      LYS 103  -3.002 -33.005 -27.399
  875    H    LYS 104           H        LYS 104   4.157 -32.324 -25.653
  876    HA   LYS 104           HA       LYS 104   6.413 -33.339 -27.092
  877    HB2  LYS 104           HB2      LYS 104   4.956 -34.424 -24.640
  878    HB3  LYS 104           HB3      LYS 104   6.477 -35.061 -25.276
  879    HG2  LYS 104           HG2      LYS 104   7.563 -32.849 -24.943
  880    HG3  LYS 104           HG3      LYS 104   6.054 -32.212 -24.260
  881    HD2  LYS 104           HD2      LYS 104   6.154 -33.905 -22.448
  882    HD3  LYS 104           HD3      LYS 104   7.672 -34.537 -23.126
  883    HE2  LYS 104           HE2      LYS 104   8.735 -32.312 -22.811
  884    HE3  LYS 104           HE3      LYS 104   7.227 -31.681 -22.139
  885    HZ1  LYS 104           HZ1      LYS 104   7.448 -33.272 -20.320
  886    HZ2  LYS 104           HZ2      LYS 104   8.843 -33.856 -20.940
  887    HZ3  LYS 104           HZ3      LYS 104   8.767 -32.321 -20.400
  Start of MODEL    5
    1    HA   MET   1           HA       MET   1   7.178 -15.910   3.896
    2    H1   MET   1           H1       MET   1   6.020 -18.030   5.569
    3    H2   MET   1           H2       MET   1   6.952 -16.791   6.110
    4    H3   MET   1           H3       MET   1   5.475 -16.494   5.467
    5    HB2  MET   1           HB2      MET   1   8.858 -17.519   4.766
    6    HB3  MET   1           HB3      MET   1   7.959 -18.860   4.049
    7    HG2  MET   1           HG2      MET   1   8.337 -17.928   1.803
    8    HG3  MET   1           HG3      MET   1   9.131 -16.512   2.513
    9    HE1  MET   1           HE1      MET   1  11.024 -16.992   0.674
   10    HE2  MET   1           HE2      MET   1  11.988 -18.485   0.632
   11    HE3  MET   1           HE3      MET   1  10.269 -18.522   0.174
   12    H    GLU   2           H        GLU   2   5.436 -15.367   2.593
   13    HA   GLU   2           HA       GLU   2   3.433 -17.358   1.974
   14    HB2  GLU   2           HB2      GLU   2   2.210 -15.527   0.995
   15    HB3  GLU   2           HB3      GLU   2   2.878 -15.057   2.558
   16    HG2  GLU   2           HG2      GLU   2   4.724 -13.840   1.373
   17    HG3  GLU   2           HG3      GLU   2   3.985 -14.261  -0.172
   18    H    MET   3           H        MET   3   6.151 -16.000   0.201
   19    HA   MET   3           HA       MET   3   5.295 -16.928  -2.418
   20    HB2  MET   3           HB2      MET   3   7.604 -16.378  -3.068
   21    HB3  MET   3           HB3      MET   3   6.778 -15.031  -2.316
   22    HG2  MET   3           HG2      MET   3   8.795 -16.844  -0.927
   23    HG3  MET   3           HG3      MET   3   9.191 -15.307  -1.660
   24    HE1  MET   3           HE1      MET   3   8.287 -12.867  -0.661
   25    HE2  MET   3           HE2      MET   3   6.604 -13.455  -0.672
   26    HE3  MET   3           HE3      MET   3   7.299 -12.765   0.807
   27    H    LEU   4           H        LEU   4   6.443 -18.604  -3.646
   28    HA   LEU   4           HA       LEU   4   7.463 -20.824  -2.002
   29    HG   LEU   4           HG       LEU   4   5.305 -20.401  -4.968
   30    HB2  LEU   4           HB2      LEU   4   5.869 -22.304  -2.689
   31    HB3  LEU   4           HB3      LEU   4   5.005 -20.831  -2.300
   32   HD11  LEU   4          HD11      LEU   4   5.110 -22.488  -6.205
   33   HD12  LEU   4          HD12      LEU   4   6.555 -22.596  -5.182
   34   HD13  LEU   4          HD13      LEU   4   5.085 -23.436  -4.695
   35   HD21  LEU   4          HD21      LEU   4   3.200 -20.368  -3.771
   36   HD22  LEU   4          HD22      LEU   4   3.031 -21.377  -5.222
   37   HD23  LEU   4          HD23      LEU   4   3.201 -22.142  -3.623
   38    HA   PRO   5           HA       PRO   5  10.653 -21.141  -4.865
   39    HB2  PRO   5           HB2      PRO   5  10.159 -24.116  -4.988
   40    HB3  PRO   5           HB3      PRO   5  11.700 -23.223  -4.756
   41    HG2  PRO   5           HG2      PRO   5  10.463 -24.281  -2.623
   42    HG3  PRO   5           HG3      PRO   5  11.131 -22.614  -2.546
   43    HD2  PRO   5           HD2      PRO   5   8.258 -23.466  -2.996
   44    HD3  PRO   5           HD3      PRO   5   8.925 -22.193  -1.930
   45    H    ASN   6           H        ASN   6  11.040 -20.758  -6.873
   46    HA   ASN   6           HA       ASN   6  10.219 -22.393  -9.087
   47    HB2  ASN   6           HB2      ASN   6   8.241 -20.810  -8.958
   48    HB3  ASN   6           HB3      ASN   6   9.377 -19.451  -9.004
   49   HD21  ASN   6          HD22      ASN   6   9.559 -18.567 -11.067
   50   HD22  ASN   6          HD21      ASN   6   9.405 -19.507 -12.547
   51    H    GLN   7           H        GLN   7  11.818 -21.842 -10.878
   52    HA   GLN   7           HA       GLN   7  14.244 -20.845  -9.723
   53    HB2  GLN   7           HB2      GLN   7  13.981 -22.645 -11.509
   54    HB3  GLN   7           HB3      GLN   7  13.766 -21.336 -12.687
   55    HG2  GLN   7           HG2      GLN   7  15.990 -20.441 -12.109
   56    HG3  GLN   7           HG3      GLN   7  16.167 -21.623 -10.813
   57   HE21  GLN   7          HE22      GLN   7  18.198 -21.498 -12.396
   58   HE22  GLN   7          HE21      GLN   7  18.269 -22.824 -13.554
   59    H    THR   8           H        THR   8  11.661 -19.119 -11.172
   60    HA   THR   8           HA       THR   8  13.392 -16.760 -11.690
   61    HB   THR   8           HB       THR   8  10.950 -17.589 -13.292
   62    HG1  THR   8           HG1      THR   8  12.281 -18.564 -14.732
   63   HG21  THR   8          HG21      THR   8  11.871 -16.102 -15.024
   64   HG22  THR   8          HG22      THR   8  11.665 -15.198 -13.516
   65   HG23  THR   8          HG23      THR   8  13.268 -15.741 -13.990
   66    H    ILE   9           H        ILE   9  12.467 -14.749 -11.204
   67    HA   ILE   9           HA       ILE   9   9.808 -14.773  -9.884
   68    HB   ILE   9           HB       ILE   9  10.460 -13.512  -8.066
   69   HG12  ILE   9          HG12      ILE   9  12.979 -12.824  -9.567
   70   HG13  ILE   9          HG13      ILE   9  11.702 -11.751  -9.027
   71   HG21  ILE   9          HG21      ILE   9  11.226 -15.883  -7.942
   72   HG22  ILE   9          HG22      ILE   9  12.853 -15.360  -8.443
   73   HG23  ILE   9          HG23      ILE   9  12.177 -14.801  -6.921
   74   HD11  ILE   9          HD11      ILE   9  13.595 -11.379  -7.612
   75   HD12  ILE   9          HD12      ILE   9  12.369 -12.220  -6.639
   76   HD13  ILE   9          HD13      ILE   9  13.773 -13.103  -7.256
   77    H    TYR  10           H        TYR  10   8.839 -12.638  -9.852
   78    HA   TYR  10           HA       TYR  10   9.343 -11.126 -12.365
   79    HD1  TYR  10           HD1      TYR  10   8.065  -9.819 -13.728
   80    HD2  TYR  10           HD2      TYR  10   4.676 -12.081 -12.294
   81    HE1  TYR  10           HE1      TYR  10   6.592  -8.586 -15.267
   82    HE2  TYR  10           HE2      TYR  10   3.197 -10.848 -13.836
   83    HH   TYR  10           HH       TYR  10   3.060  -9.270 -15.522
   84    HB2  TYR  10           HB2      TYR  10   7.561 -12.830 -12.579
   85    HB3  TYR  10           HB3      TYR  10   6.778 -12.221 -11.134
   86    H    ILE  11           H        ILE  11   9.607  -9.042 -11.889
   87    HA   ILE  11           HA       ILE  11   8.968  -7.991  -9.176
   88    HB   ILE  11           HB       ILE  11  11.070  -7.343 -11.291
   89   HG12  ILE  11          HG12      ILE  11  11.471  -8.210  -8.393
   90   HG13  ILE  11          HG13      ILE  11  11.329  -9.379  -9.698
   91   HG21  ILE  11          HG21      ILE  11  11.953  -5.624  -9.784
   92   HG22  ILE  11          HG22      ILE  11  10.313  -5.223 -10.271
   93   HG23  ILE  11          HG23      ILE  11  10.609  -5.891  -8.648
   94   HD11  ILE  11          HD11      ILE  11  13.546  -7.341  -9.394
   95   HD12  ILE  11          HD12      ILE  11  13.630  -9.111  -9.231
   96   HD13  ILE  11          HD13      ILE  11  13.311  -8.390 -10.817
   97    H    ASN  12           H        ASN  12   7.383  -6.481  -9.110
   98    HA   ASN  12           HA       ASN  12   6.169  -5.685 -11.711
   99    HB2  ASN  12           HB2      ASN  12   4.808  -6.225  -9.048
  100    HB3  ASN  12           HB3      ASN  12   4.017  -5.908 -10.590
  101   HD21  ASN  12          HD22      ASN  12   4.828  -7.513 -12.448
  102   HD22  ASN  12          HD21      ASN  12   4.927  -9.196 -11.974
  103    H    ASN  13           H        ASN  13   7.857  -4.076  -9.310
  104    HA   ASN  13           HA       ASN  13   6.347  -1.631  -9.815
  105    HB2  ASN  13           HB2      ASN  13   5.402  -2.667  -7.694
  106    HB3  ASN  13           HB3      ASN  13   6.987  -2.411  -6.947
  107   HD21  ASN  13          HD22      ASN  13   6.610  -0.668  -5.504
  108   HD22  ASN  13          HD21      ASN  13   5.765   0.796  -5.962
  109    H    LEU  14           H        LEU  14   8.620  -2.203 -11.004
  110    HA   LEU  14           HA       LEU  14  11.028  -1.316  -9.631
  111    HG   LEU  14           HG       LEU  14  12.661  -2.864 -10.879
  112    HB2  LEU  14           HB2      LEU  14  10.447  -2.793 -11.879
  113    HB3  LEU  14           HB3      LEU  14  10.770  -1.229 -12.615
  114   HD11  LEU  14          HD11      LEU  14  13.814  -3.203 -13.063
  115   HD12  LEU  14          HD12      LEU  14  12.160  -3.805 -13.110
  116   HD13  LEU  14          HD13      LEU  14  12.565  -2.255 -13.880
  117   HD21  LEU  14          HD21      LEU  14  13.308  -0.545 -10.574
  118   HD22  LEU  14          HD22      LEU  14  14.422  -1.262 -11.731
  119   HD23  LEU  14          HD23      LEU  14  13.125  -0.212 -12.320
  120    H    ASN  15           H        ASN  15  12.054   0.790  -9.994
  121    HA   ASN  15           HA       ASN  15  10.230   2.998 -10.746
  122    HB2  ASN  15           HB2      ASN  15  11.717   3.214  -8.759
  123    HB3  ASN  15           HB3      ASN  15  13.129   3.097  -9.816
  124   HD21  ASN  15          HD21      ASN  15  12.426   5.381  -8.107
  125   HD22  ASN  15          HD22      ASN  15  12.152   6.733  -9.174
  126    H    GLU  16           H        GLU  16  10.025   3.445 -12.867
  127    HA   GLU  16           HA       GLU  16  11.611   2.229 -14.857
  128    HB2  GLU  16           HB2      GLU  16  10.354   3.655 -16.416
  129    HB3  GLU  16           HB3      GLU  16   9.326   2.819 -15.265
  130    HG2  GLU  16           HG2      GLU  16  10.132   5.616 -14.515
  131    HG3  GLU  16           HG3      GLU  16   9.071   5.434 -15.907
  132    H    LYS  17           H        LYS  17  12.378   5.137 -13.050
  133    HA   LYS  17           HA       LYS  17  13.912   6.383 -15.113
  134    HB2  LYS  17           HB2      LYS  17  14.739   7.846 -13.504
  135    HB3  LYS  17           HB3      LYS  17  13.112   7.462 -12.997
  136    HG2  LYS  17           HG2      LYS  17  14.067   7.262 -10.970
  137    HG3  LYS  17           HG3      LYS  17  14.440   5.617 -11.494
  138    HD2  LYS  17           HD2      LYS  17  16.721   6.351 -12.155
  139    HD3  LYS  17           HD3      LYS  17  16.305   8.027 -11.746
  140    HE2  LYS  17           HE2      LYS  17  15.882   7.342  -9.390
  141    HE3  LYS  17           HE3      LYS  17  16.349   5.685  -9.788
  142    HZ1  LYS  17           HZ1      LYS  17  18.574   6.540 -10.349
  143    HZ2  LYS  17           HZ2      LYS  17  18.120   8.061  -9.963
  144    HZ3  LYS  17           HZ3      LYS  17  18.186   6.917  -8.810
  145    H    ILE  18           H        ILE  18  14.506   3.551 -13.183
  146    HA   ILE  18           HA       ILE  18  17.399   3.453 -13.574
  147    HB   ILE  18           HB       ILE  18  15.342   1.323 -12.819
  148   HG12  ILE  18          HG12      ILE  18  15.314   3.054 -11.117
  149   HG13  ILE  18          HG13      ILE  18  16.082   1.610 -10.497
  150   HG21  ILE  18          HG21      ILE  18  18.368   1.247 -12.559
  151   HG22  ILE  18          HG22      ILE  18  17.241   0.040 -11.911
  152   HG23  ILE  18          HG23      ILE  18  17.367   0.277 -13.655
  153   HD11  ILE  18          HD11      ILE  18  17.243   3.661  -9.776
  154   HD12  ILE  18          HD12      ILE  18  18.318   2.657 -10.758
  155   HD13  ILE  18          HD13      ILE  18  17.562   4.108 -11.454
  156    H    LYS  19           H        LYS  19  18.225   3.173 -15.618
  157    HA   LYS  19           HA       LYS  19  16.513   2.120 -17.753
  158    HB2  LYS  19           HB2      LYS  19  18.370   2.381 -19.244
  159    HB3  LYS  19           HB3      LYS  19  18.234   3.828 -18.248
  160    HG2  LYS  19           HG2      LYS  19  20.064   3.015 -16.817
  161    HG3  LYS  19           HG3      LYS  19  20.224   1.564 -17.796
  162    HD2  LYS  19           HD2      LYS  19  20.773   4.426 -18.678
  163    HD3  LYS  19           HD3      LYS  19  21.964   3.180 -18.294
  164    HE2  LYS  19           HE2      LYS  19  20.834   1.795 -20.202
  165    HE3  LYS  19           HE3      LYS  19  20.089   3.325 -20.683
  166    HZ1  LYS  19           HZ1      LYS  19  22.383   4.231 -20.843
  167    HZ2  LYS  19           HZ2      LYS  19  22.996   2.740 -20.488
  168    HZ3  LYS  19           HZ3      LYS  19  22.146   2.982 -21.866
  169    H    LYS  20           H        LYS  20  17.327   0.190 -19.086
  170    HA   LYS  20           HA       LYS  20  17.147  -2.146 -17.465
  171    HB2  LYS  20           HB2      LYS  20  17.826  -1.582 -20.371
  172    HB3  LYS  20           HB3      LYS  20  18.066  -3.192 -19.728
  173    HG2  LYS  20           HG2      LYS  20  15.903  -3.103 -20.749
  174    HG3  LYS  20           HG3      LYS  20  15.758  -3.393 -19.024
  175    HD2  LYS  20           HD2      LYS  20  15.456  -0.520 -19.814
  176    HD3  LYS  20           HD3      LYS  20  14.292  -1.609 -20.521
  177    HE2  LYS  20           HE2      LYS  20  14.047  -2.565 -18.064
  178    HE3  LYS  20           HE3      LYS  20  14.745  -1.017 -17.584
  179    HZ1  LYS  20           HZ1      LYS  20  12.309  -0.987 -17.621
  180    HZ2  LYS  20           HZ2      LYS  20  12.872   0.059 -18.751
  181    HZ3  LYS  20           HZ3      LYS  20  12.263  -1.419 -19.180
  182    H    GLU  21           H        GLU  21  19.974  -0.592 -18.958
  183    HA   GLU  21           HA       GLU  21  21.900  -2.546 -18.244
  184    HB2  GLU  21           HB2      GLU  21  22.260  -0.907 -19.913
  185    HB3  GLU  21           HB3      GLU  21  21.933   0.426 -18.812
  186    HG2  GLU  21           HG2      GLU  21  24.001   0.023 -17.578
  187    HG3  GLU  21           HG3      GLU  21  24.328  -1.429 -18.542
  188    H    GLU  22           H        GLU  22  20.632   0.299 -16.432
  189    HA   GLU  22           HA       GLU  22  22.396  -0.052 -14.176
  190    HB2  GLU  22           HB2      GLU  22  19.779   1.435 -14.562
  191    HB3  GLU  22           HB3      GLU  22  20.654   1.407 -13.024
  192    HG2  GLU  22           HG2      GLU  22  22.601   2.443 -14.015
  193    HG3  GLU  22           HG3      GLU  22  21.874   2.426 -15.616
  194    H    LEU  23           H        LEU  23  19.089  -1.163 -15.000
  195    HA   LEU  23           HA       LEU  23  18.443  -2.413 -12.545
  196    HG   LEU  23           HG       LEU  23  15.611  -4.042 -14.610
  197    HB2  LEU  23           HB2      LEU  23  16.797  -2.061 -14.276
  198    HB3  LEU  23           HB3      LEU  23  17.682  -3.004 -15.440
  199   HD11  LEU  23          HD11      LEU  23  17.426  -5.421 -15.610
  200   HD12  LEU  23          HD12      LEU  23  17.941  -5.848 -13.961
  201   HD13  LEU  23          HD13      LEU  23  16.325  -6.269 -14.517
  202   HD21  LEU  23          HD21      LEU  23  17.149  -4.535 -12.022
  203   HD22  LEU  23          HD22      LEU  23  15.886  -3.312 -12.212
  204   HD23  LEU  23          HD23      LEU  23  15.487  -5.032 -12.408
  205    H    LYS  24           H        LYS  24  20.008  -3.870 -15.464
  206    HA   LYS  24           HA       LYS  24  20.484  -6.389 -14.260
  207    HB2  LYS  24           HB2      LYS  24  21.921  -4.892 -16.495
  208    HB3  LYS  24           HB3      LYS  24  22.360  -6.540 -16.006
  209    HG2  LYS  24           HG2      LYS  24  20.053  -7.313 -16.424
  210    HG3  LYS  24           HG3      LYS  24  19.579  -5.702 -16.957
  211    HD2  LYS  24           HD2      LYS  24  21.691  -7.456 -18.285
  212    HD3  LYS  24           HD3      LYS  24  20.014  -7.275 -18.821
  213    HE2  LYS  24           HE2      LYS  24  20.390  -4.822 -19.136
  214    HE3  LYS  24           HE3      LYS  24  22.088  -5.041 -18.682
  215    HZ1  LYS  24           HZ1      LYS  24  21.816  -5.040 -21.083
  216    HZ2  LYS  24           HZ2      LYS  24  22.349  -6.503 -20.605
  217    HZ3  LYS  24           HZ3      LYS  24  20.784  -6.297 -21.030
  218    H    LYS  25           H        LYS  25  22.668  -3.524 -14.430
  219    HA   LYS  25           HA       LYS  25  24.787  -4.663 -12.975
  220    HB2  LYS  25           HB2      LYS  25  24.901  -2.522 -14.222
  221    HB3  LYS  25           HB3      LYS  25  23.826  -1.766 -13.048
  222    HG2  LYS  25           HG2      LYS  25  26.133  -1.110 -12.668
  223    HG3  LYS  25           HG3      LYS  25  25.517  -2.010 -11.281
  224    HD2  LYS  25           HD2      LYS  25  26.763  -4.022 -11.982
  225    HD3  LYS  25           HD3      LYS  25  27.212  -3.238 -13.502
  226    HE2  LYS  25           HE2      LYS  25  29.118  -3.161 -12.065
  227    HE3  LYS  25           HE3      LYS  25  28.495  -1.520 -12.236
  228    HZ1  LYS  25           HZ1      LYS  25  29.078  -2.040  -9.951
  229    HZ2  LYS  25           HZ2      LYS  25  27.480  -1.750 -10.039
  230    HZ3  LYS  25           HZ3      LYS  25  28.036  -3.289  -9.898
  231    H    SER  26           H        SER  26  21.850  -2.979 -11.735
  232    HA   SER  26           HA       SER  26  22.693  -3.000  -9.027
  233    HG   SER  26           HG       SER  26  21.065  -1.231 -10.986
  234    HB2  SER  26           HB2      SER  26  19.883  -2.893 -10.167
  235    HB3  SER  26           HB3      SER  26  20.366  -2.437  -8.518
  236    H    LEU  27           H        LEU  27  20.702  -5.330 -10.886
  237    HA   LEU  27           HA       LEU  27  20.113  -6.959  -8.604
  238    HG   LEU  27           HG       LEU  27  18.648  -6.491 -11.807
  239    HB2  LEU  27           HB2      LEU  27  20.439  -7.960 -11.431
  240    HB3  LEU  27           HB3      LEU  27  19.612  -8.741 -10.090
  241   HD11  LEU  27          HD11      LEU  27  16.727  -7.928 -12.079
  242   HD12  LEU  27          HD12      LEU  27  18.187  -8.903 -12.323
  243   HD13  LEU  27          HD13      LEU  27  17.306  -9.016 -10.798
  244   HD21  LEU  27          HD21      LEU  27  16.701  -6.213 -10.322
  245   HD22  LEU  27          HD22      LEU  27  17.474  -7.252  -9.112
  246   HD23  LEU  27          HD23      LEU  27  18.188  -5.671  -9.531
  247    H    TYR  28           H        TYR  28  22.813  -7.120 -11.044
  248    HA   TYR  28           HA       TYR  28  24.108  -9.313  -9.751
  249    HD1  TYR  28           HD1      TYR  28  24.430 -10.760 -11.442
  250    HD2  TYR  28           HD2      TYR  28  24.953  -7.142 -13.738
  251    HE1  TYR  28           HE1      TYR  28  23.788 -11.975 -13.486
  252    HE2  TYR  28           HE2      TYR  28  24.305  -8.353 -15.795
  253    HH   TYR  28           HH       TYR  28  23.457 -11.848 -15.795
  254    HB2  TYR  28           HB2      TYR  28  25.281  -7.051 -11.413
  255    HB3  TYR  28           HB3      TYR  28  26.161  -8.487 -10.922
  256    H    ALA  29           H        ALA  29  24.196  -5.813  -9.073
  257    HA   ALA  29           HA       ALA  29  26.431  -5.896  -7.320
  258    HB1  ALA  29           HB1      ALA  29  25.604  -3.818  -8.385
  259    HB2  ALA  29           HB2      ALA  29  24.139  -3.887  -7.372
  260    HB3  ALA  29           HB3      ALA  29  25.727  -3.661  -6.624
  261    H    ILE  30           H        ILE  30  22.904  -6.321  -6.640
  262    HA   ILE  30           HA       ILE  30  23.749  -7.073  -3.855
  263    HB   ILE  30           HB       ILE  30  21.534  -6.233  -3.093
  264   HG12  ILE  30          HG12      ILE  30  21.552  -4.377  -5.496
  265   HG13  ILE  30          HG13      ILE  30  20.626  -5.871  -5.505
  266   HG21  ILE  30          HG21      ILE  30  23.706  -5.139  -2.614
  267   HG22  ILE  30          HG22      ILE  30  23.535  -4.154  -4.083
  268   HG23  ILE  30          HG23      ILE  30  22.392  -3.966  -2.736
  269   HD11  ILE  30          HD11      ILE  30  19.168  -4.084  -4.828
  270   HD12  ILE  30          HD12      ILE  30  19.432  -5.143  -3.434
  271   HD13  ILE  30          HD13      ILE  30  20.274  -3.577  -3.542
  272    H    PHE  31           H        PHE  31  21.120  -7.761  -6.269
  273    HA   PHE  31           HA       PHE  31  19.830  -9.664  -4.630
  274    HD1  PHE  31           HD2      PHE  31  19.019  -6.928  -6.487
  275    HD2  PHE  31           HD1      PHE  31  16.877 -10.660  -6.639
  276    HE1  PHE  31           HE2      PHE  31  16.877  -5.703  -6.333
  277    HE2  PHE  31           HE1      PHE  31  14.731  -9.433  -6.476
  278    HZ   PHE  31           HZ       PHE  31  14.724  -6.952  -6.328
  279    HB2  PHE  31           HB2      PHE  31  19.904  -9.258  -7.609
  280    HB3  PHE  31           HB3      PHE  31  19.167 -10.689  -6.941
  281    H    SER  32           H        SER  32  22.487 -10.202  -7.030
  282    HA   SER  32           HA       SER  32  22.690 -12.947  -6.787
  283    HG   SER  32           HG       SER  32  24.592 -11.636  -9.332
  284    HB2  SER  32           HB2      SER  32  24.848 -10.864  -7.186
  285    HB3  SER  32           HB3      SER  32  25.123 -12.611  -7.337
  286    H    GLN  33           H        GLN  33  23.793 -10.557  -4.369
  287    HA   GLN  33           HA       GLN  33  25.680 -12.409  -3.167
  288    HB2  GLN  33           HB2      GLN  33  24.776  -9.576  -2.601
  289    HB3  GLN  33           HB3      GLN  33  25.700 -10.458  -1.395
  290    HG2  GLN  33           HG2      GLN  33  27.148  -9.076  -2.830
  291    HG3  GLN  33           HG3      GLN  33  27.564 -10.785  -2.867
  292   HE21  GLN  33          HE22      GLN  33  26.068  -8.119  -4.777
  293   HE22  GLN  33          HE21      GLN  33  26.184  -8.938  -6.315
  294    H    PHE  34           H        PHE  34  22.314 -12.259  -2.943
  295    HA   PHE  34           HA       PHE  34  22.466 -14.105  -0.637
  296    HD1  PHE  34           HD1      PHE  34  18.763 -12.427  -1.801
  297    HD2  PHE  34           HD2      PHE  34  21.913  -9.943  -0.208
  298    HE1  PHE  34           HE1      PHE  34  17.781 -10.439  -2.926
  299    HE2  PHE  34           HE2      PHE  34  20.910  -7.966  -1.307
  300    HZ   PHE  34           HZ       PHE  34  18.877  -8.219  -2.704
  301    HB2  PHE  34           HB2      PHE  34  20.295 -13.120   0.225
  302    HB3  PHE  34           HB3      PHE  34  21.747 -12.191   0.480
  303    H    GLY  35           H        GLY  35  22.273 -14.265  -3.673
  304    HA2  GLY  35           HA2      GLY  35  20.831 -16.596  -3.907
  305    HA3  GLY  35           HA3      GLY  35  19.659 -15.314  -4.292
  306    H    GLN  36           H        GLN  36  22.657 -16.916  -5.328
  307    HA   GLN  36           HA       GLN  36  23.539 -15.010  -7.162
  308    HB2  GLN  36           HB2      GLN  36  24.936 -16.835  -6.396
  309    HB3  GLN  36           HB3      GLN  36  23.911 -18.022  -7.207
  310    HG2  GLN  36           HG2      GLN  36  26.009 -17.542  -8.456
  311    HG3  GLN  36           HG3      GLN  36  24.570 -17.196  -9.395
  312   HE21  GLN  36          HE22      GLN  36  24.658 -15.307 -10.554
  313   HE22  GLN  36          HE21      GLN  36  25.580 -13.889 -10.092
  314    H    ILE  37           H        ILE  37  22.859 -14.293  -8.996
  315    HA   ILE  37           HA       ILE  37  20.477 -15.199 -10.320
  316    HB   ILE  37           HB       ILE  37  22.626 -13.114 -10.867
  317   HG12  ILE  37          HG12      ILE  37  19.725 -12.949  -9.913
  318   HG13  ILE  37          HG13      ILE  37  21.147 -12.801  -8.882
  319   HG21  ILE  37          HG21      ILE  37  20.063 -13.523 -12.462
  320   HG22  ILE  37          HG22      ILE  37  21.156 -12.126 -12.579
  321   HG23  ILE  37          HG23      ILE  37  21.730 -13.696 -13.067
  322   HD11  ILE  37          HD11      ILE  37  20.235 -10.848 -10.992
  323   HD12  ILE  37          HD12      ILE  37  20.387 -10.645  -9.240
  324   HD13  ILE  37          HD13      ILE  37  21.849 -10.788 -10.231
  325    H    LEU  38           H        LEU  38  20.303 -15.966 -12.410
  326    HA   LEU  38           HA       LEU  38  22.644 -17.315 -13.669
  327    HG   LEU  38           HG       LEU  38  22.209 -19.623 -14.580
  328    HB2  LEU  38           HB2      LEU  38  20.801 -18.762 -12.733
  329    HB3  LEU  38           HB3      LEU  38  19.693 -18.036 -13.892
  330   HD11  LEU  38          HD11      LEU  38  19.274 -20.436 -14.671
  331   HD12  LEU  38          HD12      LEU  38  20.657 -21.439 -15.164
  332   HD13  LEU  38          HD13      LEU  38  20.463 -20.980 -13.467
  333   HD21  LEU  38          HD21      LEU  38  21.742 -18.232 -16.472
  334   HD22  LEU  38          HD22      LEU  38  21.104 -19.818 -16.859
  335   HD23  LEU  38          HD23      LEU  38  19.988 -18.529 -16.356
  336    H    ASP  39           H        ASP  39  19.502 -15.487 -14.207
  337    HA   ASP  39           HA       ASP  39  20.768 -14.036 -16.407
  338    HB2  ASP  39           HB2      ASP  39  20.028 -16.143 -17.507
  339    HB3  ASP  39           HB3      ASP  39  18.384 -15.850 -16.947
  340    H    ILE  40           H        ILE  40  19.213 -12.330 -17.306
  341    HA   ILE  40           HA       ILE  40  17.166 -11.457 -15.351
  342    HB   ILE  40           HB       ILE  40  19.445  -9.684 -16.339
  343   HG12  ILE  40          HG12      ILE  40  19.084 -10.764 -13.514
  344   HG13  ILE  40          HG13      ILE  40  20.294 -11.329 -14.665
  345   HG21  ILE  40          HG21      ILE  40  18.461  -8.051 -14.665
  346   HG22  ILE  40          HG22      ILE  40  17.375  -8.434 -15.978
  347   HG23  ILE  40          HG23      ILE  40  17.135  -9.193 -14.392
  348   HD11  ILE  40          HD11      ILE  40  21.337  -9.100 -14.735
  349   HD12  ILE  40          HD12      ILE  40  20.202  -8.538 -13.496
  350   HD13  ILE  40          HD13      ILE  40  21.348  -9.824 -13.113
  351    H    VAL  41           H        VAL  41  15.491 -10.330 -16.400
  352    HA   VAL  41           HA       VAL  41  15.822  -9.620 -19.260
  353    HB   VAL  41           HB       VAL  41  13.505 -11.290 -18.207
  354   HG11  VAL  41          HG11      VAL  41  14.251 -10.442 -21.041
  355   HG12  VAL  41          HG12      VAL  41  12.885 -11.485 -20.582
  356   HG13  VAL  41          HG13      VAL  41  12.900  -9.795 -20.084
  357   HG21  VAL  41          HG21      VAL  41  15.813 -12.205 -19.961
  358   HG22  VAL  41          HG22      VAL  41  15.455 -12.759 -18.308
  359   HG23  VAL  41          HG23      VAL  41  14.333 -13.130 -19.609
  360    H    ALA  42           H        ALA  42  15.562  -7.448 -19.065
  361    HA   ALA  42           HA       ALA  42  12.919  -6.496 -18.209
  362    HB1  ALA  42           HB1      ALA  42  15.566  -5.137 -17.503
  363    HB2  ALA  42           HB2      ALA  42  13.931  -4.483 -17.210
  364    HB3  ALA  42           HB3      ALA  42  14.476  -5.933 -16.353
  365    H    LEU  43           H        LEU  43  12.294  -4.666 -19.614
  366    HA   LEU  43           HA       LEU  43  13.910  -4.335 -22.083
  367    HG   LEU  43           HG       LEU  43  12.919  -7.245 -21.833
  368    HB2  LEU  43           HB2      LEU  43  11.104  -5.515 -21.906
  369    HB3  LEU  43           HB3      LEU  43  11.785  -4.893 -23.397
  370   HD11  LEU  43          HD11      LEU  43  12.007  -8.596 -23.670
  371   HD12  LEU  43          HD12      LEU  43  10.722  -7.733 -22.816
  372   HD13  LEU  43          HD13      LEU  43  11.277  -7.148 -24.398
  373   HD21  LEU  43          HD21      LEU  43  13.645  -6.131 -24.587
  374   HD22  LEU  43          HD22      LEU  43  14.687  -6.130 -23.146
  375   HD23  LEU  43          HD23      LEU  43  14.239  -7.658 -23.902
  376    H    LYS  44           H        LYS  44  12.800  -2.745 -23.567
  377    HA   LYS  44           HA       LYS  44  11.744  -0.484 -21.963
  378    HB2  LYS  44           HB2      LYS  44  12.736  -0.650 -24.845
  379    HB3  LYS  44           HB3      LYS  44  12.202   0.824 -24.032
  380    HG2  LYS  44           HG2      LYS  44  14.012   0.576 -22.349
  381    HG3  LYS  44           HG3      LYS  44  14.596  -0.871 -23.198
  382    HD2  LYS  44           HD2      LYS  44  14.971   0.478 -25.246
  383    HD3  LYS  44           HD3      LYS  44  14.402   1.929 -24.394
  384    HE2  LYS  44           HE2      LYS  44  16.247   1.688 -22.748
  385    HE3  LYS  44           HE3      LYS  44  16.806   0.229 -23.577
  386    HZ1  LYS  44           HZ1      LYS  44  18.070   2.168 -24.255
  387    HZ2  LYS  44           HZ2      LYS  44  17.247   1.595 -25.537
  388    HZ3  LYS  44           HZ3      LYS  44  16.734   2.943 -24.768
  389    H    THR  45           H        THR  45  10.258  -3.082 -23.303
  390    HA   THR  45           HA       THR  45   8.093  -1.920 -24.790
  391    HB   THR  45           HB       THR  45   7.026  -4.142 -23.972
  392    HG1  THR  45           HG1      THR  45   8.459  -5.599 -23.066
  393   HG21  THR  45          HG21      THR  45   9.684  -4.299 -25.478
  394   HG22  THR  45          HG22      THR  45   8.383  -5.509 -25.506
  395   HG23  THR  45          HG23      THR  45   8.108  -3.903 -26.199
  396    H    LEU  46           H        LEU  46   5.965  -1.414 -23.924
  397    HA   LEU  46           HA       LEU  46   5.967   0.154 -21.614
  398    HG   LEU  46           HG       LEU  46   3.041  -0.415 -20.655
  399    HB2  LEU  46           HB2      LEU  46   4.257   0.315 -23.374
  400    HB3  LEU  46           HB3      LEU  46   3.655  -1.294 -22.963
  401   HD11  LEU  46          HD11      LEU  46   3.692   2.287 -21.917
  402   HD12  LEU  46          HD12      LEU  46   2.840   2.038 -20.377
  403   HD13  LEU  46          HD13      LEU  46   4.527   1.546 -20.532
  404   HD21  LEU  46          HD21      LEU  46   1.739   0.926 -23.042
  405   HD22  LEU  46          HD22      LEU  46   1.389  -0.697 -22.392
  406   HD23  LEU  46          HD23      LEU  46   1.029   0.734 -21.419
  407    H    LYS  47           H        LYS  47   4.991  -3.285 -21.958
  408    HA   LYS  47           HA       LYS  47   4.012  -3.636 -19.353
  409    HB2  LYS  47           HB2      LYS  47   3.734  -5.205 -21.281
  410    HB3  LYS  47           HB3      LYS  47   5.422  -5.712 -21.101
  411    HG2  LYS  47           HG2      LYS  47   4.943  -6.619 -18.865
  412    HG3  LYS  47           HG3      LYS  47   3.294  -5.964 -18.928
  413    HD2  LYS  47           HD2      LYS  47   2.826  -7.451 -20.886
  414    HD3  LYS  47           HD3      LYS  47   4.460  -8.137 -20.725
  415    HE2  LYS  47           HE2      LYS  47   3.921  -8.871 -18.409
  416    HE3  LYS  47           HE3      LYS  47   2.310  -8.153 -18.553
  417    HZ1  LYS  47           HZ1      LYS  47   3.345 -10.470 -20.087
  418    HZ2  LYS  47           HZ2      LYS  47   2.227 -10.519 -18.969
  419    HZ3  LYS  47           HZ3      LYS  47   1.880  -9.745 -20.380
  420    H    MET  48           H        MET  48   7.333  -3.237 -20.377
  421    HA   MET  48           HA       MET  48   8.355  -4.244 -17.767
  422    HB2  MET  48           HB2      MET  48   9.691  -4.208 -20.478
  423    HB3  MET  48           HB3      MET  48  10.406  -4.800 -18.972
  424    HG2  MET  48           HG2      MET  48   7.932  -5.930 -20.338
  425    HG3  MET  48           HG3      MET  48   9.537  -6.638 -20.402
  426    HE1  MET  48           HE1      MET  48  10.727  -6.743 -17.653
  427    HE2  MET  48           HE2      MET  48  10.041  -8.234 -16.968
  428    HE3  MET  48           HE3      MET  48  10.542  -8.190 -18.673
  429    H    ARG  49           H        ARG  49   7.468  -1.422 -19.055
  430    HA   ARG  49           HA       ARG  49   9.588   0.396 -18.737
  431    HE   ARG  49           HE       ARG  49   6.704   4.271 -16.288
  432    HB2  ARG  49           HB2      ARG  49   7.437   1.121 -19.526
  433    HB3  ARG  49           HB3      ARG  49   6.617   0.520 -18.079
  434    HG2  ARG  49           HG2      ARG  49   7.625   2.231 -16.697
  435    HG3  ARG  49           HG3      ARG  49   8.574   2.850 -18.069
  436    HD2  ARG  49           HD2      ARG  49   6.598   3.618 -19.183
  437    HD3  ARG  49           HD3      ARG  49   5.533   2.701 -18.099
  438   HH11  ARG  49          HH11      ARG  49   5.290   5.226 -19.418
  439   HH12  ARG  49          HH12      ARG  49   4.853   6.799 -18.859
  440   HH21  ARG  49          HH21      ARG  49   6.176   6.199 -15.586
  441   HH22  ARG  49          HH22      ARG  49   5.372   7.405 -16.574
  442    H    GLY  50           H        GLY  50   7.450  -1.048 -16.247
  443    HA2  GLY  50           HA2      GLY  50   9.426  -0.303 -14.134
  444    HA3  GLY  50           HA3      GLY  50   7.679  -0.145 -13.933
  445    H    GLN  51           H        GLN  51   9.328  -2.889 -15.600
  446    HA   GLN  51           HA       GLN  51   8.818  -4.647 -13.308
  447    HB2  GLN  51           HB2      GLN  51   7.681  -5.303 -16.068
  448    HB3  GLN  51           HB3      GLN  51   7.659  -6.323 -14.647
  449    HG2  GLN  51           HG2      GLN  51   6.322  -4.362 -13.520
  450    HG3  GLN  51           HG3      GLN  51   6.035  -3.830 -15.183
  451   HE21  GLN  51          HE21      GLN  51   5.247  -5.713 -16.692
  452   HE22  GLN  51          HE22      GLN  51   4.233  -6.973 -15.966
  453    H    ALA  52           H        ALA  52   9.862  -6.758 -13.603
  454    HA   ALA  52           HA       ALA  52  11.768  -7.127 -15.780
  455    HB1  ALA  52           HB1      ALA  52  12.752  -6.716 -12.918
  456    HB2  ALA  52           HB2      ALA  52  13.728  -7.318 -14.272
  457    HB3  ALA  52           HB3      ALA  52  13.099  -5.664 -14.310
  458    H    PHE  53           H        PHE  53  12.788  -9.259 -15.574
  459    HA   PHE  53           HA       PHE  53  11.607 -11.106 -13.567
  460    HD1  PHE  53           HD1      PHE  53   9.427 -12.927 -14.390
  461    HD2  PHE  53           HD2      PHE  53  10.717 -10.559 -17.754
  462    HE1  PHE  53           HE1      PHE  53   7.087 -12.817 -15.217
  463    HE2  PHE  53           HE2      PHE  53   8.369 -10.407 -18.547
  464    HZ   PHE  53           HZ       PHE  53   6.551 -11.549 -17.288
  465    HB2  PHE  53           HB2      PHE  53  12.315 -11.795 -16.444
  466    HB3  PHE  53           HB3      PHE  53  11.804 -12.925 -15.218
  467    H    VAL  54           H        VAL  54  13.194 -12.681 -12.840
  468    HA   VAL  54           HA       VAL  54  15.852 -12.612 -14.021
  469    HB   VAL  54           HB       VAL  54  16.282 -10.809 -12.660
  470   HG11  VAL  54          HG11      VAL  54  14.287 -10.720 -11.233
  471   HG12  VAL  54          HG12      VAL  54  14.871 -12.131 -10.329
  472   HG13  VAL  54          HG13      VAL  54  15.743 -10.600 -10.243
  473   HG21  VAL  54          HG21      VAL  54  17.186 -13.177 -10.987
  474   HG22  VAL  54          HG22      VAL  54  18.009 -12.496 -12.396
  475   HG23  VAL  54          HG23      VAL  54  17.842 -11.531 -10.930
  476    H    ILE  55           H        ILE  55  16.899 -14.443 -13.753
  477    HA   ILE  55           HA       ILE  55  15.391 -16.779 -12.723
  478    HB   ILE  55           HB       ILE  55  17.469 -16.622 -14.954
  479   HG12  ILE  55          HG12      ILE  55  15.730 -17.220 -16.583
  480   HG13  ILE  55          HG13      ILE  55  14.476 -16.993 -15.390
  481   HG21  ILE  55          HG21      ILE  55  15.602 -18.879 -14.112
  482   HG22  ILE  55          HG22      ILE  55  16.756 -18.938 -15.460
  483   HG23  ILE  55          HG23      ILE  55  17.352 -18.812 -13.811
  484   HD11  ILE  55          HD11      ILE  55  16.326 -14.761 -16.348
  485   HD12  ILE  55          HD12      ILE  55  14.775 -15.158 -17.105
  486   HD13  ILE  55          HD13      ILE  55  14.800 -14.580 -15.446
  487    H    PHE  56           H        PHE  56  16.609 -18.095 -11.305
  488    HA   PHE  56           HA       PHE  56  19.299 -17.054 -10.510
  489    HD1  PHE  56           HD1      PHE  56  15.475 -16.410  -9.649
  490    HD2  PHE  56           HD2      PHE  56  19.239 -15.496  -7.764
  491    HE1  PHE  56           HE1      PHE  56  14.730 -14.084  -9.248
  492    HE2  PHE  56           HE2      PHE  56  18.477 -13.184  -7.344
  493    HZ   PHE  56           HZ       PHE  56  16.209 -12.471  -8.086
  494    HB2  PHE  56           HB2      PHE  56  17.078 -18.245  -8.828
  495    HB3  PHE  56           HB3      PHE  56  18.661 -17.784  -8.234
  496    H    LYS  57           H        LYS  57  20.654 -18.694  -9.333
  497    HA   LYS  57           HA       LYS  57  21.078 -20.940 -11.037
  498    HB2  LYS  57           HB2      LYS  57  22.077 -20.254  -8.244
  499    HB3  LYS  57           HB3      LYS  57  22.626 -21.689  -9.092
  500    HG2  LYS  57           HG2      LYS  57  22.888 -19.009 -10.481
  501    HG3  LYS  57           HG3      LYS  57  23.972 -19.424  -9.157
  502    HD2  LYS  57           HD2      LYS  57  25.025 -19.947 -11.254
  503    HD3  LYS  57           HD3      LYS  57  24.775 -21.404 -10.289
  504    HE2  LYS  57           HE2      LYS  57  22.812 -22.001 -11.681
  505    HE3  LYS  57           HE3      LYS  57  23.029 -20.518 -12.629
  506    HZ1  LYS  57           HZ1      LYS  57  24.988 -22.740 -12.460
  507    HZ2  LYS  57           HZ2      LYS  57  24.013 -22.444 -13.726
  508    HZ3  LYS  57           HZ3      LYS  57  25.187 -21.382 -13.344
  509    H    GLU  58           H        GLU  58  19.173 -20.662  -8.038
  510    HA   GLU  58           HA       GLU  58  18.191 -23.411  -8.431
  511    HB2  GLU  58           HB2      GLU  58  19.420 -22.380  -5.826
  512    HB3  GLU  58           HB3      GLU  58  18.446 -23.844  -5.974
  513    HG2  GLU  58           HG2      GLU  58  20.131 -24.773  -7.579
  514    HG3  GLU  58           HG3      GLU  58  21.146 -23.354  -7.293
  515    H    ILE  59           H        ILE  59  16.164 -23.733  -7.373
  516    HA   ILE  59           HA       ILE  59  14.443 -21.481  -7.394
  517    HB   ILE  59           HB       ILE  59  12.723 -23.022  -6.726
  518   HG12  ILE  59          HG12      ILE  59  14.945 -25.012  -6.049
  519   HG13  ILE  59          HG13      ILE  59  13.835 -24.257  -4.907
  520   HG21  ILE  59          HG21      ILE  59  14.577 -24.587  -8.559
  521   HG22  ILE  59          HG22      ILE  59  12.804 -24.512  -8.571
  522   HG23  ILE  59          HG23      ILE  59  13.747 -23.105  -9.056
  523   HD11  ILE  59          HD11      ILE  59  13.082 -26.492  -5.279
  524   HD12  ILE  59          HD12      ILE  59  11.924 -25.419  -6.091
  525   HD13  ILE  59          HD13      ILE  59  13.139 -26.309  -7.037
  526    H    GLY  60           H        GLY  60  16.265 -22.954  -4.725
  527    HA2  GLY  60           HA2      GLY  60  14.852 -21.610  -2.600
  528    HA3  GLY  60           HA3      GLY  60  16.475 -22.321  -2.526
  529    H    SER  61           H        SER  61  17.697 -20.793  -4.648
  530    HA   SER  61           HA       SER  61  18.436 -18.402  -3.265
  531    HG   SER  61           HG       SER  61  20.869 -19.936  -5.368
  532    HB2  SER  61           HB2      SER  61  18.834 -19.161  -6.198
  533    HB3  SER  61           HB3      SER  61  19.745 -17.952  -5.294
  534    H    ALA  62           H        ALA  62  16.310 -19.063  -6.092
  535    HA   ALA  62           HA       ALA  62  15.483 -16.406  -6.613
  536    HB1  ALA  62           HB1      ALA  62  13.488 -17.505  -7.620
  537    HB2  ALA  62           HB2      ALA  62  14.970 -18.355  -8.085
  538    HB3  ALA  62           HB3      ALA  62  13.923 -19.021  -6.822
  539    H    SER  63           H        SER  63  14.012 -18.889  -4.445
  540    HA   SER  63           HA       SER  63  11.901 -17.304  -3.487
  541    HG   SER  63           HG       SER  63  12.761 -20.309  -3.906
  542    HB2  SER  63           HB2      SER  63  13.424 -19.448  -1.941
  543    HB3  SER  63           HB3      SER  63  11.769 -18.890  -1.651
  544    H    ASN  64           H        ASN  64  15.228 -17.633  -2.227
  545    HA   ASN  64           HA       ASN  64  14.735 -16.028   0.076
  546    HB2  ASN  64           HB2      ASN  64  16.659 -17.635  -0.157
  547    HB3  ASN  64           HB3      ASN  64  17.433 -16.483  -1.257
  548   HD21  ASN  64          HD22      ASN  64  18.836 -15.027  -0.212
  549   HD22  ASN  64          HD21      ASN  64  18.663 -14.535   1.460
  550    H    ALA  65           H        ALA  65  16.111 -15.199  -3.121
  551    HA   ALA  65           HA       ALA  65  16.606 -12.465  -2.660
  552    HB1  ALA  65           HB1      ALA  65  16.462 -12.285  -5.121
  553    HB2  ALA  65           HB2      ALA  65  17.386 -13.730  -4.670
  554    HB3  ALA  65           HB3      ALA  65  15.705 -13.883  -5.226
  555    H    LEU  66           H        LEU  66  13.681 -14.129  -3.914
  556    HA   LEU  66           HA       LEU  66  12.042 -11.905  -4.301
  557    HG   LEU  66           HG       LEU  66   9.984 -12.789  -5.467
  558    HB2  LEU  66           HB2      LEU  66  11.716 -14.406  -4.857
  559    HB3  LEU  66           HB3      LEU  66  11.052 -14.589  -3.251
  560   HD11  LEU  66          HD11      LEU  66   9.654 -15.073  -6.066
  561   HD12  LEU  66          HD12      LEU  66   9.172 -15.522  -4.426
  562   HD13  LEU  66          HD13      LEU  66   8.104 -14.516  -5.419
  563   HD21  LEU  66          HD21      LEU  66   9.299 -11.819  -3.326
  564   HD22  LEU  66          HD22      LEU  66   7.920 -12.609  -4.074
  565   HD23  LEU  66          HD23      LEU  66   8.779 -13.413  -2.746
  566    H    ARG  67           H        ARG  67  12.157 -14.001  -1.330
  567    HA   ARG  67           HA       ARG  67  10.348 -12.353   0.103
  568    HE   ARG  67           HE       ARG  67  12.938 -13.372   4.443
  569    HB2  ARG  67           HB2      ARG  67  11.024 -14.734   0.657
  570    HB3  ARG  67           HB3      ARG  67  12.573 -14.111   1.213
  571    HG2  ARG  67           HG2      ARG  67  11.063 -12.589   2.814
  572    HG3  ARG  67           HG3      ARG  67   9.798 -13.731   2.408
  573    HD2  ARG  67           HD2      ARG  67  10.820 -14.456   4.462
  574    HD3  ARG  67           HD3      ARG  67  11.343 -15.593   3.221
  575   HH11  ARG  67          HH21      ARG  67  13.019 -16.533   2.788
  576   HH12  ARG  67          HH22      ARG  67  14.744 -16.460   2.541
  577   HH21  ARG  67          HH11      ARG  67  15.222 -13.344   4.031
  578   HH22  ARG  67          HH12      ARG  67  15.944 -14.681   3.195
  579    H    THR  68           H        THR  68  13.969 -12.329   0.066
  580    HA   THR  68           HA       THR  68  14.292 -10.423   2.124
  581    HB   THR  68           HB       THR  68  16.072 -10.980  -0.292
  582    HG1  THR  68           HG1      THR  68  15.838 -12.827   0.761
  583   HG21  THR  68          HG21      THR  68  16.838  -8.946   0.845
  584   HG22  THR  68          HG22      THR  68  16.756  -9.763   2.423
  585   HG23  THR  68          HG23      THR  68  17.936 -10.284   1.195
  586    H    MET  69           H        MET  69  13.678  -9.984  -1.383
  587    HA   MET  69           HA       MET  69  13.984  -7.071  -1.063
  588    HB2  MET  69           HB2      MET  69  13.686  -8.820  -3.531
  589    HB3  MET  69           HB3      MET  69  13.999  -7.080  -3.527
  590    HG2  MET  69           HG2      MET  69  15.799  -9.277  -2.407
  591    HG3  MET  69           HG3      MET  69  16.102  -8.318  -3.832
  592    HE1  MET  69           HE1      MET  69  16.906  -5.834  -3.857
  593    HE2  MET  69           HE2      MET  69  15.433  -5.306  -3.003
  594    HE3  MET  69           HE3      MET  69  17.040  -4.798  -2.426
  595    H    GLN  70           H        GLN  70  11.398  -9.266  -0.912
  596    HA   GLN  70           HA       GLN  70   9.319  -7.825  -2.118
  597    HB2  GLN  70           HB2      GLN  70   9.227 -10.170  -1.151
  598    HB3  GLN  70           HB3      GLN  70   9.252  -9.467   0.462
  599    HG2  GLN  70           HG2      GLN  70   7.029 -10.075  -0.025
  600    HG3  GLN  70           HG3      GLN  70   7.067  -8.315  -0.095
  601   HE21  GLN  70          HE22      GLN  70   6.149 -11.161  -1.809
  602   HE22  GLN  70          HE21      GLN  70   5.958 -10.453  -3.400
  603    H    GLY  71           H        GLY  71   8.495  -5.832  -1.713
  604    HA2  GLY  71           HA2      GLY  71   7.814  -3.967  -0.617
  605    HA3  GLY  71           HA3      GLY  71   8.135  -4.760   0.929
  606    H    PHE  72           H        PHE  72  11.033  -4.944  -0.861
  607    HA   PHE  72           HA       PHE  72  12.247  -3.142   1.026
  608    HD1  PHE  72           HD2      PHE  72  14.657  -4.357   2.100
  609    HD2  PHE  72           HD1      PHE  72  15.166  -2.886  -1.921
  610    HE1  PHE  72           HE2      PHE  72  16.820  -3.324   2.748
  611    HE2  PHE  72           HE1      PHE  72  17.326  -1.845  -1.267
  612    HZ   PHE  72           HZ       PHE  72  18.155  -2.064   1.068
  613    HB2  PHE  72           HB2      PHE  72  13.298  -5.226   0.194
  614    HB3  PHE  72           HB3      PHE  72  13.437  -4.515  -1.414
  615    HA   PRO  73           HA       PRO  73  12.067   0.455  -1.752
  616    HB2  PRO  73           HB2      PRO  73  13.464   2.281  -0.326
  617    HB3  PRO  73           HB3      PRO  73  11.851   1.695   0.176
  618    HG2  PRO  73           HG2      PRO  73  14.557   0.736   1.174
  619    HG3  PRO  73           HG3      PRO  73  13.123   1.202   2.142
  620    HD2  PRO  73           HD2      PRO  73  13.706  -1.400   1.486
  621    HD3  PRO  73           HD3      PRO  73  12.026  -0.813   1.660
  622    H    PHE  74           H        PHE  74  13.263  -0.965  -3.220
  623    HA   PHE  74           HA       PHE  74  16.089  -1.173  -3.434
  624    HD1  PHE  74           HD2      PHE  74  17.291  -2.650  -5.055
  625    HD2  PHE  74           HD1      PHE  74  14.213  -1.222  -7.719
  626    HE1  PHE  74           HE2      PHE  74  18.680  -3.283  -7.015
  627    HE2  PHE  74           HE1      PHE  74  15.607  -1.851  -9.667
  628    HZ   PHE  74           HZ       PHE  74  17.822  -2.904  -9.324
  629    HB2  PHE  74           HB2      PHE  74  14.521  -2.568  -4.620
  630    HB3  PHE  74           HB3      PHE  74  13.818  -1.181  -5.447
  631    H    TYR  75           H        TYR  75  13.796   1.254  -4.548
  632    HA   TYR  75           HA       TYR  75  15.756   3.370  -4.498
  633    HD1  TYR  75           HD2      TYR  75  17.367   4.636  -6.270
  634    HD2  TYR  75           HD1      TYR  75  15.877   0.921  -7.876
  635    HE1  TYR  75           HE2      TYR  75  19.659   4.030  -6.969
  636    HE2  TYR  75           HE1      TYR  75  18.173   0.290  -8.565
  637    HH   TYR  75           HH       TYR  75  21.010   2.429  -7.972
  638    HB2  TYR  75           HB2      TYR  75  14.319   2.612  -7.083
  639    HB3  TYR  75           HB3      TYR  75  14.921   4.237  -6.784
  640    H    ASP  76           H        ASP  76  13.750   5.199  -5.691
  641    HA   ASP  76           HA       ASP  76  12.162   5.688  -3.408
  642    HB2  ASP  76           HB2      ASP  76  13.081   7.363  -5.022
  643    HB3  ASP  76           HB3      ASP  76  11.886   6.838  -6.207
  644    H    LYS  77           H        LYS  77  11.563   3.005  -4.609
  645    HA   LYS  77           HA       LYS  77   8.681   3.223  -4.383
  646    HB2  LYS  77           HB2      LYS  77   9.999   1.684  -6.674
  647    HB3  LYS  77           HB3      LYS  77   8.344   1.443  -6.132
  648    HG2  LYS  77           HG2      LYS  77   7.861   3.869  -6.710
  649    HG3  LYS  77           HG3      LYS  77   9.484   3.939  -7.442
  650    HD2  LYS  77           HD2      LYS  77   8.840   1.906  -8.817
  651    HD3  LYS  77           HD3      LYS  77   7.192   2.065  -8.194
  652    HE2  LYS  77           HE2      LYS  77   7.012   4.318  -9.215
  653    HE3  LYS  77           HE3      LYS  77   8.680   4.200  -9.778
  654    HZ1  LYS  77           HZ1      LYS  77   7.888   2.124 -11.006
  655    HZ2  LYS  77           HZ2      LYS  77   6.356   2.670 -10.738
  656    HZ3  LYS  77           HZ3      LYS  77   7.443   3.573 -11.598
  657    HA   PRO  78           HA       PRO  78   9.951  -0.462  -2.017
  658    HB2  PRO  78           HB2      PRO  78   7.498  -1.345  -1.195
  659    HB3  PRO  78           HB3      PRO  78   8.309   0.071  -0.457
  660    HG2  PRO  78           HG2      PRO  78   6.130   0.049  -2.559
  661    HG3  PRO  78           HG3      PRO  78   6.266   1.087  -1.108
  662    HD2  PRO  78           HD2      PRO  78   7.027   1.892  -3.634
  663    HD3  PRO  78           HD3      PRO  78   7.820   2.497  -2.148
  664    H    MET  79           H        MET  79  10.450  -2.351  -3.078
  665    HA   MET  79           HA       MET  79   9.381  -2.980  -5.649
  666    HB2  MET  79           HB2      MET  79  10.949  -4.619  -3.628
  667    HB3  MET  79           HB3      MET  79  10.616  -5.173  -5.278
  668    HG2  MET  79           HG2      MET  79  12.056  -2.581  -4.624
  669    HG3  MET  79           HG3      MET  79  12.877  -4.113  -4.883
  670    HE1  MET  79           HE1      MET  79  12.812  -5.470  -7.250
  671    HE2  MET  79           HE2      MET  79  13.422  -4.371  -8.512
  672    HE3  MET  79           HE3      MET  79  14.146  -4.347  -6.895
  673    H    GLN  80           H        GLN  80   8.034  -4.721  -6.287
  674    HA   GLN  80           HA       GLN  80   6.497  -6.168  -4.214
  675    HB2  GLN  80           HB2      GLN  80   5.300  -4.811  -6.681
  676    HB3  GLN  80           HB3      GLN  80   4.460  -5.934  -5.606
  677    HG2  GLN  80           HG2      GLN  80   4.728  -4.343  -3.713
  678    HG3  GLN  80           HG3      GLN  80   5.592  -3.224  -4.766
  679   HE21  GLN  80          HE22      GLN  80   4.266  -1.487  -5.243
  680   HE22  GLN  80          HE21      GLN  80   2.575  -1.620  -5.651
  681    H    ILE  81           H        ILE  81   6.668  -8.319  -4.726
  682    HA   ILE  81           HA       ILE  81   7.621  -9.047  -7.442
  683    HB   ILE  81           HB       ILE  81   8.873 -10.222  -4.951
  684   HG12  ILE  81          HG12      ILE  81   9.781  -7.627  -6.241
  685   HG13  ILE  81          HG13      ILE  81   9.297  -7.906  -4.555
  686   HG21  ILE  81          HG21      ILE  81  10.730 -10.717  -6.497
  687   HG22  ILE  81          HG22      ILE  81   9.233 -11.332  -7.159
  688   HG23  ILE  81          HG23      ILE  81   9.907  -9.826  -7.789
  689   HD11  ILE  81          HD11      ILE  81  11.844  -8.877  -5.874
  690   HD12  ILE  81          HD12      ILE  81  11.651  -7.663  -4.609
  691   HD13  ILE  81          HD13      ILE  81  11.289  -9.365  -4.250
  692    H    ALA  82           H        ALA  82   7.260 -11.250  -7.985
  693    HA   ALA  82           HA       ALA  82   5.793 -12.997  -6.118
  694    HB1  ALA  82           HB1      ALA  82   4.098 -13.542  -7.845
  695    HB2  ALA  82           HB2      ALA  82   4.000 -11.831  -7.396
  696    HB3  ALA  82           HB3      ALA  82   4.781 -12.305  -8.924
  697    H    TYR  83           H        TYR  83   5.796 -15.278  -7.053
  698    HA   TYR  83           HA       TYR  83   8.318 -15.856  -8.447
  699    HD1  TYR  83           HD1      TYR  83   5.428 -16.877  -5.545
  700    HD2  TYR  83           HD2      TYR  83   5.686 -19.161  -9.201
  701    HE1  TYR  83           HE1      TYR  83   3.127 -17.721  -5.179
  702    HE2  TYR  83           HE2      TYR  83   3.413 -20.044  -8.821
  703    HH   TYR  83           HH       TYR  83   1.528 -20.020  -7.435
  704    HB2  TYR  83           HB2      TYR  83   7.671 -18.179  -8.211
  705    HB3  TYR  83           HB3      TYR  83   7.627 -17.352  -6.671
  706    H    SER  84           H        SER  84   8.468 -16.316 -10.655
  707    HA   SER  84           HA       SER  84   6.478 -15.269 -12.336
  708    HG   SER  84           HG       SER  84   9.652 -14.984 -13.543
  709    HB2  SER  84           HB2      SER  84   8.721 -17.183 -13.088
  710    HB3  SER  84           HB3      SER  84   7.866 -16.058 -14.161
  711    H    LYS  85           H        LYS  85   5.314 -16.298 -14.057
  712    HA   LYS  85           HA       LYS  85   4.445 -19.093 -13.746
  713    HB2  LYS  85           HB2      LYS  85   2.554 -16.684 -13.690
  714    HB3  LYS  85           HB3      LYS  85   2.061 -18.380 -13.739
  715    HG2  LYS  85           HG2      LYS  85   3.009 -18.764 -11.500
  716    HG3  LYS  85           HG3      LYS  85   3.627 -17.106 -11.461
  717    HD2  LYS  85           HD2      LYS  85   1.280 -16.241 -11.630
  718    HD3  LYS  85           HD3      LYS  85   0.708 -17.910 -11.500
  719    HE2  LYS  85           HE2      LYS  85   0.612 -16.888  -9.307
  720    HE3  LYS  85           HE3      LYS  85   1.860 -18.133  -9.307
  721    HZ1  LYS  85           HZ1      LYS  85   2.614 -16.130  -8.205
  722    HZ2  LYS  85           HZ2      LYS  85   3.531 -16.342  -9.546
  723    HZ3  LYS  85           HZ3      LYS  85   2.339 -15.214  -9.526
  724    H    SER  86           H        SER  86   3.100 -19.632 -15.759
  725    HA   SER  86           HA       SER  86   4.289 -18.834 -18.146
  726    HG   SER  86           HG       SER  86   2.371 -21.874 -17.925
  727    HB2  SER  86           HB2      SER  86   1.420 -19.783 -17.784
  728    HB3  SER  86           HB3      SER  86   2.445 -19.972 -19.218
  729    H    ASP  87           H        ASP  87   4.137 -17.017 -19.400
  730    HA   ASP  87           HA       ASP  87   1.831 -15.198 -19.254
  731    HB2  ASP  87           HB2      ASP  87   3.246 -14.449 -17.374
  732    HB3  ASP  87           HB3      ASP  87   4.667 -14.415 -18.423
  733    H    SER  88           H        SER  88   1.653 -14.051 -21.183
  734    HA   SER  88           HA       SER  88   2.742 -15.159 -23.447
  735    HG   SER  88           HG       SER  88  -0.426 -13.415 -23.394
  736    HB2  SER  88           HB2      SER  88   1.609 -12.352 -23.223
  737    HB3  SER  88           HB3      SER  88   1.528 -13.453 -24.612
  738    H    ASP  89           H        ASP  89   4.407 -12.805 -21.449
  739    HA   ASP  89           HA       ASP  89   6.093 -11.845 -23.660
  740    HB2  ASP  89           HB2      ASP  89   5.640 -10.408 -21.700
  741    HB3  ASP  89           HB3      ASP  89   6.445 -11.587 -20.654
  742    H    ILE  90           H        ILE  90   6.391 -14.138 -20.917
  743    HA   ILE  90           HA       ILE  90   9.101 -14.840 -21.744
  744    HB   ILE  90           HB       ILE  90   9.151 -16.442 -19.991
  745   HG12  ILE  90          HG12      ILE  90   6.232 -15.860 -19.360
  746   HG13  ILE  90          HG13      ILE  90   6.824 -17.339 -20.125
  747   HG21  ILE  90          HG21      ILE  90   9.002 -14.914 -18.124
  748   HG22  ILE  90          HG22      ILE  90   9.473 -13.993 -19.553
  749   HG23  ILE  90          HG23      ILE  90   7.799 -13.914 -18.964
  750   HD11  ILE  90          HD11      ILE  90   6.505 -17.823 -17.818
  751   HD12  ILE  90          HD12      ILE  90   8.254 -17.761 -18.097
  752   HD13  ILE  90          HD13      ILE  90   7.423 -16.398 -17.302
  753    H    VAL  91           H        VAL  91   5.833 -16.178 -22.270
  754    HA   VAL  91           HA       VAL  91   6.773 -18.565 -23.512
  755    HB   VAL  91           HB       VAL  91   4.176 -17.036 -23.876
  756   HG11  VAL  91          HG11      VAL  91   3.256 -19.132 -24.812
  757   HG12  VAL  91          HG12      VAL  91   4.576 -18.540 -25.830
  758   HG13  VAL  91          HG13      VAL  91   4.861 -19.893 -24.726
  759   HG21  VAL  91          HG21      VAL  91   3.241 -18.749 -22.379
  760   HG22  VAL  91          HG22      VAL  91   4.816 -19.568 -22.278
  761   HG23  VAL  91          HG23      VAL  91   4.598 -17.968 -21.566
  762    H    ALA  92           H        ALA  92   6.153 -15.231 -24.773
  763    HA   ALA  92           HA       ALA  92   6.819 -15.824 -27.488
  764    HB1  ALA  92           HB1      ALA  92   5.636 -13.804 -26.864
  765    HB2  ALA  92           HB2      ALA  92   7.027 -13.230 -25.903
  766    HB3  ALA  92           HB3      ALA  92   7.153 -13.381 -27.660
  767    H    LYS  93           H        LYS  93   8.861 -14.831 -24.675
  768    HA   LYS  93           HA       LYS  93  11.301 -14.584 -26.054
  769    HB2  LYS  93           HB2      LYS  93  10.939 -14.005 -23.645
  770    HB3  LYS  93           HB3      LYS  93  10.910 -15.723 -23.248
  771    HG2  LYS  93           HG2      LYS  93  13.220 -15.975 -24.160
  772    HG3  LYS  93           HG3      LYS  93  13.261 -14.235 -24.480
  773    HD2  LYS  93           HD2      LYS  93  12.913 -13.820 -22.034
  774    HD3  LYS  93           HD3      LYS  93  12.929 -15.558 -21.738
  775    HE2  LYS  93           HE2      LYS  93  15.230 -13.959 -22.966
  776    HE3  LYS  93           HE3      LYS  93  15.107 -14.389 -21.260
  777    HZ1  LYS  93           HZ1      LYS  93  16.511 -15.938 -22.409
  778    HZ2  LYS  93           HZ2      LYS  93  15.184 -16.732 -21.906
  779    HZ3  LYS  93           HZ3      LYS  93  15.356 -16.328 -23.486
  780    H    ILE  94           H        ILE  94   9.949 -17.594 -24.493
  781    HA   ILE  94           HA       ILE  94  12.139 -19.130 -25.544
  782    HB   ILE  94           HB       ILE  94  11.029 -21.104 -24.740
  783   HG12  ILE  94          HG12      ILE  94   8.645 -19.348 -24.088
  784   HG13  ILE  94          HG13      ILE  94   8.691 -20.570 -25.358
  785   HG21  ILE  94          HG21      ILE  94  12.290 -19.558 -23.209
  786   HG22  ILE  94          HG22      ILE  94  10.741 -18.855 -22.697
  787   HG23  ILE  94          HG23      ILE  94  11.102 -20.564 -22.385
  788   HD11  ILE  94          HD11      ILE  94   8.840 -21.066 -22.361
  789   HD12  ILE  94          HD12      ILE  94   7.523 -21.479 -23.467
  790   HD13  ILE  94          HD13      ILE  94   9.081 -22.320 -23.605
  791    H    LYS  95           H        LYS  95   8.978 -18.311 -26.923
  792    HA   LYS  95           HA       LYS  95   9.103 -20.176 -29.085
  793    HB2  LYS  95           HB2      LYS  95   7.113 -18.721 -28.432
  794    HB3  LYS  95           HB3      LYS  95   7.926 -17.368 -29.239
  795    HG2  LYS  95           HG2      LYS  95   7.997 -18.742 -31.348
  796    HG3  LYS  95           HG3      LYS  95   7.143 -20.040 -30.496
  797    HD2  LYS  95           HD2      LYS  95   5.226 -18.452 -30.107
  798    HD3  LYS  95           HD3      LYS  95   6.098 -17.236 -31.075
  799    HE2  LYS  95           HE2      LYS  95   6.193 -18.970 -32.950
  800    HE3  LYS  95           HE3      LYS  95   5.107 -19.981 -31.984
  801    HZ1  LYS  95           HZ1      LYS  95   4.543 -17.280 -33.051
  802    HZ2  LYS  95           HZ2      LYS  95   3.868 -18.683 -33.562
  803    HZ3  LYS  95           HZ3      LYS  95   3.500 -18.120 -32.064
  804    H    GLY  96           H        GLY  96  10.392 -16.820 -28.735
  805    HA2  GLY  96           HA2      GLY  96  12.873 -17.117 -29.490
  806    HA3  GLY  96           HA3      GLY  96  12.145 -17.241 -31.096
  807    H    THR  97           H        THR  97  10.051 -15.089 -29.831
  808    HA   THR  97           HA       THR  97  11.733 -12.699 -30.360
  809    HB   THR  97           HB       THR  97   9.244 -13.441 -31.974
  810    HG1  THR  97           HG1      THR  97  10.857 -14.763 -32.668
  811   HG21  THR  97          HG21      THR  97   9.600 -11.010 -31.823
  812   HG22  THR  97          HG22      THR  97  11.294 -11.199 -32.325
  813   HG23  THR  97          HG23      THR  97   9.972 -11.577 -33.452
  814    H    PHE  98           H        PHE  98  11.262 -11.589 -28.464
  815    HA   PHE  98           HA       PHE  98   9.009 -11.768 -26.861
  816    HD1  PHE  98           HD1      PHE  98   9.944 -11.117 -24.261
  817    HD2  PHE  98           HD2      PHE  98  12.973 -10.141 -27.180
  818    HE1  PHE  98           HE1      PHE  98  11.702 -11.824 -22.678
  819    HE2  PHE  98           HE2      PHE  98  14.729 -10.901 -25.604
  820    HZ   PHE  98           HZ       PHE  98  14.106 -11.717 -23.340
  821    HB2  PHE  98           HB2      PHE  98  10.720  -9.312 -27.434
  822    HB3  PHE  98           HB3      PHE  98   9.580  -9.441 -26.114
  823    H    LYS  99           H        LYS  99   9.446  -9.681 -29.701
  824    HA   LYS  99           HA       LYS  99   7.128  -8.078 -29.330
  825    HB2  LYS  99           HB2      LYS  99   9.104  -7.537 -30.763
  826    HB3  LYS  99           HB3      LYS  99   8.576  -8.768 -31.923
  827    HG2  LYS  99           HG2      LYS  99   6.500  -7.498 -32.354
  828    HG3  LYS  99           HG3      LYS  99   6.922  -6.346 -31.081
  829    HD2  LYS  99           HD2      LYS  99   7.392  -5.365 -33.233
  830    HD3  LYS  99           HD3      LYS  99   8.918  -5.642 -32.381
  831    HE2  LYS  99           HE2      LYS  99   9.289  -7.710 -33.715
  832    HE3  LYS  99           HE3      LYS  99   7.739  -7.468 -34.531
  833    HZ1  LYS  99           HZ1      LYS  99   8.625  -5.408 -35.458
  834    HZ2  LYS  99           HZ2      LYS  99  10.057  -5.629 -34.700
  835    HZ3  LYS  99           HZ3      LYS  99   9.579  -6.662 -35.864
  836    H    GLU 100           H        GLU 100   7.479 -11.341 -30.705
  837    HA   GLU 100           HA       GLU 100   4.899 -11.152 -32.113
  838    HB2  GLU 100           HB2      GLU 100   6.920 -12.372 -33.061
  839    HB3  GLU 100           HB3      GLU 100   6.724 -13.579 -31.780
  840    HG2  GLU 100           HG2      GLU 100   4.326 -13.890 -32.583
  841    HG3  GLU 100           HG3      GLU 100   4.678 -12.798 -33.917
  842    H    ARG 101           H        ARG 101   3.096 -11.318 -30.795
  843    HA   ARG 101           HA       ARG 101   3.168 -12.604 -28.227
  844    HE   ARG 101           HE       ARG 101   2.480 -11.563 -25.842
  845    HB2  ARG 101           HB2      ARG 101   0.785 -12.040 -30.043
  846    HB3  ARG 101           HB3      ARG 101   0.656 -12.535 -28.362
  847    HG2  ARG 101           HG2      ARG 101   2.084  -9.970 -29.195
  848    HG3  ARG 101           HG3      ARG 101   0.359 -10.053 -28.934
  849    HD2  ARG 101           HD2      ARG 101   1.503  -9.151 -26.966
  850    HD3  ARG 101           HD3      ARG 101   0.598 -10.615 -26.617
  851   HH11  ARG 101          HH11      ARG 101   3.601  -8.960 -28.019
  852   HH12  ARG 101          HH12      ARG 101   5.277  -9.332 -27.741
  853   HH21  ARG 101          HH21      ARG 101   4.736 -12.015 -25.565
  854   HH22  ARG 101          HH22      ARG 101   5.894 -11.004 -26.398
  855    HA   PRO 102           HA       PRO 102   3.665 -16.693 -29.162
  856    HB2  PRO 102           HB2      PRO 102   1.233 -17.381 -27.483
  857    HB3  PRO 102           HB3      PRO 102   2.843 -18.168 -27.494
  858    HG2  PRO 102           HG2      PRO 102   2.244 -16.341 -25.586
  859    HG3  PRO 102           HG3      PRO 102   3.843 -16.280 -26.398
  860    HD2  PRO 102           HD2      PRO 102   1.422 -14.561 -26.904
  861    HD3  PRO 102           HD3      PRO 102   3.156 -14.123 -26.846
  862    H    LYS 103           H        LYS 103   0.253 -15.781 -29.581
  863    HA   LYS 103           HA       LYS 103   0.126 -17.526 -31.987
  864    HB2  LYS 103           HB2      LYS 103  -1.086 -18.403 -29.879
  865    HB3  LYS 103           HB3      LYS 103  -2.242 -17.091 -30.131
  866    HG2  LYS 103           HG2      LYS 103  -2.717 -18.020 -32.425
  867    HG3  LYS 103           HG3      LYS 103  -1.528 -19.299 -32.128
  868    HD2  LYS 103           HD2      LYS 103  -2.878 -20.111 -30.212
  869    HD3  LYS 103           HD3      LYS 103  -4.065 -18.819 -30.501
  870    HE2  LYS 103           HE2      LYS 103  -4.485 -19.723 -32.779
  871    HE3  LYS 103           HE3      LYS 103  -3.303 -21.007 -32.492
  872    HZ1  LYS 103           HZ1      LYS 103  -5.820 -20.639 -30.971
  873    HZ2  LYS 103           HZ2      LYS 103  -5.556 -21.775 -32.106
  874    HZ3  LYS 103           HZ3      LYS 103  -4.728 -21.826 -30.705
  875    H    LYS 104           H        LYS 104   0.977 -14.850 -31.966
  876    HA   LYS 104           HA       LYS 104  -0.990 -12.939 -32.686
  877    HB2  LYS 104           HB2      LYS 104   1.433 -12.464 -32.305
  878    HB3  LYS 104           HB3      LYS 104   1.826 -13.318 -33.804
  879    HG2  LYS 104           HG2      LYS 104   0.495 -11.670 -35.090
  880    HG3  LYS 104           HG3      LYS 104   0.054 -10.840 -33.584
  881    HD2  LYS 104           HD2      LYS 104   2.462 -10.373 -33.156
  882    HD3  LYS 104           HD3      LYS 104   2.892 -11.150 -34.685
  883    HE2  LYS 104           HE2      LYS 104   1.080  -8.706 -34.384
  884    HE3  LYS 104           HE3      LYS 104   2.800  -8.640 -34.772
  885    HZ1  LYS 104           HZ1      LYS 104   1.476  -8.479 -36.758
  886    HZ2  LYS 104           HZ2      LYS 104   2.326  -9.864 -36.816
  887    HZ3  LYS 104           HZ3      LYS 104   0.725  -9.894 -36.474
  Start of MODEL    6
    1    HA   MET   1           HA       MET   1   0.818 -18.599   2.162
    2    H1   MET   1           H1       MET   1   1.078 -18.733   4.518
    3    H2   MET   1           H2       MET   1   0.760 -17.143   4.708
    4    H3   MET   1           H3       MET   1  -0.415 -18.155   4.166
    5    HB2  MET   1           HB2      MET   1  -0.852 -16.813   2.081
    6    HB3  MET   1           HB3      MET   1   0.317 -15.637   2.696
    7    HG2  MET   1           HG2      MET   1  -0.008 -15.445   0.267
    8    HG3  MET   1           HG3      MET   1   1.657 -15.824   0.679
    9    HE1  MET   1           HE1      MET   1   2.420 -16.535  -1.647
   10    HE2  MET   1           HE2      MET   1   1.492 -17.592  -2.734
   11    HE3  MET   1           HE3      MET   1   0.836 -16.007  -2.263
   12    H    GLU   2           H        GLU   2   2.763 -18.657   1.104
   13    HA   GLU   2           HA       GLU   2   4.823 -16.703   1.629
   14    HB2  GLU   2           HB2      GLU   2   6.589 -18.322   2.066
   15    HB3  GLU   2           HB3      GLU   2   5.392 -18.361   3.348
   16    HG2  GLU   2           HG2      GLU   2   4.392 -20.428   2.336
   17    HG3  GLU   2           HG3      GLU   2   5.647 -20.402   1.094
   18    H    MET   3           H        MET   3   6.164 -16.541  -0.289
   19    HA   MET   3           HA       MET   3   4.707 -17.388  -2.629
   20    HB2  MET   3           HB2      MET   3   7.297 -15.845  -2.212
   21    HB3  MET   3           HB3      MET   3   6.713 -16.309  -3.809
   22    HG2  MET   3           HG2      MET   3   5.934 -14.085  -3.410
   23    HG3  MET   3           HG3      MET   3   4.566 -15.176  -3.410
   24    HE1  MET   3           HE1      MET   3   6.223 -12.875   0.259
   25    HE2  MET   3           HE2      MET   3   7.192 -14.128  -0.543
   26    HE3  MET   3           HE3      MET   3   6.743 -12.649  -1.424
   27    H    LEU   4           H        LEU   4   5.026 -19.088  -3.952
   28    HA   LEU   4           HA       LEU   4   6.405 -21.303  -2.868
   29    HG   LEU   4           HG       LEU   4   3.451 -20.613  -4.040
   30    HB2  LEU   4           HB2      LEU   4   5.257 -20.950  -5.667
   31    HB3  LEU   4           HB3      LEU   4   5.693 -22.481  -4.919
   32   HD11  LEU   4          HD11      LEU   4   3.011 -21.903  -6.099
   33   HD12  LEU   4          HD12      LEU   4   3.391 -23.413  -5.244
   34   HD13  LEU   4          HD13      LEU   4   1.983 -22.438  -4.763
   35   HD21  LEU   4          HD21      LEU   4   4.351 -23.260  -2.818
   36   HD22  LEU   4          HD22      LEU   4   4.338 -21.663  -2.028
   37   HD23  LEU   4          HD23      LEU   4   2.815 -22.439  -2.456
   38    HA   PRO   5           HA       PRO   5  10.467 -20.998  -4.848
   39    HB2  PRO   5           HB2      PRO   5  10.220 -24.000  -4.951
   40    HB3  PRO   5           HB3      PRO   5  11.601 -22.994  -4.412
   41    HG2  PRO   5           HG2      PRO   5   9.990 -24.186  -2.591
   42    HG3  PRO   5           HG3      PRO   5  10.554 -22.501  -2.344
   43    HD2  PRO   5           HD2      PRO   5   7.870 -23.448  -3.382
   44    HD3  PRO   5           HD3      PRO   5   8.245 -22.157  -2.197
   45    H    ASN   6           H        ASN   6  11.003 -20.699  -6.901
   46    HA   ASN   6           HA       ASN   6  10.360 -22.512  -9.052
   47    HB2  ASN   6           HB2      ASN   6   8.329 -21.016  -9.118
   48    HB3  ASN   6           HB3      ASN   6   9.399 -19.607  -9.133
   49   HD21  ASN   6          HD22      ASN   6   9.668 -18.754 -11.190
   50   HD22  ASN   6          HD21      ASN   6   9.630 -19.718 -12.661
   51    H    GLN   7           H        GLN   7  12.017 -22.030 -10.792
   52    HA   GLN   7           HA       GLN   7  14.333 -20.856  -9.573
   53    HB2  GLN   7           HB2      GLN   7  14.060 -22.796 -11.411
   54    HB3  GLN   7           HB3      GLN   7  14.321 -21.438 -12.520
   55    HG2  GLN   7           HG2      GLN   7  16.363 -20.860 -11.049
   56    HG3  GLN   7           HG3      GLN   7  16.131 -22.409 -10.255
   57   HE21  GLN   7          HE22      GLN   7  18.326 -21.235 -12.032
   58   HE22  GLN   7          HE21      GLN   7  18.581 -22.462 -13.264
   59    H    THR   8           H        THR   8  11.778 -19.265 -11.063
   60    HA   THR   8           HA       THR   8  13.459 -16.922 -11.737
   61    HB   THR   8           HB       THR   8  10.982 -17.730 -13.286
   62    HG1  THR   8           HG1      THR   8  12.255 -18.753 -14.757
   63   HG21  THR   8          HG21      THR   8  13.373 -16.009 -14.053
   64   HG22  THR   8          HG22      THR   8  11.912 -16.270 -15.030
   65   HG23  THR   8          HG23      THR   8  11.845 -15.362 -13.505
   66    H    ILE   9           H        ILE   9  12.564 -14.957 -11.185
   67    HA   ILE   9           HA       ILE   9   9.994 -14.987  -9.708
   68    HB   ILE   9           HB       ILE   9  10.851 -13.606  -7.980
   69   HG12  ILE   9          HG12      ILE   9  13.503 -13.576  -9.454
   70   HG13  ILE   9          HG13      ILE   9  12.405 -12.204  -9.238
   71   HG21  ILE   9          HG21      ILE   9  12.414 -15.144  -6.873
   72   HG22  ILE   9          HG22      ILE   9  11.228 -16.081  -7.796
   73   HG23  ILE   9          HG23      ILE   9  12.881 -15.840  -8.414
   74   HD11  ILE   9          HD11      ILE   9  14.084 -13.574  -7.109
   75   HD12  ILE   9          HD12      ILE   9  14.165 -11.899  -7.677
   76   HD13  ILE   9          HD13      ILE   9  12.769 -12.442  -6.725
   77    H    TYR  10           H        TYR  10   9.010 -12.891  -9.613
   78    HA   TYR  10           HA       TYR  10   9.268 -11.401 -12.183
   79    HD1  TYR  10           HD1      TYR  10   7.629 -10.247 -13.534
   80    HD2  TYR  10           HD2      TYR  10   4.705 -12.132 -10.975
   81    HE1  TYR  10           HE1      TYR  10   5.828  -9.009 -14.673
   82    HE2  TYR  10           HE2      TYR  10   2.903 -10.878 -12.093
   83    HH   TYR  10           HH       TYR  10   2.346  -9.433 -13.814
   84    HB2  TYR  10           HB2      TYR  10   7.493 -13.014 -12.239
   85    HB3  TYR  10           HB3      TYR  10   6.946 -12.592 -10.628
   86    H    ILE  11           H        ILE  11   9.831  -9.375 -11.724
   87    HA   ILE  11           HA       ILE  11   9.360  -8.233  -9.012
   88    HB   ILE  11           HB       ILE  11  11.378  -7.660 -11.227
   89   HG12  ILE  11          HG12      ILE  11  11.819  -8.566  -8.343
   90   HG13  ILE  11          HG13      ILE  11  11.740  -9.678  -9.706
   91   HG21  ILE  11          HG21      ILE  11  12.356  -5.931  -9.767
   92   HG22  ILE  11          HG22      ILE  11  10.720  -5.503 -10.193
   93   HG23  ILE  11          HG23      ILE  11  11.045  -6.166  -8.580
   94   HD11  ILE  11          HD11      ILE  11  13.856  -7.542  -9.247
   95   HD12  ILE  11          HD12      ILE  11  14.044  -9.300  -9.207
   96   HD13  ILE  11          HD13      ILE  11  13.695  -8.490 -10.747
   97    H    ASN  12           H        ASN  12   8.260  -6.314  -8.856
   98    HA   ASN  12           HA       ASN  12   7.055  -5.020 -11.230
   99    HB2  ASN  12           HB2      ASN  12   5.590  -6.405  -8.927
  100    HB3  ASN  12           HB3      ASN  12   4.836  -5.181  -9.936
  101   HD21  ASN  12          HD22      ASN  12   5.993  -8.540  -9.898
  102   HD22  ASN  12          HD21      ASN  12   5.363  -8.950 -11.475
  103    H    ASN  13           H        ASN  13   5.838  -3.046 -10.438
  104    HA   ASN  13           HA       ASN  13   6.008  -0.971  -9.651
  105    HB2  ASN  13           HB2      ASN  13   5.116  -2.129  -7.579
  106    HB3  ASN  13           HB3      ASN  13   6.769  -2.133  -6.954
  107   HD21  ASN  13          HD22      ASN  13   6.915  -0.504  -5.403
  108   HD22  ASN  13          HD21      ASN  13   6.145   1.066  -5.550
  109    H    LEU  14           H        LEU  14   8.285  -2.131 -10.914
  110    HA   LEU  14           HA       LEU  14  10.765  -1.352  -9.611
  111    HG   LEU  14           HG       LEU  14  12.506  -2.875 -10.706
  112    HB2  LEU  14           HB2      LEU  14  10.173  -3.191 -11.414
  113    HB3  LEU  14           HB3      LEU  14  10.308  -1.874 -12.566
  114   HD11  LEU  14          HD11      LEU  14  13.435  -3.874 -12.741
  115   HD12  LEU  14          HD12      LEU  14  11.810  -4.487 -12.453
  116   HD13  LEU  14          HD13      LEU  14  12.081  -3.251 -13.703
  117   HD21  LEU  14          HD21      LEU  14  14.030  -1.563 -12.247
  118   HD22  LEU  14          HD22      LEU  14  12.590  -0.773 -12.916
  119   HD23  LEU  14          HD23      LEU  14  13.029  -0.565 -11.203
  120    H    ASN  15           H        ASN  15  11.745   0.701  -9.825
  121    HA   ASN  15           HA       ASN  15  10.098   2.879 -10.692
  122    HB2  ASN  15           HB2      ASN  15  11.830   3.009  -8.891
  123    HB3  ASN  15           HB3      ASN  15  13.090   2.952 -10.130
  124   HD21  ASN  15          HD22      ASN  15  12.274   5.154  -8.169
  125   HD22  ASN  15          HD21      ASN  15  11.957   6.539  -9.182
  126    H    GLU  16           H        GLU  16   9.614   3.298 -12.726
  127    HA   GLU  16           HA       GLU  16  10.909   2.268 -14.964
  128    HB2  GLU  16           HB2      GLU  16   9.384   3.651 -16.263
  129    HB3  GLU  16           HB3      GLU  16   8.551   2.919 -14.892
  130    HG2  GLU  16           HG2      GLU  16   8.727   5.068 -13.637
  131    HG3  GLU  16           HG3      GLU  16   9.568   5.798 -15.004
  132    H    LYS  17           H        LYS  17  12.096   4.987 -13.139
  133    HA   LYS  17           HA       LYS  17  13.295   6.345 -15.361
  134    HB2  LYS  17           HB2      LYS  17  14.488   7.607 -13.899
  135    HB3  LYS  17           HB3      LYS  17  12.973   7.274 -13.069
  136    HG2  LYS  17           HG2      LYS  17  14.206   5.455 -11.758
  137    HG3  LYS  17           HG3      LYS  17  15.700   5.996 -12.553
  138    HD2  LYS  17           HD2      LYS  17  15.329   8.282 -11.732
  139    HD3  LYS  17           HD3      LYS  17  13.857   7.750 -10.895
  140    HE2  LYS  17           HE2      LYS  17  15.185   6.204  -9.490
  141    HE3  LYS  17           HE3      LYS  17  16.658   6.637 -10.369
  142    HZ1  LYS  17           HZ1      LYS  17  16.498   7.848  -8.286
  143    HZ2  LYS  17           HZ2      LYS  17  16.433   8.898  -9.525
  144    HZ3  LYS  17           HZ3      LYS  17  15.071   8.515  -8.709
  145    H    ILE  18           H        ILE  18  14.051   3.347 -13.740
  146    HA   ILE  18           HA       ILE  18  16.893   3.325 -14.338
  147    HB   ILE  18           HB       ILE  18  14.957   1.161 -13.394
  148   HG12  ILE  18          HG12      ILE  18  14.941   2.936 -11.756
  149   HG13  ILE  18          HG13      ILE  18  15.850   1.583 -11.124
  150   HG21  ILE  18          HG21      ILE  18  16.889  -0.056 -12.556
  151   HG22  ILE  18          HG22      ILE  18  17.024   0.193 -14.301
  152   HG23  ILE  18          HG23      ILE  18  17.985   1.183 -13.188
  153   HD11  ILE  18          HD11      ILE  18  17.979   2.783 -11.580
  154   HD12  ILE  18          HD12      ILE  18  17.076   4.133 -12.297
  155   HD13  ILE  18          HD13      ILE  18  16.887   3.762 -10.584
  156    H    LYS  19           H        LYS  19  17.697   2.950 -16.350
  157    HA   LYS  19           HA       LYS  19  15.994   1.712 -18.404
  158    HB2  LYS  19           HB2      LYS  19  17.638   2.292 -19.967
  159    HB3  LYS  19           HB3      LYS  19  17.602   3.626 -18.815
  160    HG2  LYS  19           HG2      LYS  19  19.600   2.475 -17.672
  161    HG3  LYS  19           HG3      LYS  19  19.701   1.442 -19.094
  162    HD2  LYS  19           HD2      LYS  19  19.915   4.481 -19.078
  163    HD3  LYS  19           HD3      LYS  19  21.267   3.346 -19.197
  164    HE2  LYS  19           HE2      LYS  19  20.335   2.459 -21.336
  165    HE3  LYS  19           HE3      LYS  19  19.001   3.614 -21.231
  166    HZ1  LYS  19           HZ1      LYS  19  21.865   4.342 -21.469
  167    HZ2  LYS  19           HZ2      LYS  19  20.760   4.429 -22.662
  168    HZ3  LYS  19           HZ3      LYS  19  20.630   5.409 -21.370
  169    H    LYS  20           H        LYS  20  17.179  -0.057 -19.811
  170    HA   LYS  20           HA       LYS  20  17.107  -2.452 -18.355
  171    HB2  LYS  20           HB2      LYS  20  16.812  -2.152 -20.857
  172    HB3  LYS  20           HB3      LYS  20  18.574  -1.959 -20.988
  173    HG2  LYS  20           HG2      LYS  20  18.850  -4.262 -20.005
  174    HG3  LYS  20           HG3      LYS  20  17.088  -4.425 -19.957
  175    HD2  LYS  20           HD2      LYS  20  17.008  -4.164 -22.434
  176    HD3  LYS  20           HD3      LYS  20  18.770  -3.949 -22.467
  177    HE2  LYS  20           HE2      LYS  20  19.036  -6.230 -21.463
  178    HE3  LYS  20           HE3      LYS  20  17.286  -6.443 -21.519
  179    HZ1  LYS  20           HZ1      LYS  20  19.036  -6.058 -23.884
  180    HZ2  LYS  20           HZ2      LYS  20  18.354  -7.462 -23.424
  181    HZ3  LYS  20           HZ3      LYS  20  17.412  -6.240 -23.945
  182    H    GLU  21           H        GLU  21  19.975  -0.650 -19.530
  183    HA   GLU  21           HA       GLU  21  21.939  -2.444 -18.598
  184    HB2  GLU  21           HB2      GLU  21  22.329  -0.727 -20.245
  185    HB3  GLU  21           HB3      GLU  21  21.941   0.560 -19.101
  186    HG2  GLU  21           HG2      GLU  21  23.912   0.073 -17.756
  187    HG3  GLU  21           HG3      GLU  21  24.281  -1.358 -18.731
  188    H    GLU  22           H        GLU  22  20.388   0.353 -16.968
  189    HA   GLU  22           HA       GLU  22  22.028   0.221 -14.622
  190    HB2  GLU  22           HB2      GLU  22  19.319   1.464 -15.188
  191    HB3  GLU  22           HB3      GLU  22  20.175   1.649 -13.645
  192    HG2  GLU  22           HG2      GLU  22  22.029   2.767 -14.699
  193    HG3  GLU  22           HG3      GLU  22  21.378   2.497 -16.309
  194    H    LEU  23           H        LEU  23  18.872  -1.158 -15.531
  195    HA   LEU  23           HA       LEU  23  18.210  -2.372 -13.048
  196    HG   LEU  23           HG       LEU  23  15.448  -4.024 -15.235
  197    HB2  LEU  23           HB2      LEU  23  16.545  -2.055 -14.699
  198    HB3  LEU  23           HB3      LEU  23  17.472  -2.813 -15.964
  199   HD11  LEU  23          HD11      LEU  23  17.269  -5.156 -16.440
  200   HD12  LEU  23          HD12      LEU  23  17.940  -5.691 -14.907
  201   HD13  LEU  23          HD13      LEU  23  16.329  -6.225 -15.375
  202   HD21  LEU  23          HD21      LEU  23  17.013  -4.709 -12.716
  203   HD22  LEU  23          HD22      LEU  23  15.688  -3.543 -12.788
  204   HD23  LEU  23          HD23      LEU  23  15.387  -5.257 -13.158
  205    H    LYS  24           H        LYS  24  19.984  -3.724 -15.906
  206    HA   LYS  24           HA       LYS  24  20.497  -6.251 -14.716
  207    HB2  LYS  24           HB2      LYS  24  22.066  -4.658 -16.788
  208    HB3  LYS  24           HB3      LYS  24  22.518  -6.289 -16.275
  209    HG2  LYS  24           HG2      LYS  24  20.245  -7.105 -16.961
  210    HG3  LYS  24           HG3      LYS  24  19.910  -5.518 -17.651
  211    HD2  LYS  24           HD2      LYS  24  22.149  -7.427 -18.455
  212    HD3  LYS  24           HD3      LYS  24  20.655  -7.139 -19.354
  213    HE2  LYS  24           HE2      LYS  24  21.307  -4.789 -19.749
  214    HE3  LYS  24           HE3      LYS  24  22.776  -5.015 -18.788
  215    HZ1  LYS  24           HZ1      LYS  24  23.547  -6.619 -20.420
  216    HZ2  LYS  24           HZ2      LYS  24  22.196  -6.445 -21.319
  217    HZ3  LYS  24           HZ3      LYS  24  23.235  -5.201 -21.151
  218    H    LYS  25           H        LYS  25  22.511  -3.276 -14.719
  219    HA   LYS  25           HA       LYS  25  24.631  -4.322 -13.193
  220    HB2  LYS  25           HB2      LYS  25  24.740  -2.177 -14.400
  221    HB3  LYS  25           HB3      LYS  25  23.521  -1.480 -13.337
  222    HG2  LYS  25           HG2      LYS  25  25.736  -0.683 -12.747
  223    HG3  LYS  25           HG3      LYS  25  25.053  -1.617 -11.417
  224    HD2  LYS  25           HD2      LYS  25  26.459  -3.561 -12.030
  225    HD3  LYS  25           HD3      LYS  25  27.081  -2.675 -13.442
  226    HE2  LYS  25           HE2      LYS  25  28.007  -0.937 -11.914
  227    HE3  LYS  25           HE3      LYS  25  27.397  -1.836 -10.520
  228    HZ1  LYS  25           HZ1      LYS  25  28.876  -3.664 -11.142
  229    HZ2  LYS  25           HZ2      LYS  25  29.436  -2.828 -12.431
  230    HZ3  LYS  25           HZ3      LYS  25  29.730  -2.296 -10.921
  231    H    SER  26           H        SER  26  21.648  -2.627 -12.056
  232    HA   SER  26           HA       SER  26  22.334  -2.657  -9.333
  233    HG   SER  26           HG       SER  26  20.694  -0.987 -11.396
  234    HB2  SER  26           HB2      SER  26  19.577  -2.688 -10.601
  235    HB3  SER  26           HB3      SER  26  19.961  -2.191  -8.936
  236    H    LEU  27           H        LEU  27  20.401  -5.028 -11.196
  237    HA   LEU  27           HA       LEU  27  19.770  -6.757  -9.029
  238    HG   LEU  27           HG       LEU  27  18.107  -5.998 -11.167
  239    HB2  LEU  27           HB2      LEU  27  20.224  -7.239 -11.986
  240    HB3  LEU  27           HB3      LEU  27  19.754  -8.545 -10.905
  241   HD11  LEU  27          HD11      LEU  27  16.695  -7.357 -12.728
  242   HD12  LEU  27          HD12      LEU  27  18.328  -7.041 -13.336
  243   HD13  LEU  27          HD13      LEU  27  17.948  -8.631 -12.683
  244   HD21  LEU  27          HD21      LEU  27  16.284  -7.485 -10.340
  245   HD22  LEU  27          HD22      LEU  27  17.473  -8.784 -10.099
  246   HD23  LEU  27          HD23      LEU  27  17.579  -7.277  -9.163
  247    H    TYR  28           H        TYR  28  22.570  -6.919 -11.355
  248    HA   TYR  28           HA       TYR  28  23.657  -9.177  -9.997
  249    HD1  TYR  28           HD1      TYR  28  24.344 -10.703 -12.363
  250    HD2  TYR  28           HD2      TYR  28  27.421  -8.178 -10.692
  251    HE1  TYR  28           HE1      TYR  28  25.924 -12.609 -12.406
  252    HE2  TYR  28           HE2      TYR  28  29.001 -10.082 -10.708
  253    HH   TYR  28           HH       TYR  28  29.309 -12.338 -11.223
  254    HB2  TYR  28           HB2      TYR  28  24.144  -8.246 -12.374
  255    HB3  TYR  28           HB3      TYR  28  25.323  -7.205 -11.587
  256    H    ALA  29           H        ALA  29  23.956  -5.697  -9.435
  257    HA   ALA  29           HA       ALA  29  26.217  -5.843  -7.678
  258    HB1  ALA  29           HB1      ALA  29  25.686  -3.494  -7.175
  259    HB2  ALA  29           HB2      ALA  29  25.666  -3.797  -8.919
  260    HB3  ALA  29           HB3      ALA  29  24.134  -3.647  -8.018
  261    H    ILE  30           H        ILE  30  22.685  -6.131  -7.038
  262    HA   ILE  30           HA       ILE  30  23.477  -6.645  -4.200
  263    HB   ILE  30           HB       ILE  30  21.228  -5.612  -3.571
  264   HG12  ILE  30          HG12      ILE  30  21.690  -3.901  -6.030
  265   HG13  ILE  30          HG13      ILE  30  20.473  -5.186  -5.952
  266   HG21  ILE  30          HG21      ILE  30  23.516  -4.807  -2.933
  267   HG22  ILE  30          HG22      ILE  30  23.525  -3.769  -4.374
  268   HG23  ILE  30          HG23      ILE  30  22.349  -3.498  -3.071
  269   HD11  ILE  30          HD11      ILE  30  19.345  -4.022  -4.090
  270   HD12  ILE  30          HD12      ILE  30  20.561  -2.721  -4.156
  271   HD13  ILE  30          HD13      ILE  30  19.490  -2.985  -5.529
  272    H    PHE  31           H        PHE  31  20.959  -7.477  -6.657
  273    HA   PHE  31           HA       PHE  31  19.542  -9.178  -4.818
  274    HD1  PHE  31           HD1      PHE  31  18.469  -6.683  -6.478
  275    HD2  PHE  31           HD2      PHE  31  16.734 -10.622  -6.797
  276    HE1  PHE  31           HE1      PHE  31  16.214  -5.736  -6.100
  277    HE2  PHE  31           HE2      PHE  31  14.490  -9.669  -6.411
  278    HZ   PHE  31           HZ       PHE  31  14.219  -7.225  -6.056
  279    HB2  PHE  31           HB2      PHE  31  19.560  -8.860  -7.803
  280    HB3  PHE  31           HB3      PHE  31  19.003 -10.368  -7.141
  281    H    SER  32           H        SER  32  22.380  -9.771  -6.955
  282    HA   SER  32           HA       SER  32  22.413 -12.541  -6.689
  283    HG   SER  32           HG       SER  32  24.400 -11.227  -9.173
  284    HB2  SER  32           HB2      SER  32  24.666 -10.546  -7.047
  285    HB3  SER  32           HB3      SER  32  24.901 -12.306  -7.132
  286    H    GLN  33           H        GLN  33  23.504 -10.163  -4.219
  287    HA   GLN  33           HA       GLN  33  24.907 -12.044  -2.623
  288    HB2  GLN  33           HB2      GLN  33  23.463  -9.459  -1.882
  289    HB3  GLN  33           HB3      GLN  33  24.377 -10.433  -0.740
  290    HG2  GLN  33           HG2      GLN  33  25.982  -8.952  -1.297
  291    HG3  GLN  33           HG3      GLN  33  26.366 -10.229  -2.436
  292   HE21  GLN  33          HE22      GLN  33  26.157  -6.932  -2.178
  293   HE22  GLN  33          HE21      GLN  33  25.735  -6.537  -3.842
  294    H    PHE  34           H        PHE  34  21.538 -11.992  -3.301
  295    HA   PHE  34           HA       PHE  34  20.931 -13.525  -0.824
  296    HD1  PHE  34           HD2      PHE  34  19.545 -12.021   1.024
  297    HD2  PHE  34           HD1      PHE  34  19.918  -9.790  -2.647
  298    HE1  PHE  34           HE2      PHE  34  20.071  -9.970   2.318
  299    HE2  PHE  34           HE1      PHE  34  20.443  -7.745  -1.354
  300    HZ   PHE  34           HZ       PHE  34  20.520  -7.826   1.135
  301    HB2  PHE  34           HB2      PHE  34  19.056 -12.044  -2.697
  302    HB3  PHE  34           HB3      PHE  34  18.613 -12.862  -1.204
  303    H    GLY  35           H        GLY  35  21.981 -14.343  -3.808
  304    HA2  GLY  35           HA2      GLY  35  21.333 -16.969  -3.554
  305    HA3  GLY  35           HA3      GLY  35  19.938 -16.352  -4.448
  306    H    GLN  36           H        GLN  36  22.704 -14.663  -5.415
  307    HA   GLN  36           HA       GLN  36  23.679 -14.390  -7.349
  308    HB2  GLN  36           HB2      GLN  36  24.977 -16.321  -6.651
  309    HB3  GLN  36           HB3      GLN  36  23.860 -17.408  -7.477
  310    HG2  GLN  36           HG2      GLN  36  25.894 -17.017  -8.800
  311    HG3  GLN  36           HG3      GLN  36  24.459 -16.472  -9.647
  312   HE21  GLN  36          HE22      GLN  36  24.611 -14.429 -10.578
  313   HE22  GLN  36          HE21      GLN  36  25.742 -13.190 -10.073
  314    H    ILE  37           H        ILE  37  22.594 -13.380  -8.851
  315    HA   ILE  37           HA       ILE  37  20.256 -14.307 -10.237
  316    HB   ILE  37           HB       ILE  37  22.439 -12.269 -10.859
  317   HG12  ILE  37          HG12      ILE  37  20.898 -11.809  -8.866
  318   HG13  ILE  37          HG13      ILE  37  21.058 -10.561 -10.083
  319   HG21  ILE  37          HG21      ILE  37  20.844 -11.300 -12.515
  320   HG22  ILE  37          HG22      ILE  37  21.560 -12.832 -13.004
  321   HG23  ILE  37          HG23      ILE  37  19.882 -12.789 -12.416
  322   HD11  ILE  37          HD11      ILE  37  18.712 -12.496  -9.963
  323   HD12  ILE  37          HD12      ILE  37  18.726 -10.852  -9.284
  324   HD13  ILE  37          HD13      ILE  37  18.873 -11.073 -11.021
  325    H    LEU  38           H        LEU  38  20.136 -15.544 -12.121
  326    HA   LEU  38           HA       LEU  38  22.669 -16.633 -13.237
  327    HG   LEU  38           HG       LEU  38  21.089 -18.571 -15.195
  328    HB2  LEU  38           HB2      LEU  38  21.191 -18.286 -12.154
  329    HB3  LEU  38           HB3      LEU  38  19.854 -17.781 -13.193
  330   HD11  LEU  38          HD11      LEU  38  23.177 -19.505 -13.168
  331   HD12  LEU  38          HD12      LEU  38  23.113 -20.009 -14.872
  332   HD13  LEU  38          HD13      LEU  38  23.422 -18.319 -14.471
  333   HD21  LEU  38          HD21      LEU  38  19.531 -20.056 -14.022
  334   HD22  LEU  38          HD22      LEU  38  20.877 -20.979 -14.705
  335   HD23  LEU  38          HD23      LEU  38  20.836 -20.626 -12.960
  336    H    ASP  39           H        ASP  39  19.451 -15.142 -14.013
  337    HA   ASP  39           HA       ASP  39  20.660 -13.951 -16.363
  338    HB2  ASP  39           HB2      ASP  39  20.004 -16.185 -17.280
  339    HB3  ASP  39           HB3      ASP  39  18.340 -15.872 -16.814
  340    H    ILE  40           H        ILE  40  18.989 -12.464 -17.467
  341    HA   ILE  40           HA       ILE  40  17.055 -11.335 -15.507
  342    HB   ILE  40           HB       ILE  40  19.314  -9.835 -16.901
  343   HG12  ILE  40          HG12      ILE  40  19.008 -10.475 -13.934
  344   HG13  ILE  40          HG13      ILE  40  20.195 -11.185 -15.026
  345   HG21  ILE  40          HG21      ILE  40  17.348  -8.422 -16.716
  346   HG22  ILE  40          HG22      ILE  40  17.174  -8.817 -14.996
  347   HG23  ILE  40          HG23      ILE  40  18.556  -7.875 -15.579
  348   HD11  ILE  40          HD11      ILE  40  21.173  -8.890 -15.399
  349   HD12  ILE  40          HD12      ILE  40  20.158  -8.335 -14.044
  350   HD13  ILE  40          HD13      ILE  40  21.382  -9.567 -13.779
  351    H    VAL  41           H        VAL  41  15.277 -10.444 -16.544
  352    HA   VAL  41           HA       VAL  41  15.332 -10.040 -19.483
  353    HB   VAL  41           HB       VAL  41  13.213 -11.571 -17.924
  354   HG11  VAL  41          HG11      VAL  41  12.249 -10.284 -19.808
  355   HG12  VAL  41          HG12      VAL  41  13.451 -10.988 -20.912
  356   HG13  VAL  41          HG13      VAL  41  12.218 -12.014 -20.146
  357   HG21  VAL  41          HG21      VAL  41  15.252 -12.598 -19.932
  358   HG22  VAL  41          HG22      VAL  41  15.149 -13.017 -18.206
  359   HG23  VAL  41          HG23      VAL  41  13.870 -13.524 -19.304
  360    H    ALA  42           H        ALA  42  15.327  -7.838 -19.334
  361    HA   ALA  42           HA       ALA  42  12.771  -6.598 -18.680
  362    HB1  ALA  42           HB1      ALA  42  13.867  -4.678 -17.597
  363    HB2  ALA  42           HB2      ALA  42  14.214  -6.150 -16.668
  364    HB3  ALA  42           HB3      ALA  42  15.446  -5.463 -17.760
  365    H    LEU  43           H        LEU  43  12.741  -4.453 -19.876
  366    HA   LEU  43           HA       LEU  43  14.643  -4.227 -22.137
  367    HG   LEU  43           HG       LEU  43  12.068  -5.815 -24.413
  368    HB2  LEU  43           HB2      LEU  43  11.608  -4.455 -22.392
  369    HB3  LEU  43           HB3      LEU  43  12.617  -3.743 -23.616
  370   HD11  LEU  43          HD11      LEU  43  14.433  -5.163 -24.744
  371   HD12  LEU  43          HD12      LEU  43  14.888  -6.166 -23.342
  372   HD13  LEU  43          HD13      LEU  43  14.181  -6.916 -24.785
  373   HD21  LEU  43          HD21      LEU  43  12.308  -7.950 -23.383
  374   HD22  LEU  43          HD22      LEU  43  13.074  -7.268 -21.947
  375   HD23  LEU  43          HD23      LEU  43  11.370  -6.916 -22.301
  376    H    LYS  44           H        LYS  44  14.282  -2.050 -23.228
  377    HA   LYS  44           HA       LYS  44  13.785   0.015 -21.250
  378    HB2  LYS  44           HB2      LYS  44  14.191   1.600 -23.056
  379    HB3  LYS  44           HB3      LYS  44  15.452   0.371 -22.973
  380    HG2  LYS  44           HG2      LYS  44  14.466  -0.805 -24.923
  381    HG3  LYS  44           HG3      LYS  44  13.129   0.349 -24.960
  382    HD2  LYS  44           HD2      LYS  44  14.719   0.906 -26.682
  383    HD3  LYS  44           HD3      LYS  44  14.695   2.188 -25.464
  384    HE2  LYS  44           HE2      LYS  44  16.781   1.301 -24.463
  385    HE3  LYS  44           HE3      LYS  44  16.774  -0.048 -25.609
  386    HZ1  LYS  44           HZ1      LYS  44  18.259   1.714 -26.321
  387    HZ2  LYS  44           HZ2      LYS  44  17.053   1.561 -27.402
  388    HZ3  LYS  44           HZ3      LYS  44  17.055   2.809 -26.347
  389    H    THR  45           H        THR  45  11.640  -1.769 -23.383
  390    HA   THR  45           HA       THR  45   9.633   0.254 -23.700
  391    HB   THR  45           HB       THR  45   8.224  -1.895 -24.088
  392    HG1  THR  45           HG1      THR  45   9.370  -3.774 -24.282
  393   HG21  THR  45          HG21      THR  45   9.266  -2.319 -26.276
  394   HG22  THR  45          HG22      THR  45   9.250  -0.579 -25.938
  395   HG23  THR  45          HG23      THR  45  10.759  -1.506 -25.757
  396    H    LEU  46           H        LEU  46   8.019   0.866 -22.273
  397    HA   LEU  46           HA       LEU  46   8.493   0.692 -19.572
  398    HG   LEU  46           HG       LEU  46   5.591   0.756 -18.448
  399    HB2  LEU  46           HB2      LEU  46   7.030   2.381 -20.614
  400    HB3  LEU  46           HB3      LEU  46   5.821   1.138 -20.950
  401   HD11  LEU  46          HD11      LEU  46   7.749   1.634 -17.658
  402   HD12  LEU  46          HD12      LEU  46   7.339   3.252 -18.272
  403   HD13  LEU  46          HD13      LEU  46   6.421   2.536 -16.930
  404   HD21  LEU  46          HD21      LEU  46   4.001   2.085 -19.681
  405   HD22  LEU  46          HD22      LEU  46   4.252   2.758 -18.065
  406   HD23  LEU  46          HD23      LEU  46   5.004   3.546 -19.476
  407    H    LYS  47           H        LYS  47   6.324  -1.412 -21.464
  408    HA   LYS  47           HA       LYS  47   5.077  -2.750 -19.364
  409    HB2  LYS  47           HB2      LYS  47   4.341  -2.869 -21.696
  410    HB3  LYS  47           HB3      LYS  47   5.819  -3.703 -22.168
  411    HG2  LYS  47           HG2      LYS  47   3.912  -5.223 -22.091
  412    HG3  LYS  47           HG3      LYS  47   5.160  -5.701 -20.951
  413    HD2  LYS  47           HD2      LYS  47   3.788  -4.630 -19.091
  414    HD3  LYS  47           HD3      LYS  47   2.560  -4.233 -20.295
  415    HE2  LYS  47           HE2      LYS  47   1.900  -6.235 -19.107
  416    HE3  LYS  47           HE3      LYS  47   2.266  -6.661 -20.782
  417    HZ1  LYS  47           HZ1      LYS  47   4.377  -7.548 -20.039
  418    HZ2  LYS  47           HZ2      LYS  47   4.125  -7.049 -18.492
  419    HZ3  LYS  47           HZ3      LYS  47   3.200  -8.225 -19.147
  420    H    MET  48           H        MET  48   8.423  -3.075 -20.375
  421    HA   MET  48           HA       MET  48   8.774  -5.232 -18.374
  422    HB2  MET  48           HB2      MET  48   9.842  -5.088 -21.198
  423    HB3  MET  48           HB3      MET  48  10.672  -6.048 -19.972
  424    HG2  MET  48           HG2      MET  48   7.727  -6.515 -20.359
  425    HG3  MET  48           HG3      MET  48   8.847  -7.069 -21.592
  426    HE1  MET  48           HE1      MET  48   7.545  -7.502 -17.959
  427    HE2  MET  48           HE2      MET  48   8.603  -8.755 -17.275
  428    HE3  MET  48           HE3      MET  48   9.234  -7.125 -17.531
  429    H    ARG  49           H        ARG  49   8.931  -2.287 -18.274
  430    HA   ARG  49           HA       ARG  49  11.711  -2.132 -17.198
  431    HE   ARG  49           HE       ARG  49  11.828   1.517 -20.084
  432    HB2  ARG  49           HB2      ARG  49  11.089  -0.623 -19.256
  433    HB3  ARG  49           HB3      ARG  49  10.116   0.279 -18.089
  434    HG2  ARG  49           HG2      ARG  49  12.430   0.229 -16.704
  435    HG3  ARG  49           HG3      ARG  49  13.115  -0.017 -18.313
  436    HD2  ARG  49           HD2      ARG  49  11.312   2.254 -17.394
  437    HD3  ARG  49           HD3      ARG  49  13.061   2.361 -17.667
  438   HH11  ARG  49          HH11      ARG  49  11.953   4.397 -17.993
  439   HH12  ARG  49          HH12      ARG  49  11.663   5.506 -19.295
  440   HH21  ARG  49          HH21      ARG  49  11.441   2.926 -21.751
  441   HH22  ARG  49          HH22      ARG  49  11.353   4.649 -21.514
  442    H    GLY  50           H        GLY  50   8.231  -1.251 -16.795
  443    HA2  GLY  50           HA2      GLY  50   8.562  -0.394 -14.028
  444    HA3  GLY  50           HA3      GLY  50   7.051  -0.739 -14.884
  445    H    GLN  51           H        GLN  51   8.667  -3.431 -15.585
  446    HA   GLN  51           HA       GLN  51   8.653  -4.878 -13.091
  447    HB2  GLN  51           HB2      GLN  51   7.112  -6.651 -14.034
  448    HB3  GLN  51           HB3      GLN  51   6.320  -5.144 -13.566
  449    HG2  GLN  51           HG2      GLN  51   6.026  -4.472 -15.852
  450    HG3  GLN  51           HG3      GLN  51   7.115  -5.740 -16.434
  451   HE21  GLN  51          HE22      GLN  51   4.554  -6.277 -13.927
  452   HE22  GLN  51          HE21      GLN  51   3.678  -7.400 -14.912
  453    H    ALA  52           H        ALA  52   9.501  -7.149 -13.572
  454    HA   ALA  52           HA       ALA  52  10.963  -7.544 -16.077
  455    HB1  ALA  52           HB1      ALA  52  12.471  -5.983 -14.859
  456    HB2  ALA  52           HB2      ALA  52  12.432  -7.051 -13.436
  457    HB3  ALA  52           HB3      ALA  52  13.176  -7.606 -14.948
  458    H    PHE  53           H        PHE  53  12.325  -9.648 -15.786
  459    HA   PHE  53           HA       PHE  53  11.284 -11.399 -13.629
  460    HD1  PHE  53           HD2      PHE  53   9.035 -13.197 -14.092
  461    HD2  PHE  53           HD1      PHE  53  10.001 -11.119 -17.745
  462    HE1  PHE  53           HE2      PHE  53   6.620 -13.083 -14.673
  463    HE2  PHE  53           HE1      PHE  53   7.587 -10.991 -18.309
  464    HZ   PHE  53           HZ       PHE  53   5.894 -11.979 -16.774
  465    HB2  PHE  53           HB2      PHE  53  11.714 -12.288 -16.506
  466    HB3  PHE  53           HB3      PHE  53  11.318 -13.318 -15.154
  467    H    VAL  54           H        VAL  54  12.971 -12.746 -12.796
  468    HA   VAL  54           HA       VAL  54  15.580 -12.621 -14.176
  469    HB   VAL  54           HB       VAL  54  16.829 -12.003 -12.245
  470   HG11  VAL  54          HG11      VAL  54  16.019 -10.135 -13.620
  471   HG12  VAL  54          HG12      VAL  54  14.572  -9.976 -12.602
  472   HG13  VAL  54          HG13      VAL  54  16.159  -9.672 -11.911
  473   HG21  VAL  54          HG21      VAL  54  15.826 -11.181 -10.142
  474   HG22  VAL  54          HG22      VAL  54  14.211 -11.627 -10.733
  475   HG23  VAL  54          HG23      VAL  54  15.439 -12.880 -10.418
  476    H    ILE  55           H        ILE  55  16.742 -14.431 -13.961
  477    HA   ILE  55           HA       ILE  55  15.354 -16.783 -12.776
  478    HB   ILE  55           HB       ILE  55  17.510 -16.636 -14.922
  479   HG12  ILE  55          HG12      ILE  55  15.839 -17.512 -16.531
  480   HG13  ILE  55          HG13      ILE  55  14.552 -17.285 -15.371
  481   HG21  ILE  55          HG21      ILE  55  17.568 -18.717 -13.618
  482   HG22  ILE  55          HG22      ILE  55  15.838 -18.980 -13.931
  483   HG23  ILE  55          HG23      ILE  55  17.019 -19.039 -15.258
  484   HD11  ILE  55          HD11      ILE  55  14.682 -14.869 -15.625
  485   HD12  ILE  55          HD12      ILE  55  16.245 -14.985 -16.462
  486   HD13  ILE  55          HD13      ILE  55  14.762 -15.569 -17.235
  487    H    PHE  56           H        PHE  56  16.548 -17.958 -11.269
  488    HA   PHE  56           HA       PHE  56  19.061 -16.703 -10.243
  489    HD1  PHE  56           HD1      PHE  56  16.000 -15.064  -9.245
  490    HD2  PHE  56           HD2      PHE  56  19.463 -16.497  -7.129
  491    HE1  PHE  56           HE1      PHE  56  16.349 -12.803  -8.256
  492    HE2  PHE  56           HE2      PHE  56  19.825 -14.221  -6.170
  493    HZ   PHE  56           HZ       PHE  56  18.269 -12.395  -6.730
  494    HB2  PHE  56           HB2      PHE  56  16.477 -17.497  -9.003
  495    HB3  PHE  56           HB3      PHE  56  17.885 -18.041  -8.124
  496    H    LYS  57           H        LYS  57  20.356 -18.203  -8.878
  497    HA   LYS  57           HA       LYS  57  21.377 -20.364 -10.252
  498    HB2  LYS  57           HB2      LYS  57  22.429 -19.153  -8.371
  499    HB3  LYS  57           HB3      LYS  57  21.244 -19.851  -7.256
  500    HG2  LYS  57           HG2      LYS  57  22.167 -22.120  -7.695
  501    HG3  LYS  57           HG3      LYS  57  23.323 -21.421  -8.839
  502    HD2  LYS  57           HD2      LYS  57  24.390 -21.850  -6.689
  503    HD3  LYS  57           HD3      LYS  57  24.352 -20.109  -7.011
  504    HE2  LYS  57           HE2      LYS  57  22.417 -19.839  -5.503
  505    HE3  LYS  57           HE3      LYS  57  22.327 -21.586  -5.261
  506    HZ1  LYS  57           HZ1      LYS  57  24.504 -21.488  -4.192
  507    HZ2  LYS  57           HZ2      LYS  57  24.597 -19.872  -4.420
  508    HZ3  LYS  57           HZ3      LYS  57  23.461 -20.497  -3.432
  509    H    GLU  58           H        GLU  58  18.818 -20.534  -7.686
  510    HA   GLU  58           HA       GLU  58  17.986 -23.182  -8.597
  511    HB2  GLU  58           HB2      GLU  58  19.970 -22.883  -6.534
  512    HB3  GLU  58           HB3      GLU  58  18.476 -23.267  -5.701
  513    HG2  GLU  58           HG2      GLU  58  19.597 -24.879  -8.038
  514    HG3  GLU  58           HG3      GLU  58  19.947 -25.215  -6.346
  515    H    ILE  59           H        ILE  59  16.006 -23.854  -7.321
  516    HA   ILE  59           HA       ILE  59  14.195 -21.667  -7.186
  517    HB   ILE  59           HB       ILE  59  12.527 -23.240  -6.546
  518   HG12  ILE  59          HG12      ILE  59  14.749 -25.221  -5.883
  519   HG13  ILE  59          HG13      ILE  59  13.624 -24.477  -4.745
  520   HG21  ILE  59          HG21      ILE  59  12.585 -24.690  -8.404
  521   HG22  ILE  59          HG22      ILE  59  13.555 -23.296  -8.884
  522   HG23  ILE  59          HG23      ILE  59  14.358 -24.794  -8.398
  523   HD11  ILE  59          HD11      ILE  59  12.894 -26.716  -5.139
  524   HD12  ILE  59          HD12      ILE  59  11.728 -25.630  -5.920
  525   HD13  ILE  59          HD13      ILE  59  12.931 -26.507  -6.895
  526    H    GLY  60           H        GLY  60  16.048 -23.254  -4.582
  527    HA2  GLY  60           HA2      GLY  60  14.634 -21.947  -2.424
  528    HA3  GLY  60           HA3      GLY  60  16.230 -22.719  -2.347
  529    H    SER  61           H        SER  61  17.516 -21.185  -4.418
  530    HA   SER  61           HA       SER  61  18.367 -18.878  -2.966
  531    HG   SER  61           HG       SER  61  20.058 -20.738  -3.869
  532    HB2  SER  61           HB2      SER  61  18.758 -19.284  -5.945
  533    HB3  SER  61           HB3      SER  61  19.864 -18.599  -4.751
  534    H    ALA  62           H        ALA  62  16.257 -19.376  -5.818
  535    HA   ALA  62           HA       ALA  62  15.522 -16.706  -6.337
  536    HB1  ALA  62           HB1      ALA  62  13.864 -19.259  -6.579
  537    HB2  ALA  62           HB2      ALA  62  13.571 -17.749  -7.438
  538    HB3  ALA  62           HB3      ALA  62  15.028 -18.701  -7.790
  539    H    SER  63           H        SER  63  13.972 -19.159  -4.175
  540    HA   SER  63           HA       SER  63  11.870 -17.525  -3.253
  541    HG   SER  63           HG       SER  63  12.611 -20.527  -3.667
  542    HB2  SER  63           HB2      SER  63  13.332 -19.705  -1.698
  543    HB3  SER  63           HB3      SER  63  11.706 -19.085  -1.379
  544    H    ASN  64           H        ASN  64  15.154 -17.982  -1.913
  545    HA   ASN  64           HA       ASN  64  14.785 -16.331   0.366
  546    HB2  ASN  64           HB2      ASN  64  16.669 -17.914   0.116
  547    HB3  ASN  64           HB3      ASN  64  17.351 -16.913  -1.169
  548   HD21  ASN  64          HD22      ASN  64  18.770 -15.298  -0.543
  549   HD22  ASN  64          HD21      ASN  64  18.942 -14.718   1.109
  550    H    ALA  65           H        ALA  65  16.123 -15.537  -2.865
  551    HA   ALA  65           HA       ALA  65  16.612 -12.795  -2.413
  552    HB1  ALA  65           HB1      ALA  65  16.525 -12.603  -4.865
  553    HB2  ALA  65           HB2      ALA  65  17.429 -14.056  -4.379
  554    HB3  ALA  65           HB3      ALA  65  15.765 -14.202  -4.995
  555    H    LEU  66           H        LEU  66  13.701 -14.381  -3.804
  556    HA   LEU  66           HA       LEU  66  12.114 -12.132  -4.267
  557    HG   LEU  66           HG       LEU  66   9.822 -13.093  -5.280
  558    HB2  LEU  66           HB2      LEU  66  11.742 -14.525  -4.924
  559    HB3  LEU  66           HB3      LEU  66  11.246 -14.896  -3.291
  560   HD11  LEU  66          HD11      LEU  66   9.695 -15.458  -5.830
  561   HD12  LEU  66          HD12      LEU  66   9.234 -15.868  -4.165
  562   HD13  LEU  66          HD13      LEU  66   8.130 -14.940  -5.193
  563   HD21  LEU  66          HD21      LEU  66   8.966 -13.849  -2.454
  564   HD22  LEU  66          HD22      LEU  66   9.246 -12.208  -3.091
  565   HD23  LEU  66          HD23      LEU  66   7.899 -13.137  -3.690
  566    H    ARG  67           H        ARG  67  12.122 -14.226  -1.329
  567    HA   ARG  67           HA       ARG  67  10.146 -12.642  -0.016
  568    HE   ARG  67           HE       ARG  67   9.380 -17.626  -0.491
  569    HB2  ARG  67           HB2      ARG  67  12.158 -14.681   1.037
  570    HB3  ARG  67           HB3      ARG  67  10.835 -14.018   2.003
  571    HG2  ARG  67           HG2      ARG  67   9.153 -14.987   0.569
  572    HG3  ARG  67           HG3      ARG  67  10.346 -15.456  -0.646
  573    HD2  ARG  67           HD2      ARG  67  11.441 -16.944   1.072
  574    HD3  ARG  67           HD3      ARG  67  10.099 -16.560   2.169
  575   HH11  ARG  67          HH21      ARG  67   9.976 -18.473   2.947
  576   HH12  ARG  67          HH22      ARG  67   8.993 -19.919   2.823
  577   HH21  ARG  67          HH11      ARG  67   8.185 -19.604  -0.531
  578   HH22  ARG  67          HH12      ARG  67   8.073 -20.551   0.954
  579    H    THR  68           H        THR  68  13.754 -12.554   0.127
  580    HA   THR  68           HA       THR  68  13.777 -10.700   2.337
  581    HB   THR  68           HB       THR  68  15.979 -11.248   0.302
  582    HG1  THR  68           HG1      THR  68  15.487 -13.166   1.125
  583   HG21  THR  68          HG21      THR  68  17.458 -10.734   2.272
  584   HG22  THR  68          HG22      THR  68  16.525  -9.338   1.717
  585   HG23  THR  68          HG23      THR  68  16.022 -10.217   3.178
  586    H    MET  69           H        MET  69  13.951 -10.307  -1.243
  587    HA   MET  69           HA       MET  69  14.396  -7.437  -0.963
  588    HB2  MET  69           HB2      MET  69  14.006  -9.201  -3.412
  589    HB3  MET  69           HB3      MET  69  14.397  -7.486  -3.453
  590    HG2  MET  69           HG2      MET  69  16.108  -9.697  -2.249
  591    HG3  MET  69           HG3      MET  69  16.415  -8.847  -3.751
  592    HE1  MET  69           HE1      MET  69  15.919  -5.836  -3.208
  593    HE2  MET  69           HE2      MET  69  17.478  -5.271  -2.558
  594    HE3  MET  69           HE3      MET  69  17.448  -6.395  -3.923
  595    H    GLN  70           H        GLN  70  11.562  -9.414  -1.106
  596    HA   GLN  70           HA       GLN  70   9.701  -7.646  -2.226
  597    HB2  GLN  70           HB2      GLN  70   9.662  -9.980  -0.462
  598    HB3  GLN  70           HB3      GLN  70   8.481  -8.800   0.099
  599    HG2  GLN  70           HG2      GLN  70   8.637  -9.721  -2.767
  600    HG3  GLN  70           HG3      GLN  70   7.690 -10.533  -1.529
  601   HE21  GLN  70          HE22      GLN  70   6.032  -9.937  -3.241
  602   HE22  GLN  70          HE21      GLN  70   5.105  -8.483  -2.863
  603    H    GLY  71           H        GLY  71   9.014  -5.667  -1.746
  604    HA2  GLY  71           HA2      GLY  71   8.503  -3.784  -0.601
  605    HA3  GLY  71           HA3      GLY  71   8.879  -4.598   0.921
  606    H    PHE  72           H        PHE  72  11.670  -4.961  -0.971
  607    HA   PHE  72           HA       PHE  72  13.087  -3.113   0.709
  608    HD1  PHE  72           HD2      PHE  72  15.586  -4.284   1.583
  609    HD2  PHE  72           HD1      PHE  72  15.708  -3.080  -2.557
  610    HE1  PHE  72           HE2      PHE  72  17.829  -3.281   1.936
  611    HE2  PHE  72           HE1      PHE  72  17.949  -2.068  -2.195
  612    HZ   PHE  72           HZ       PHE  72  19.012  -2.170   0.050
  613    HB2  PHE  72           HB2      PHE  72  14.028  -5.246  -0.130
  614    HB3  PHE  72           HB3      PHE  72  14.005  -4.611  -1.776
  615    HA   PRO  73           HA       PRO  73  12.761   0.370  -2.207
  616    HB2  PRO  73           HB2      PRO  73  14.322   2.207  -0.984
  617    HB3  PRO  73           HB3      PRO  73  12.739   1.698  -0.327
  618    HG2  PRO  73           HG2      PRO  73  15.489   0.702   0.498
  619    HG3  PRO  73           HG3      PRO  73  14.149   1.251   1.551
  620    HD2  PRO  73           HD2      PRO  73  14.617  -1.394   0.964
  621    HD3  PRO  73           HD3      PRO  73  12.974  -0.755   1.259
  622    H    PHE  74           H        PHE  74  13.779  -1.100  -3.733
  623    HA   PHE  74           HA       PHE  74  16.577  -1.394  -4.202
  624    HD1  PHE  74           HD1      PHE  74  17.245  -3.455  -5.828
  625    HD2  PHE  74           HD2      PHE  74  14.647  -1.062  -8.299
  626    HE1  PHE  74           HE1      PHE  74  18.375  -4.324  -7.863
  627    HE2  PHE  74           HE2      PHE  74  15.783  -1.924 -10.326
  628    HZ   PHE  74           HZ       PHE  74  17.608  -3.595 -10.118
  629    HB2  PHE  74           HB2      PHE  74  14.821  -2.734  -5.197
  630    HB3  PHE  74           HB3      PHE  74  14.145  -1.337  -6.027
  631    H    TYR  75           H        TYR  75  14.249   1.089  -5.022
  632    HA   TYR  75           HA       TYR  75  16.227   3.166  -5.225
  633    HD1  TYR  75           HD1      TYR  75  17.323   4.811  -7.175
  634    HD2  TYR  75           HD2      TYR  75  16.314   0.840  -8.529
  635    HE1  TYR  75           HE1      TYR  75  19.582   4.578  -8.146
  636    HE2  TYR  75           HE2      TYR  75  18.582   0.588  -9.490
  637    HH   TYR  75           HH       TYR  75  21.054   3.203  -9.301
  638    HB2  TYR  75           HB2      TYR  75  14.574   2.317  -7.632
  639    HB3  TYR  75           HB3      TYR  75  14.950   4.012  -7.395
  640    H    ASP  76           H        ASP  76  14.192   5.090  -6.041
  641    HA   ASP  76           HA       ASP  76  12.906   5.497  -3.562
  642    HB2  ASP  76           HB2      ASP  76  13.705   7.226  -5.186
  643    HB3  ASP  76           HB3      ASP  76  12.349   6.825  -6.238
  644    H    LYS  77           H        LYS  77  12.028   2.925  -4.901
  645    HA   LYS  77           HA       LYS  77   9.209   3.244  -4.308
  646    HB2  LYS  77           HB2      LYS  77  10.163   1.914  -6.892
  647    HB3  LYS  77           HB3      LYS  77   8.569   1.675  -6.180
  648    HG2  LYS  77           HG2      LYS  77   8.177   4.166  -6.352
  649    HG3  LYS  77           HG3      LYS  77   9.694   4.280  -7.273
  650    HD2  LYS  77           HD2      LYS  77   8.763   2.598  -8.898
  651    HD3  LYS  77           HD3      LYS  77   7.233   2.627  -8.031
  652    HE2  LYS  77           HE2      LYS  77   8.546   5.058  -9.343
  653    HE3  LYS  77           HE3      LYS  77   7.283   4.072 -10.085
  654    HZ1  LYS  77           HZ1      LYS  77   5.795   4.713  -8.280
  655    HZ2  LYS  77           HZ2      LYS  77   6.952   5.654  -7.602
  656    HZ3  LYS  77           HZ3      LYS  77   6.346   6.026  -9.066
  657    HA   PRO  78           HA       PRO  78  10.533  -0.600  -2.315
  658    HB2  PRO  78           HB2      PRO  78   8.126  -1.526  -1.400
  659    HB3  PRO  78           HB3      PRO  78   8.995  -0.158  -0.640
  660    HG2  PRO  78           HG2      PRO  78   6.707  -0.050  -2.622
  661    HG3  PRO  78           HG3      PRO  78   6.914   0.891  -1.112
  662    HD2  PRO  78           HD2      PRO  78   7.555   1.881  -3.593
  663    HD3  PRO  78           HD3      PRO  78   8.459   2.343  -2.120
  664    H    MET  79           H        MET  79  10.909  -2.524  -3.319
  665    HA   MET  79           HA       MET  79   9.758  -3.210  -5.853
  666    HB2  MET  79           HB2      MET  79  11.290  -4.850  -3.783
  667    HB3  MET  79           HB3      MET  79  10.922  -5.420  -5.416
  668    HG2  MET  79           HG2      MET  79  12.496  -2.890  -4.824
  669    HG3  MET  79           HG3      MET  79  13.228  -4.465  -5.075
  670    HE1  MET  79           HE1      MET  79  14.549  -4.577  -6.971
  671    HE2  MET  79           HE2      MET  79  13.306  -5.732  -7.486
  672    HE3  MET  79           HE3      MET  79  13.958  -4.547  -8.644
  673    H    GLN  80           H        GLN  80   8.299  -4.872  -6.397
  674    HA   GLN  80           HA       GLN  80   6.850  -6.260  -4.190
  675    HB2  GLN  80           HB2      GLN  80   5.676  -5.060  -6.749
  676    HB3  GLN  80           HB3      GLN  80   4.831  -6.185  -5.673
  677    HG2  GLN  80           HG2      GLN  80   4.996  -4.556  -3.810
  678    HG3  GLN  80           HG3      GLN  80   5.892  -3.445  -4.845
  679   HE21  GLN  80          HE22      GLN  80   4.295  -1.774  -4.544
  680   HE22  GLN  80          HE21      GLN  80   2.748  -1.859  -5.345
  681    H    ILE  81           H        ILE  81   6.873  -8.522  -4.604
  682    HA   ILE  81           HA       ILE  81   7.952  -9.382  -7.200
  683    HB   ILE  81           HB       ILE  81   9.344 -10.348  -4.711
  684   HG12  ILE  81          HG12      ILE  81  10.179  -7.857  -6.250
  685   HG13  ILE  81          HG13      ILE  81   9.703  -7.963  -4.544
  686   HG21  ILE  81          HG21      ILE  81   9.599 -11.564  -6.913
  687   HG22  ILE  81          HG22      ILE  81  10.261 -10.091  -7.614
  688   HG23  ILE  81          HG23      ILE  81  11.120 -10.939  -6.311
  689   HD11  ILE  81          HD11      ILE  81  11.695  -9.415  -4.123
  690   HD12  ILE  81          HD12      ILE  81  12.238  -9.055  -5.783
  691   HD13  ILE  81          HD13      ILE  81  12.058  -7.745  -4.614
  692    H    ALA  82           H        ALA  82   7.548 -11.493  -7.671
  693    HA   ALA  82           HA       ALA  82   6.252 -13.304  -5.747
  694    HB1  ALA  82           HB1      ALA  82   4.343 -12.086  -6.787
  695    HB2  ALA  82           HB2      ALA  82   4.955 -12.514  -8.402
  696    HB3  ALA  82           HB3      ALA  82   4.378 -13.781  -7.300
  697    H    TYR  83           H        TYR  83   5.903 -15.505  -7.132
  698    HA   TYR  83           HA       TYR  83   8.444 -16.070  -8.519
  699    HD1  TYR  83           HD2      TYR  83   5.644 -17.188  -5.726
  700    HD2  TYR  83           HD1      TYR  83   5.420 -19.069  -9.600
  701    HE1  TYR  83           HE2      TYR  83   3.302 -17.874  -5.253
  702    HE2  TYR  83           HE1      TYR  83   3.119 -19.820  -9.112
  703    HH   TYR  83           HH       TYR  83   1.368 -19.833  -7.556
  704    HB2  TYR  83           HB2      TYR  83   7.543 -18.348  -8.711
  705    HB3  TYR  83           HB3      TYR  83   7.703 -17.787  -7.062
  706    H    SER  84           H        SER  84   8.512 -16.622 -10.795
  707    HA   SER  84           HA       SER  84   6.875 -15.038 -12.410
  708    HG   SER  84           HG       SER  84   9.859 -15.357 -13.726
  709    HB2  SER  84           HB2      SER  84   8.597 -17.422 -13.205
  710    HB3  SER  84           HB3      SER  84   7.968 -16.170 -14.296
  711    H    LYS  85           H        LYS  85   5.269 -15.388 -13.858
  712    HA   LYS  85           HA       LYS  85   3.738 -17.887 -13.960
  713    HB2  LYS  85           HB2      LYS  85   2.610 -15.195 -13.022
  714    HB3  LYS  85           HB3      LYS  85   1.622 -16.567 -13.527
  715    HG2  LYS  85           HG2      LYS  85   2.518 -17.938 -11.677
  716    HG3  LYS  85           HG3      LYS  85   3.510 -16.570 -11.140
  717    HD2  LYS  85           HD2      LYS  85   1.474 -15.208 -10.784
  718    HD3  LYS  85           HD3      LYS  85   0.468 -16.585 -11.293
  719    HE2  LYS  85           HE2      LYS  85   1.405 -17.947  -9.446
  720    HE3  LYS  85           HE3      LYS  85   2.418 -16.590  -8.941
  721    HZ1  LYS  85           HZ1      LYS  85  -0.548 -16.599  -8.929
  722    HZ2  LYS  85           HZ2      LYS  85   0.403 -16.754  -7.616
  723    HZ3  LYS  85           HZ3      LYS  85   0.388 -15.350  -8.445
  724    H    SER  86           H        SER  86   1.962 -17.505 -15.702
  725    HA   SER  86           HA       SER  86   2.995 -16.545 -18.107
  726    HG   SER  86           HG       SER  86   0.272 -18.906 -18.011
  727    HB2  SER  86           HB2      SER  86   0.062 -16.721 -17.321
  728    HB3  SER  86           HB3      SER  86   0.753 -16.860 -18.948
  729    H    ASP  87           H        ASP  87   2.649 -14.641 -19.324
  730    HA   ASP  87           HA       ASP  87   1.141 -12.376 -18.264
  731    HB2  ASP  87           HB2      ASP  87   3.276 -11.886 -17.218
  732    HB3  ASP  87           HB3      ASP  87   4.164 -12.314 -18.683
  733    H    SER  88           H        SER  88   0.568 -10.985 -20.022
  734    HA   SER  88           HA       SER  88   0.032 -12.220 -22.386
  735    HG   SER  88           HG       SER  88  -1.758  -9.305 -21.242
  736    HB2  SER  88           HB2      SER  88   0.405  -9.225 -22.051
  737    HB3  SER  88           HB3      SER  88  -0.715 -10.067 -23.138
  738    H    ASP  89           H        ASP  89   3.076 -10.428 -21.654
  739    HA   ASP  89           HA       ASP  89   3.791 -10.114 -24.449
  740    HB2  ASP  89           HB2      ASP  89   4.721  -8.643 -22.716
  741    HB3  ASP  89           HB3      ASP  89   5.508 -10.024 -21.941
  742    H    ILE  90           H        ILE  90   4.749 -12.411 -21.874
  743    HA   ILE  90           HA       ILE  90   6.437 -13.903 -23.706
  744    HB   ILE  90           HB       ILE  90   6.719 -15.533 -21.936
  745   HG12  ILE  90          HG12      ILE  90   4.801 -13.863 -20.263
  746   HG13  ILE  90          HG13      ILE  90   4.469 -15.482 -20.895
  747   HG21  ILE  90          HG21      ILE  90   6.969 -12.689 -20.873
  748   HG22  ILE  90          HG22      ILE  90   7.994 -14.087 -20.478
  749   HG23  ILE  90          HG23      ILE  90   8.034 -13.403 -22.103
  750   HD11  ILE  90          HD11      ILE  90   5.081 -15.676 -18.579
  751   HD12  ILE  90          HD12      ILE  90   6.398 -16.357 -19.553
  752   HD13  ILE  90          HD13      ILE  90   6.561 -14.742 -18.813
  753    H    VAL  91           H        VAL  91   3.049 -14.164 -22.630
  754    HA   VAL  91           HA       VAL  91   2.588 -16.693 -23.845
  755    HB   VAL  91           HB       VAL  91   0.758 -14.376 -23.142
  756   HG11  VAL  91          HG11      VAL  91  -1.155 -15.942 -23.457
  757   HG12  VAL  91          HG12      VAL  91  -0.363 -15.546 -24.983
  758   HG13  VAL  91          HG13      VAL  91  -0.054 -17.117 -24.211
  759   HG21  VAL  91          HG21      VAL  91   1.051 -17.179 -21.948
  760   HG22  VAL  91          HG22      VAL  91   1.809 -15.732 -21.274
  761   HG23  VAL  91          HG23      VAL  91   0.046 -15.852 -21.323
  762    H    ALA  92           H        ALA  92   2.312 -13.297 -25.152
  763    HA   ALA  92           HA       ALA  92   1.521 -14.064 -27.756
  764    HB1  ALA  92           HB1      ALA  92   2.430 -11.887 -28.468
  765    HB2  ALA  92           HB2      ALA  92   1.468 -11.730 -26.987
  766    HB3  ALA  92           HB3      ALA  92   3.244 -11.693 -26.906
  767    H    LYS  93           H        LYS  93   4.844 -13.627 -26.386
  768    HA   LYS  93           HA       LYS  93   6.270 -14.231 -28.713
  769    HB2  LYS  93           HB2      LYS  93   6.965 -14.709 -25.805
  770    HB3  LYS  93           HB3      LYS  93   8.072 -15.101 -27.123
  771    HG2  LYS  93           HG2      LYS  93   8.103 -12.800 -27.906
  772    HG3  LYS  93           HG3      LYS  93   6.853 -12.333 -26.758
  773    HD2  LYS  93           HD2      LYS  93   8.987 -11.568 -25.950
  774    HD3  LYS  93           HD3      LYS  93   8.384 -12.831 -24.868
  775    HE2  LYS  93           HE2      LYS  93   9.876 -14.490 -25.963
  776    HE3  LYS  93           HE3      LYS  93  10.431 -13.254 -27.101
  777    HZ1  LYS  93           HZ1      LYS  93  11.988 -13.549 -25.286
  778    HZ2  LYS  93           HZ2      LYS  93  11.376 -12.042 -25.223
  779    HZ3  LYS  93           HZ3      LYS  93  10.862 -13.183 -24.168
  780    H    ILE  94           H        ILE  94   5.168 -16.680 -26.246
  781    HA   ILE  94           HA       ILE  94   6.234 -18.781 -27.895
  782    HB   ILE  94           HB       ILE  94   5.173 -20.354 -26.422
  783   HG12  ILE  94          HG12      ILE  94   3.799 -18.006 -25.079
  784   HG13  ILE  94          HG13      ILE  94   3.000 -19.239 -26.051
  785   HG21  ILE  94          HG21      ILE  94   6.415 -19.807 -24.426
  786   HG22  ILE  94          HG22      ILE  94   7.306 -19.174 -25.809
  787   HG23  ILE  94          HG23      ILE  94   6.361 -18.072 -24.787
  788   HD11  ILE  94          HD11      ILE  94   3.735 -20.970 -24.395
  789   HD12  ILE  94          HD12      ILE  94   4.359 -19.655 -23.365
  790   HD13  ILE  94          HD13      ILE  94   2.632 -19.742 -23.736
  791    H    LYS  95           H        LYS  95   3.049 -17.216 -27.851
  792    HA   LYS  95           HA       LYS  95   1.783 -19.260 -29.458
  793    HB2  LYS  95           HB2      LYS  95   1.090 -16.358 -28.850
  794    HB3  LYS  95           HB3      LYS  95   0.096 -17.357 -29.902
  795    HG2  LYS  95           HG2      LYS  95   0.731 -18.106 -27.015
  796    HG3  LYS  95           HG3      LYS  95  -0.693 -17.196 -27.525
  797    HD2  LYS  95           HD2      LYS  95  -1.367 -19.139 -28.982
  798    HD3  LYS  95           HD3      LYS  95   0.035 -20.032 -28.384
  799    HE2  LYS  95           HE2      LYS  95  -1.816 -20.796 -27.121
  800    HE3  LYS  95           HE3      LYS  95  -0.834 -19.800 -26.045
  801    HZ1  LYS  95           HZ1      LYS  95  -3.330 -18.930 -27.398
  802    HZ2  LYS  95           HZ2      LYS  95  -3.195 -19.323 -25.825
  803    HZ3  LYS  95           HZ3      LYS  95  -2.441 -17.994 -26.391
  804    H    GLY  96           H        GLY  96   3.398 -16.133 -30.330
  805    HA2  GLY  96           HA2      GLY  96   4.094 -17.083 -32.953
  806    HA3  GLY  96           HA3      GLY  96   2.605 -16.127 -32.996
  807    H    THR  97           H        THR  97   5.614 -15.769 -31.034
  808    HA   THR  97           HA       THR  97   7.123 -14.140 -30.808
  809    HB   THR  97           HB       THR  97   6.213 -13.023 -33.489
  810    HG1  THR  97           HG1      THR  97   6.801 -15.219 -33.574
  811   HG21  THR  97          HG21      THR  97   8.611 -12.323 -33.673
  812   HG22  THR  97          HG22      THR  97   7.703 -11.427 -32.465
  813   HG23  THR  97          HG23      THR  97   8.826 -12.717 -31.954
  814    H    PHE  98           H        PHE  98   7.338 -11.751 -30.255
  815    HA   PHE  98           HA       PHE  98   5.341 -10.993 -28.477
  816    HD1  PHE  98           HD1      PHE  98   6.469  -7.451 -30.554
  817    HD2  PHE  98           HD2      PHE  98   9.346 -10.588 -29.831
  818    HE1  PHE  98           HE1      PHE  98   7.849  -6.622 -32.437
  819    HE2  PHE  98           HE2      PHE  98  10.723  -9.748 -31.713
  820    HZ   PHE  98           HZ       PHE  98   9.976  -7.770 -33.026
  821    HB2  PHE  98           HB2      PHE  98   6.482  -8.789 -28.412
  822    HB3  PHE  98           HB3      PHE  98   7.558 -10.158 -28.236
  823    H    LYS  99           H        LYS  99   5.566 -10.249 -31.901
  824    HA   LYS  99           HA       LYS  99   2.757  -9.478 -31.920
  825    HB2  LYS  99           HB2      LYS  99   4.992  -7.878 -33.268
  826    HB3  LYS  99           HB3      LYS  99   3.313  -7.753 -33.755
  827    HG2  LYS  99           HG2      LYS  99   4.217  -7.074 -30.925
  828    HG3  LYS  99           HG3      LYS  99   4.297  -5.936 -32.254
  829    HD2  LYS  99           HD2      LYS  99   2.339  -5.459 -31.027
  830    HD3  LYS  99           HD3      LYS  99   1.844  -6.110 -32.593
  831    HE2  LYS  99           HE2      LYS  99   1.280  -8.259 -31.571
  832    HE3  LYS  99           HE3      LYS  99   1.987  -7.757 -30.027
  833    HZ1  LYS  99           HZ1      LYS  99   0.235  -6.089 -29.848
  834    HZ2  LYS  99           HZ2      LYS  99  -0.410  -6.539 -31.282
  835    HZ3  LYS  99           HZ3      LYS  99  -0.421  -7.566 -30.019
  836    H    GLU 100           H        GLU 100   1.804 -10.566 -33.631
  837    HA   GLU 100           HA       GLU 100   3.382 -12.469 -35.139
  838    HB2  GLU 100           HB2      GLU 100   1.052 -12.853 -34.371
  839    HB3  GLU 100           HB3      GLU 100   0.494 -11.536 -35.405
  840    HG2  GLU 100           HG2      GLU 100  -0.021 -13.581 -36.505
  841    HG3  GLU 100           HG3      GLU 100   1.275 -12.834 -37.416
  842    H    ARG 101           H        ARG 101   2.098  -9.201 -35.686
  843    HA   ARG 101           HA       ARG 101   2.707  -8.976 -38.487
  844    HE   ARG 101           HE       ARG 101   1.696  -4.299 -37.256
  845    HB2  ARG 101           HB2      ARG 101   2.647  -6.877 -36.261
  846    HB3  ARG 101           HB3      ARG 101   2.812  -6.522 -37.982
  847    HG2  ARG 101           HG2      ARG 101   0.606  -7.347 -38.485
  848    HG3  ARG 101           HG3      ARG 101   0.400  -7.984 -36.847
  849    HD2  ARG 101           HD2      ARG 101  -0.814  -5.865 -37.090
  850    HD3  ARG 101           HD3      ARG 101   0.468  -5.741 -35.892
  851   HH11  ARG 101          HH22      ARG 101  -1.013  -5.539 -39.188
  852   HH12  ARG 101          HH21      ARG 101  -0.996  -4.219 -40.298
  853   HH21  ARG 101          HH12      ARG 101   1.490  -2.426 -38.483
  854   HH22  ARG 101          HH11      ARG 101   0.567  -2.442 -39.962
  855    HA   PRO 102           HA       PRO 102   7.200  -8.617 -38.361
  856    HB2  PRO 102           HB2      PRO 102   6.777  -6.249 -40.189
  857    HB3  PRO 102           HB3      PRO 102   7.933  -7.606 -40.355
  858    HG2  PRO 102           HG2      PRO 102   5.649  -7.554 -41.822
  859    HG3  PRO 102           HG3      PRO 102   6.208  -9.086 -41.075
  860    HD2  PRO 102           HD2      PRO 102   4.059  -7.196 -40.094
  861    HD3  PRO 102           HD3      PRO 102   4.060  -8.985 -40.162
  862    H    LYS 103           H        LYS 103   5.172  -5.704 -38.066
  863    HA   LYS 103           HA       LYS 103   6.425  -4.903 -35.600
  864    HB2  LYS 103           HB2      LYS 103   7.022  -2.623 -36.321
  865    HB3  LYS 103           HB3      LYS 103   8.017  -3.828 -37.127
  866    HG2  LYS 103           HG2      LYS 103   6.607  -3.635 -39.176
  867    HG3  LYS 103           HG3      LYS 103   5.624  -2.400 -38.387
  868    HD2  LYS 103           HD2      LYS 103   8.612  -2.181 -38.950
  869    HD3  LYS 103           HD3      LYS 103   7.325  -1.484 -39.945
  870    HE2  LYS 103           HE2      LYS 103   6.563  -0.123 -37.997
  871    HE3  LYS 103           HE3      LYS 103   7.893  -0.774 -37.031
  872    HZ1  LYS 103           HZ1      LYS 103   8.211   0.852 -39.486
  873    HZ2  LYS 103           HZ2      LYS 103   8.454   1.373 -37.963
  874    HZ3  LYS 103           HZ3      LYS 103   9.442   0.244 -38.596
  875    H    LYS 104           H        LYS 104   5.179  -3.005 -34.689
  876    HA   LYS 104           HA       LYS 104   2.327  -3.167 -35.203
  877    HB2  LYS 104           HB2      LYS 104   3.996  -1.115 -33.682
  878    HB3  LYS 104           HB3      LYS 104   2.230  -1.122 -33.768
  879    HG2  LYS 104           HG2      LYS 104   2.195  -3.405 -32.759
  880    HG3  LYS 104           HG3      LYS 104   3.951  -3.342 -32.565
  881    HD2  LYS 104           HD2      LYS 104   1.952  -1.428 -31.282
  882    HD3  LYS 104           HD3      LYS 104   2.726  -2.802 -30.481
  883    HE2  LYS 104           HE2      LYS 104   4.961  -1.774 -30.870
  884    HE3  LYS 104           HE3      LYS 104   4.184  -0.383 -31.639
  885    HZ1  LYS 104           HZ1      LYS 104   3.082   0.087 -29.530
  886    HZ2  LYS 104           HZ2      LYS 104   3.804  -1.195 -28.815
  887    HZ3  LYS 104           HZ3      LYS 104   4.698   0.065 -29.331
  Start of MODEL    7
    1    HA   MET   1           HA       MET   1   4.362 -19.217   4.320
    2    H1   MET   1           H1       MET   1   4.834 -17.462   5.896
    3    H2   MET   1           H2       MET   1   3.239 -17.171   6.100
    4    H3   MET   1           H3       MET   1   3.868 -18.624   6.559
    5    HB2  MET   1           HB2      MET   1   1.503 -18.189   4.623
    6    HB3  MET   1           HB3      MET   1   2.073 -19.164   3.269
    7    HG2  MET   1           HG2      MET   1   2.033 -20.030   6.182
    8    HG3  MET   1           HG3      MET   1   0.933 -20.545   4.911
    9    HE1  MET   1           HE1      MET   1   2.416 -22.569   6.835
   10    HE2  MET   1           HE2      MET   1   1.306 -23.066   5.536
   11    HE3  MET   1           HE3      MET   1   2.906 -23.827   5.678
   12    H    GLU   2           H        GLU   2   5.218 -18.482   2.440
   13    HA   GLU   2           HA       GLU   2   4.603 -15.730   1.519
   14    HB2  GLU   2           HB2      GLU   2   7.421 -16.855   1.835
   15    HB3  GLU   2           HB3      GLU   2   6.970 -15.319   1.111
   16    HG2  GLU   2           HG2      GLU   2   7.626 -14.579   3.145
   17    HG3  GLU   2           HG3      GLU   2   5.903 -14.761   3.443
   18    H    MET   3           H        MET   3   5.848 -15.497  -0.693
   19    HA   MET   3           HA       MET   3   4.482 -17.067  -2.526
   20    HB2  MET   3           HB2      MET   3   6.933 -15.277  -2.788
   21    HB3  MET   3           HB3      MET   3   6.171 -16.045  -4.175
   22    HG2  MET   3           HG2      MET   3   5.322 -13.806  -3.985
   23    HG3  MET   3           HG3      MET   3   4.040 -14.966  -3.695
   24    HE1  MET   3           HE1      MET   3   6.841 -13.359  -1.266
   25    HE2  MET   3           HE2      MET   3   6.210 -12.057  -2.304
   26    HE3  MET   3           HE3      MET   3   5.855 -12.060  -0.564
   27    H    LEU   4           H        LEU   4   4.897 -18.818  -3.759
   28    HA   LEU   4           HA       LEU   4   6.542 -20.797  -2.597
   29    HG   LEU   4           HG       LEU   4   3.467 -20.489  -3.536
   30    HB2  LEU   4           HB2      LEU   4   5.148 -20.793  -5.306
   31    HB3  LEU   4           HB3      LEU   4   5.788 -22.215  -4.493
   32   HD11  LEU   4          HD11      LEU   4   2.957 -21.948  -5.455
   33   HD12  LEU   4          HD12      LEU   4   3.560 -23.358  -4.557
   34   HD13  LEU   4          HD13      LEU   4   2.117 -22.486  -3.993
   35   HD21  LEU   4          HD21      LEU   4   4.716 -22.952  -2.239
   36   HD22  LEU   4          HD22      LEU   4   4.622 -21.309  -1.556
   37   HD23  LEU   4          HD23      LEU   4   3.148 -22.246  -1.786
   38    HA   PRO   5           HA       PRO   5  10.430 -20.583  -4.890
   39    HB2  PRO   5           HB2      PRO   5  10.102 -23.570  -5.098
   40    HB3  PRO   5           HB3      PRO   5  11.536 -22.614  -4.601
   41    HG2  PRO   5           HG2      PRO   5  10.012 -23.857  -2.746
   42    HG3  PRO   5           HG3      PRO   5  10.631 -22.198  -2.459
   43    HD2  PRO   5           HD2      PRO   5   7.869 -23.040  -3.364
   44    HD3  PRO   5           HD3      PRO   5   8.348 -21.807  -2.156
   45    H    ASN   6           H        ASN   6  10.922 -20.278  -6.953
   46    HA   ASN   6           HA       ASN   6  10.100 -21.977  -9.136
   47    HB2  ASN   6           HB2      ASN   6   8.171 -20.353  -8.977
   48    HB3  ASN   6           HB3      ASN   6   9.308 -19.012  -9.113
   49   HD21  ASN   6          HD22      ASN   6   6.995 -20.019 -10.902
   50   HD22  ASN   6          HD21      ASN   6   7.729 -20.155 -12.476
   51    H    GLN   7           H        GLN   7  11.918 -21.805 -10.628
   52    HA   GLN   7           HA       GLN   7  14.274 -20.572  -9.573
   53    HB2  GLN   7           HB2      GLN   7  14.100 -22.624 -11.101
   54    HB3  GLN   7           HB3      GLN   7  13.878 -21.498 -12.448
   55    HG2  GLN   7           HG2      GLN   7  16.072 -20.473 -11.957
   56    HG3  GLN   7           HG3      GLN   7  16.256 -21.486 -10.526
   57   HE21  GLN   7          HE22      GLN   7  18.305 -21.535 -12.135
   58   HE22  GLN   7          HE21      GLN   7  18.384 -23.001 -13.109
   59    H    THR   8           H        THR   8  11.678 -19.253 -11.441
   60    HA   THR   8           HA       THR   8  13.282 -16.834 -12.094
   61    HB   THR   8           HB       THR   8  10.801 -17.900 -13.499
   62    HG1  THR   8           HG1      THR   8  12.477 -19.282 -13.912
   63   HG21  THR   8          HG21      THR   8  12.754 -15.663 -14.205
   64   HG22  THR   8          HG22      THR   8  11.497 -16.293 -15.295
   65   HG23  THR   8          HG23      THR   8  11.042 -15.489 -13.786
   66    H    ILE   9           H        ILE   9  12.499 -14.944 -11.276
   67    HA   ILE   9           HA       ILE   9   9.840 -14.969  -9.939
   68    HB   ILE   9           HB       ILE   9  10.538 -13.782  -8.111
   69   HG12  ILE   9          HG12      ILE   9  12.982 -12.958  -9.660
   70   HG13  ILE   9          HG13      ILE   9  11.687 -11.950  -9.045
   71   HG21  ILE   9          HG21      ILE   9  12.965 -15.535  -8.608
   72   HG22  ILE   9          HG22      ILE   9  12.293 -15.059  -7.050
   73   HG23  ILE   9          HG23      ILE   9  11.365 -16.132  -8.101
   74   HD11  ILE   9          HD11      ILE   9  12.408 -12.485  -6.698
   75   HD12  ILE   9          HD12      ILE   9  13.825 -13.305  -7.356
   76   HD13  ILE   9          HD13      ILE   9  13.596 -11.576  -7.660
   77    H    TYR  10           H        TYR  10   9.024 -12.683  -9.742
   78    HA   TYR  10           HA       TYR  10   9.431 -11.163 -12.274
   79    HD1  TYR  10           HD1      TYR  10   8.046 -10.326 -14.080
   80    HD2  TYR  10           HD2      TYR  10   4.878 -11.541 -11.413
   81    HE1  TYR  10           HE1      TYR  10   6.468  -8.848 -15.286
   82    HE2  TYR  10           HE2      TYR  10   3.305 -10.125 -12.633
   83    HH   TYR  10           HH       TYR  10   3.025  -8.494 -14.235
   84    HB2  TYR  10           HB2      TYR  10   7.716 -12.798 -12.641
   85    HB3  TYR  10           HB3      TYR  10   6.949 -12.442 -11.102
   86    H    ILE  11           H        ILE  11   9.676  -9.138 -11.810
   87    HA   ILE  11           HA       ILE  11   9.142  -8.069  -9.082
   88    HB   ILE  11           HB       ILE  11  11.094  -7.389 -11.329
   89   HG12  ILE  11          HG12      ILE  11  11.670  -8.177  -8.434
   90   HG13  ILE  11          HG13      ILE  11  11.513  -9.375  -9.712
   91   HG21  ILE  11          HG21      ILE  11  10.725  -5.886  -8.699
   92   HG22  ILE  11          HG22      ILE  11  11.996  -5.594  -9.911
   93   HG23  ILE  11          HG23      ILE  11  10.317  -5.269 -10.316
   94   HD11  ILE  11          HD11      ILE  11  13.822  -9.010  -9.349
   95   HD12  ILE  11          HD12      ILE  11  13.407  -8.341 -10.936
   96   HD13  ILE  11          HD13      ILE  11  13.660  -7.249  -9.549
   97    H    ASN  12           H        ASN  12   7.610  -6.454  -8.945
   98    HA   ASN  12           HA       ASN  12   6.174  -5.816 -11.482
   99    HB2  ASN  12           HB2      ASN  12   5.347  -7.543  -9.618
  100    HB3  ASN  12           HB3      ASN  12   4.784  -6.074  -8.824
  101   HD21  ASN  12          HD22      ASN  12   4.644  -8.004 -11.825
  102   HD22  ASN  12          HD21      ASN  12   3.026  -7.496 -12.262
  103    H    ASN  13           H        ASN  13   7.801  -4.122  -9.038
  104    HA   ASN  13           HA       ASN  13   6.230  -1.722  -9.651
  105    HB2  ASN  13           HB2      ASN  13   5.428  -2.646  -7.438
  106    HB3  ASN  13           HB3      ASN  13   7.058  -2.375  -6.802
  107   HD21  ASN  13          HD21      ASN  13   6.818  -0.576  -5.427
  108   HD22  ASN  13          HD22      ASN  13   5.957   0.886  -5.868
  109    H    LEU  14           H        LEU  14   8.444  -2.434 -10.917
  110    HA   LEU  14           HA       LEU  14  10.925  -1.395  -9.799
  111    HG   LEU  14           HG       LEU  14  12.593  -2.823 -11.028
  112    HB2  LEU  14           HB2      LEU  14  10.278  -3.141 -11.779
  113    HB3  LEU  14           HB3      LEU  14  10.353  -1.681 -12.748
  114   HD11  LEU  14          HD11      LEU  14  12.020  -4.249 -12.920
  115   HD12  LEU  14          HD12      LEU  14  12.045  -2.867 -14.036
  116   HD13  LEU  14          HD13      LEU  14  13.538  -3.424 -13.284
  117   HD21  LEU  14          HD21      LEU  14  12.987  -0.429 -11.248
  118   HD22  LEU  14          HD22      LEU  14  14.069  -1.268 -12.350
  119   HD23  LEU  14          HD23      LEU  14  12.611  -0.484 -12.990
  120    H    ASN  15           H        ASN  15  11.685   0.788 -10.153
  121    HA   ASN  15           HA       ASN  15   9.723   2.790 -10.954
  122    HB2  ASN  15           HB2      ASN  15  11.510   3.256  -9.285
  123    HB3  ASN  15           HB3      ASN  15  12.727   3.117 -10.554
  124   HD21  ASN  15          HD22      ASN  15  11.827   5.501  -8.842
  125   HD22  ASN  15          HD21      ASN  15  11.392   6.726 -10.004
  126    H    GLU  16           H        GLU  16   9.105   3.015 -12.992
  127    HA   GLU  16           HA       GLU  16  10.334   1.700 -15.123
  128    HB2  GLU  16           HB2      GLU  16   8.647   2.686 -16.487
  129    HB3  GLU  16           HB3      GLU  16   7.932   2.209 -14.960
  130    HG2  GLU  16           HG2      GLU  16   8.714   5.051 -15.765
  131    HG3  GLU  16           HG3      GLU  16   7.097   4.375 -15.858
  132    H    LYS  17           H        LYS  17  11.415   4.736 -13.814
  133    HA   LYS  17           HA       LYS  17  12.372   5.767 -16.326
  134    HB2  LYS  17           HB2      LYS  17  13.465   7.425 -15.130
  135    HB3  LYS  17           HB3      LYS  17  12.030   7.080 -14.171
  136    HG2  LYS  17           HG2      LYS  17  13.539   5.592 -12.700
  137    HG3  LYS  17           HG3      LYS  17  14.909   6.234 -13.617
  138    HD2  LYS  17           HD2      LYS  17  14.295   8.535 -12.966
  139    HD3  LYS  17           HD3      LYS  17  12.921   7.909 -12.030
  140    HE2  LYS  17           HE2      LYS  17  14.461   6.630 -10.583
  141    HE3  LYS  17           HE3      LYS  17  15.845   7.165 -11.546
  142    HZ1  LYS  17           HZ1      LYS  17  14.096   8.961  -9.960
  143    HZ2  LYS  17           HZ2      LYS  17  15.600   8.490  -9.544
  144    HZ3  LYS  17           HZ3      LYS  17  15.382   9.438 -10.848
  145    H    ILE  18           H        ILE  18  13.512   3.248 -14.171
  146    HA   ILE  18           HA       ILE  18  16.296   3.563 -14.612
  147    HB   ILE  18           HB       ILE  18  14.660   1.150 -13.736
  148   HG12  ILE  18          HG12      ILE  18  14.311   3.032 -12.231
  149   HG13  ILE  18          HG13      ILE  18  15.288   1.818 -11.445
  150   HG21  ILE  18          HG21      ILE  18  16.735   0.338 -12.636
  151   HG22  ILE  18          HG22      ILE  18  16.843   0.339 -14.393
  152   HG23  ILE  18          HG23      ILE  18  17.658   1.611 -13.459
  153   HD11  ILE  18          HD11      ILE  18  16.078   4.061 -10.913
  154   HD12  ILE  18          HD12      ILE  18  17.320   3.248 -11.882
  155   HD13  ILE  18          HD13      ILE  18  16.262   4.470 -12.617
  156    H    LYS  19           H        LYS  19  17.699   2.772 -16.057
  157    HA   LYS  19           HA       LYS  19  16.729   1.952 -18.673
  158    HB2  LYS  19           HB2      LYS  19  18.668   3.506 -18.208
  159    HB3  LYS  19           HB3      LYS  19  19.550   2.152 -17.505
  160    HG2  LYS  19           HG2      LYS  19  19.501   1.012 -19.742
  161    HG3  LYS  19           HG3      LYS  19  18.668   2.429 -20.411
  162    HD2  LYS  19           HD2      LYS  19  20.615   3.849 -19.792
  163    HD3  LYS  19           HD3      LYS  19  21.416   2.441 -19.069
  164    HE2  LYS  19           HE2      LYS  19  21.246   1.313 -21.365
  165    HE3  LYS  19           HE3      LYS  19  20.710   2.871 -22.004
  166    HZ1  LYS  19           HZ1      LYS  19  22.849   3.794 -21.186
  167    HZ2  LYS  19           HZ2      LYS  19  23.327   2.287 -20.716
  168    HZ3  LYS  19           HZ3      LYS  19  23.071   2.620 -22.295
  169    H    LYS  20           H        LYS  20  17.279  -0.112 -19.695
  170    HA   LYS  20           HA       LYS  20  16.980  -2.461 -18.167
  171    HB2  LYS  20           HB2      LYS  20  16.643  -2.253 -20.648
  172    HB3  LYS  20           HB3      LYS  20  18.402  -2.129 -20.851
  173    HG2  LYS  20           HG2      LYS  20  18.629  -4.427 -19.820
  174    HG3  LYS  20           HG3      LYS  20  16.875  -4.497 -19.674
  175    HD2  LYS  20           HD2      LYS  20  17.538  -5.757 -21.610
  176    HD3  LYS  20           HD3      LYS  20  16.695  -4.306 -22.172
  177    HE2  LYS  20           HE2      LYS  20  18.877  -3.225 -22.666
  178    HE3  LYS  20           HE3      LYS  20  19.732  -4.636 -22.025
  179    HZ1  LYS  20           HZ1      LYS  20  19.601  -4.701 -24.429
  180    HZ2  LYS  20           HZ2      LYS  20  18.765  -5.955 -23.817
  181    HZ3  LYS  20           HZ3      LYS  20  17.974  -4.652 -24.413
  182    H    GLU  21           H        GLU  21  19.987  -0.919 -19.376
  183    HA   GLU  21           HA       GLU  21  21.814  -2.814 -18.353
  184    HB2  GLU  21           HB2      GLU  21  22.386  -1.181 -20.028
  185    HB3  GLU  21           HB3      GLU  21  21.999   0.158 -18.944
  186    HG2  GLU  21           HG2      GLU  21  23.916  -0.366 -17.511
  187    HG3  GLU  21           HG3      GLU  21  24.263  -1.819 -18.454
  188    H    GLU  22           H        GLU  22  20.319   0.066 -16.788
  189    HA   GLU  22           HA       GLU  22  22.002  -0.126 -14.447
  190    HB2  GLU  22           HB2      GLU  22  19.454   1.406 -15.061
  191    HB3  GLU  22           HB3      GLU  22  20.284   1.517 -13.507
  192    HG2  GLU  22           HG2      GLU  22  21.643   2.136 -16.170
  193    HG3  GLU  22           HG3      GLU  22  20.810   3.341 -15.196
  194    H    LEU  23           H        LEU  23  18.752  -1.304 -15.320
  195    HA   LEU  23           HA       LEU  23  18.078  -2.511 -12.810
  196    HG   LEU  23           HG       LEU  23  15.327  -4.199 -14.976
  197    HB2  LEU  23           HB2      LEU  23  16.420  -2.196 -14.505
  198    HB3  LEU  23           HB3      LEU  23  17.353  -3.003 -15.732
  199   HD11  LEU  23          HD11      LEU  23  17.208  -5.387 -16.094
  200   HD12  LEU  23          HD12      LEU  23  17.761  -5.912 -14.494
  201   HD13  LEU  23          HD13      LEU  23  16.167  -6.390 -15.068
  202   HD21  LEU  23          HD21      LEU  23  16.888  -4.852 -12.442
  203   HD22  LEU  23          HD22      LEU  23  15.603  -3.646 -12.515
  204   HD23  LEU  23          HD23      LEU  23  15.240  -5.351 -12.859
  205    H    LYS  24           H        LYS  24  19.770  -3.853 -15.706
  206    HA   LYS  24           HA       LYS  24  20.246  -6.391 -14.571
  207    HB2  LYS  24           HB2      LYS  24  20.437  -5.766 -16.986
  208    HB3  LYS  24           HB3      LYS  24  21.937  -4.897 -16.633
  209    HG2  LYS  24           HG2      LYS  24  22.981  -7.023 -15.870
  210    HG3  LYS  24           HG3      LYS  24  21.458  -7.881 -16.188
  211    HD2  LYS  24           HD2      LYS  24  21.598  -7.240 -18.581
  212    HD3  LYS  24           HD3      LYS  24  23.135  -6.422 -18.290
  213    HE2  LYS  24           HE2      LYS  24  22.608  -9.396 -17.808
  214    HE3  LYS  24           HE3      LYS  24  23.309  -8.733 -19.285
  215    HZ1  LYS  24           HZ1      LYS  24  24.547  -8.544 -16.599
  216    HZ2  LYS  24           HZ2      LYS  24  25.025  -9.515 -17.814
  217    HZ3  LYS  24           HZ3      LYS  24  25.171  -7.904 -17.972
  218    H    LYS  25           H        LYS  25  22.330  -3.472 -14.587
  219    HA   LYS  25           HA       LYS  25  24.463  -4.540 -13.087
  220    HB2  LYS  25           HB2      LYS  25  24.626  -2.422 -14.275
  221    HB3  LYS  25           HB3      LYS  25  23.342  -1.711 -13.298
  222    HG2  LYS  25           HG2      LYS  25  25.525  -0.856 -12.660
  223    HG3  LYS  25           HG3      LYS  25  24.759  -1.705 -11.324
  224    HD2  LYS  25           HD2      LYS  25  27.146  -2.203 -11.449
  225    HD3  LYS  25           HD3      LYS  25  26.185  -3.667 -11.707
  226    HE2  LYS  25           HE2      LYS  25  26.563  -3.598 -14.092
  227    HE3  LYS  25           HE3      LYS  25  27.316  -2.001 -13.986
  228    HZ1  LYS  25           HZ1      LYS  25  28.444  -4.492 -12.832
  229    HZ2  LYS  25           HZ2      LYS  25  28.969  -3.750 -14.184
  230    HZ3  LYS  25           HZ3      LYS  25  29.138  -3.013 -12.743
  231    H    SER  26           H        SER  26  21.478  -2.842 -11.906
  232    HA   SER  26           HA       SER  26  22.275  -2.902  -9.202
  233    HG   SER  26           HG       SER  26  20.629  -1.135 -11.145
  234    HB2  SER  26           HB2      SER  26  19.481  -2.822 -10.385
  235    HB3  SER  26           HB3      SER  26  19.920  -2.396  -8.713
  236    H    LEU  27           H        LEU  27  20.306  -5.243 -11.056
  237    HA   LEU  27           HA       LEU  27  19.748  -6.995  -8.869
  238    HG   LEU  27           HG       LEU  27  17.961  -6.238 -11.040
  239    HB2  LEU  27           HB2      LEU  27  20.036  -7.429 -11.853
  240    HB3  LEU  27           HB3      LEU  27  19.646  -8.759 -10.765
  241   HD11  LEU  27          HD11      LEU  27  18.004  -7.611 -13.100
  242   HD12  LEU  27          HD12      LEU  27  17.496  -9.027 -12.164
  243   HD13  LEU  27          HD13      LEU  27  16.409  -7.631 -12.335
  244   HD21  LEU  27          HD21      LEU  27  17.566  -7.261  -8.896
  245   HD22  LEU  27          HD22      LEU  27  16.214  -7.679  -9.939
  246   HD23  LEU  27          HD23      LEU  27  17.481  -8.887  -9.622
  247    H    TYR  28           H        TYR  28  22.432  -7.076 -11.305
  248    HA   TYR  28           HA       TYR  28  23.757  -9.278 -10.123
  249    HD1  TYR  28           HD1      TYR  28  24.977 -10.695 -12.159
  250    HD2  TYR  28           HD2      TYR  28  27.308  -7.247 -11.011
  251    HE1  TYR  28           HE1      TYR  28  27.032 -12.082 -12.178
  252    HE2  TYR  28           HE2      TYR  28  29.363  -8.622 -11.024
  253    HH   TYR  28           HH       TYR  28  30.273 -10.740 -11.379
  254    HB2  TYR  28           HB2      TYR  28  24.121  -8.332 -12.418
  255    HB3  TYR  28           HB3      TYR  28  24.991  -6.985 -11.692
  256    H    ALA  29           H        ALA  29  23.919  -5.798  -9.362
  257    HA   ALA  29           HA       ALA  29  26.251  -5.908  -7.775
  258    HB1  ALA  29           HB1      ALA  29  25.558  -3.675  -6.993
  259    HB2  ALA  29           HB2      ALA  29  25.422  -3.826  -8.752
  260    HB3  ALA  29           HB3      ALA  29  23.962  -3.897  -7.730
  261    H    ILE  30           H        ILE  30  22.737  -6.121  -6.872
  262    HA   ILE  30           HA       ILE  30  23.639  -6.764  -4.087
  263    HB   ILE  30           HB       ILE  30  21.511  -5.634  -3.371
  264   HG12  ILE  30          HG12      ILE  30  21.741  -4.045  -5.938
  265   HG13  ILE  30          HG13      ILE  30  20.547  -5.333  -5.700
  266   HG21  ILE  30          HG21      ILE  30  22.701  -3.486  -3.132
  267   HG22  ILE  30          HG22      ILE  30  23.866  -4.801  -3.012
  268   HG23  ILE  30          HG23      ILE  30  23.740  -3.874  -4.518
  269   HD11  ILE  30          HD11      ILE  30  20.768  -2.787  -4.034
  270   HD12  ILE  30          HD12      ILE  30  19.568  -3.137  -5.278
  271   HD13  ILE  30          HD13      ILE  30  19.588  -4.097  -3.783
  272    H    PHE  31           H        PHE  31  21.059  -7.569  -6.449
  273    HA   PHE  31           HA       PHE  31  19.665  -9.285  -4.598
  274    HD1  PHE  31           HD1      PHE  31  18.595  -6.876  -6.226
  275    HD2  PHE  31           HD2      PHE  31  16.890 -10.800  -6.755
  276    HE1  PHE  31           HE1      PHE  31  16.313  -5.925  -6.028
  277    HE2  PHE  31           HE2      PHE  31  14.615  -9.844  -6.520
  278    HZ   PHE  31           HZ       PHE  31  14.324  -7.408  -6.170
  279    HB2  PHE  31           HB2      PHE  31  19.714  -9.094  -7.598
  280    HB3  PHE  31           HB3      PHE  31  19.162 -10.577  -6.873
  281    H    SER  32           H        SER  32  22.527  -9.839  -6.691
  282    HA   SER  32           HA       SER  32  22.901 -12.530  -6.412
  283    HG   SER  32           HG       SER  32  24.784 -10.045  -8.202
  284    HB2  SER  32           HB2      SER  32  25.064 -10.411  -6.185
  285    HB3  SER  32           HB3      SER  32  25.272 -12.080  -6.749
  286    H    GLN  33           H        GLN  33  23.207 -10.183  -3.784
  287    HA   GLN  33           HA       GLN  33  24.885 -11.743  -2.038
  288    HB2  GLN  33           HB2      GLN  33  22.767  -9.663  -1.382
  289    HB3  GLN  33           HB3      GLN  33  24.015 -10.231  -0.282
  290    HG2  GLN  33           HG2      GLN  33  25.778  -9.231  -1.629
  291    HG3  GLN  33           HG3      GLN  33  24.628  -8.761  -2.886
  292   HE21  GLN  33          HE22      GLN  33  22.610  -7.510  -1.899
  293   HE22  GLN  33          HE21      GLN  33  23.036  -6.182  -0.824
  294    H    PHE  34           H        PHE  34  21.487 -11.921  -2.909
  295    HA   PHE  34           HA       PHE  34  20.913 -13.702  -0.592
  296    HD1  PHE  34           HD1      PHE  34  20.475 -12.076   1.387
  297    HD2  PHE  34           HD2      PHE  34  19.455  -9.593  -2.000
  298    HE1  PHE  34           HE1      PHE  34  21.261 -10.067   2.612
  299    HE2  PHE  34           HE2      PHE  34  20.211  -7.597  -0.758
  300    HZ   PHE  34           HZ       PHE  34  21.128  -7.823   1.545
  301    HB2  PHE  34           HB2      PHE  34  18.960 -11.901  -2.074
  302    HB3  PHE  34           HB3      PHE  34  18.685 -12.737  -0.553
  303    H    GLY  35           H        GLY  35  20.682 -13.317  -4.074
  304    HA2  GLY  35           HA2      GLY  35  20.328 -16.204  -4.238
  305    HA3  GLY  35           HA3      GLY  35  19.057 -15.241  -5.030
  306    H    GLN  36           H        GLN  36  22.214 -16.485  -5.331
  307    HA   GLN  36           HA       GLN  36  23.403 -14.642  -7.084
  308    HB2  GLN  36           HB2      GLN  36  24.642 -16.513  -6.182
  309    HB3  GLN  36           HB3      GLN  36  23.637 -17.669  -7.059
  310    HG2  GLN  36           HG2      GLN  36  25.867 -17.284  -8.123
  311    HG3  GLN  36           HG3      GLN  36  24.513 -16.941  -9.185
  312   HE21  GLN  36          HE22      GLN  36  24.740 -15.090 -10.400
  313   HE22  GLN  36          HE21      GLN  36  25.653 -13.677  -9.902
  314    H    ILE  37           H        ILE  37  22.867 -13.885  -8.931
  315    HA   ILE  37           HA       ILE  37  20.617 -14.497 -10.514
  316    HB   ILE  37           HB       ILE  37  23.250 -13.098 -11.188
  317   HG12  ILE  37          HG12      ILE  37  22.250 -12.067  -9.186
  318   HG13  ILE  37          HG13      ILE  37  22.292 -10.989 -10.563
  319   HG21  ILE  37          HG21      ILE  37  22.061 -13.495 -13.246
  320   HG22  ILE  37          HG22      ILE  37  20.548 -12.865 -12.560
  321   HG23  ILE  37          HG23      ILE  37  21.949 -11.796 -12.843
  322   HD11  ILE  37          HD11      ILE  37  19.810 -12.499  -9.654
  323   HD12  ILE  37          HD12      ILE  37  20.204 -10.817  -9.251
  324   HD13  ILE  37          HD13      ILE  37  19.912 -11.263 -10.937
  325    H    LEU  38           H        LEU  38  20.396 -15.656 -12.420
  326    HA   LEU  38           HA       LEU  38  22.745 -17.063 -13.556
  327    HG   LEU  38           HG       LEU  38  20.693 -18.770 -15.443
  328    HB2  LEU  38           HB2      LEU  38  21.295 -18.681 -12.447
  329    HB3  LEU  38           HB3      LEU  38  19.872 -18.011 -13.248
  330   HD11  LEU  38          HD11      LEU  38  22.983 -20.037 -13.872
  331   HD12  LEU  38          HD12      LEU  38  22.623 -20.313 -15.589
  332   HD13  LEU  38          HD13      LEU  38  23.141 -18.714 -15.054
  333   HD21  LEU  38          HD21      LEU  38  19.249 -20.223 -14.084
  334   HD22  LEU  38          HD22      LEU  38  20.378 -21.179 -15.053
  335   HD23  LEU  38          HD23      LEU  38  20.672 -20.948 -13.312
  336    H    ASP  39           H        ASP  39  19.560 -15.371 -14.125
  337    HA   ASP  39           HA       ASP  39  20.718 -14.149 -16.480
  338    HB2  ASP  39           HB2      ASP  39  19.922 -16.306 -17.463
  339    HB3  ASP  39           HB3      ASP  39  18.298 -15.960 -16.883
  340    H    ILE  40           H        ILE  40  19.089 -12.492 -17.416
  341    HA   ILE  40           HA       ILE  40  17.109 -11.507 -15.440
  342    HB   ILE  40           HB       ILE  40  19.594 -10.033 -16.422
  343   HG12  ILE  40          HG12      ILE  40  18.578 -10.474 -13.584
  344   HG13  ILE  40          HG13      ILE  40  19.802 -11.478 -14.343
  345   HG21  ILE  40          HG21      ILE  40  17.182  -8.862 -14.971
  346   HG22  ILE  40          HG22      ILE  40  18.707  -8.004 -15.306
  347   HG23  ILE  40          HG23      ILE  40  17.695  -8.489 -16.633
  348   HD11  ILE  40          HD11      ILE  40  20.178  -8.523 -13.805
  349   HD12  ILE  40          HD12      ILE  40  20.783  -9.842 -12.812
  350   HD13  ILE  40          HD13      ILE  40  21.373  -9.656 -14.475
  351    H    VAL  41           H        VAL  41  15.438 -10.349 -16.486
  352    HA   VAL  41           HA       VAL  41  15.755  -9.687 -19.353
  353    HB   VAL  41           HB       VAL  41  13.394 -11.259 -18.247
  354   HG11  VAL  41          HG11      VAL  41  12.703 -11.422 -20.616
  355   HG12  VAL  41          HG12      VAL  41  12.772  -9.741 -20.093
  356   HG13  VAL  41          HG13      VAL  41  14.080 -10.407 -21.095
  357   HG21  VAL  41          HG21      VAL  41  15.270 -12.809 -18.419
  358   HG22  VAL  41          HG22      VAL  41  14.123 -13.114 -19.719
  359   HG23  VAL  41          HG23      VAL  41  15.628 -12.236 -20.065
  360    H    ALA  42           H        ALA  42  15.363  -7.583 -19.457
  361    HA   ALA  42           HA       ALA  42  12.842  -6.466 -18.557
  362    HB1  ALA  42           HB1      ALA  42  14.340  -5.844 -16.688
  363    HB2  ALA  42           HB2      ALA  42  15.533  -5.199 -17.840
  364    HB3  ALA  42           HB3      ALA  42  13.945  -4.422 -17.668
  365    H    LEU  43           H        LEU  43  12.705  -4.233 -19.778
  366    HA   LEU  43           HA       LEU  43  14.240  -4.180 -22.316
  367    HG   LEU  43           HG       LEU  43  12.250  -6.621 -22.100
  368    HB2  LEU  43           HB2      LEU  43  11.200  -4.310 -22.134
  369    HB3  LEU  43           HB3      LEU  43  12.096  -3.975 -23.598
  370   HD11  LEU  43          HD11      LEU  43  10.864  -7.502 -23.929
  371   HD12  LEU  43          HD12      LEU  43  10.007  -6.242 -23.038
  372   HD13  LEU  43          HD13      LEU  43  10.714  -5.869 -24.622
  373   HD21  LEU  43          HD21      LEU  43  13.258  -5.804 -24.871
  374   HD22  LEU  43          HD22      LEU  43  14.278  -6.156 -23.460
  375   HD23  LEU  43          HD23      LEU  43  13.312  -7.442 -24.180
  376    H    LYS  44           H        LYS  44  13.584  -2.138 -23.558
  377    HA   LYS  44           HA       LYS  44  13.317   0.138 -21.748
  378    HB2  LYS  44           HB2      LYS  44  13.146   0.019 -24.799
  379    HB3  LYS  44           HB3      LYS  44  13.322   1.482 -23.844
  380    HG2  LYS  44           HG2      LYS  44  15.376  -0.766 -24.069
  381    HG3  LYS  44           HG3      LYS  44  15.436   0.756 -24.927
  382    HD2  LYS  44           HD2      LYS  44  15.610   0.428 -21.899
  383    HD3  LYS  44           HD3      LYS  44  16.975   0.664 -22.976
  384    HE2  LYS  44           HE2      LYS  44  14.719   2.672 -22.521
  385    HE3  LYS  44           HE3      LYS  44  16.326   2.741 -21.794
  386    HZ1  LYS  44           HZ1      LYS  44  16.204   4.178 -23.711
  387    HZ2  LYS  44           HZ2      LYS  44  17.263   2.983 -24.025
  388    HZ3  LYS  44           HZ3      LYS  44  15.774   2.960 -24.700
  389    H    THR  45           H        THR  45  11.124  -1.835 -23.700
  390    HA   THR  45           HA       THR  45   8.904  -0.182 -23.878
  391    HB   THR  45           HB       THR  45   8.835  -3.178 -23.333
  392    HG1  THR  45           HG1      THR  45   9.421  -3.491 -25.482
  393   HG21  THR  45          HG21      THR  45   6.656  -2.066 -23.742
  394   HG22  THR  45          HG22      THR  45   7.272  -1.412 -25.276
  395   HG23  THR  45          HG23      THR  45   7.072  -3.167 -25.062
  396    H    LEU  46           H        LEU  46   7.410   0.537 -22.377
  397    HA   LEU  46           HA       LEU  46   7.957   0.692 -19.712
  398    HG   LEU  46           HG       LEU  46   4.931   0.503 -18.609
  399    HB2  LEU  46           HB2      LEU  46   6.317   2.115 -20.816
  400    HB3  LEU  46           HB3      LEU  46   5.243   0.740 -21.085
  401   HD11  LEU  46          HD11      LEU  46   7.009   1.501 -17.775
  402   HD12  LEU  46          HD12      LEU  46   6.564   3.078 -18.468
  403   HD13  LEU  46          HD13      LEU  46   5.621   2.379 -17.132
  404   HD21  LEU  46          HD21      LEU  46   4.269   3.239 -19.742
  405   HD22  LEU  46          HD22      LEU  46   3.334   1.737 -19.955
  406   HD23  LEU  46          HD23      LEU  46   3.489   2.451 -18.346
  407    H    LYS  47           H        LYS  47   5.791  -1.765 -21.181
  408    HA   LYS  47           HA       LYS  47   4.881  -2.900 -18.795
  409    HB2  LYS  47           HB2      LYS  47   3.955  -3.217 -21.102
  410    HB3  LYS  47           HB3      LYS  47   5.300  -4.309 -21.469
  411    HG2  LYS  47           HG2      LYS  47   4.506  -5.906 -19.778
  412    HG3  LYS  47           HG3      LYS  47   3.300  -4.745 -19.203
  413    HD2  LYS  47           HD2      LYS  47   2.223  -6.436 -20.551
  414    HD3  LYS  47           HD3      LYS  47   2.129  -4.877 -21.382
  415    HE2  LYS  47           HE2      LYS  47   4.049  -5.539 -22.829
  416    HE3  LYS  47           HE3      LYS  47   4.161  -7.083 -21.976
  417    HZ1  LYS  47           HZ1      LYS  47   1.834  -6.188 -23.582
  418    HZ2  LYS  47           HZ2      LYS  47   2.938  -7.290 -24.047
  419    HZ3  LYS  47           HZ3      LYS  47   1.943  -7.623 -22.802
  420    H    MET  48           H        MET  48   8.076  -3.177 -20.152
  421    HA   MET  48           HA       MET  48   8.774  -5.207 -18.110
  422    HB2  MET  48           HB2      MET  48   9.458  -5.135 -21.048
  423    HB3  MET  48           HB3      MET  48  10.519  -5.980 -19.919
  424    HG2  MET  48           HG2      MET  48   7.592  -6.643 -19.808
  425    HG3  MET  48           HG3      MET  48   8.511  -7.175 -21.213
  426    HE1  MET  48           HE1      MET  48   9.111  -8.636 -16.867
  427    HE2  MET  48           HE2      MET  48   9.597  -6.995 -17.324
  428    HE3  MET  48           HE3      MET  48   7.884  -7.480 -17.429
  429    H    ARG  49           H        ARG  49   8.817  -2.193 -18.333
  430    HA   ARG  49           HA       ARG  49  11.622  -1.915 -17.368
  431    HE   ARG  49           HE       ARG  49  13.752   2.442 -18.055
  432    HB2  ARG  49           HB2      ARG  49  10.869  -0.606 -19.474
  433    HB3  ARG  49           HB3      ARG  49   9.886   0.363 -18.373
  434    HG2  ARG  49           HG2      ARG  49  11.928   1.026 -17.135
  435    HG3  ARG  49           HG3      ARG  49  12.913  -0.039 -18.163
  436    HD2  ARG  49           HD2      ARG  49  12.297   1.219 -20.152
  437    HD3  ARG  49           HD3      ARG  49  11.201   2.252 -19.213
  438   HH11  ARG  49          HH21      ARG  49  12.220   3.228 -21.161
  439   HH12  ARG  49          HH22      ARG  49  13.097   4.693 -21.405
  440   HH21  ARG  49          HH11      ARG  49  14.804   4.525 -18.293
  441   HH22  ARG  49          HH12      ARG  49  14.707   5.364 -19.797
  442    H    GLY  50           H        GLY  50   8.140  -1.295 -16.802
  443    HA2  GLY  50           HA2      GLY  50   8.601  -0.385 -14.043
  444    HA3  GLY  50           HA3      GLY  50   7.051  -0.666 -14.856
  445    H    GLN  51           H        GLN  51   8.662  -3.354 -15.683
  446    HA   GLN  51           HA       GLN  51   8.431  -4.906 -13.204
  447    HB2  GLN  51           HB2      GLN  51   7.155  -5.654 -15.891
  448    HB3  GLN  51           HB3      GLN  51   7.380  -6.760 -14.558
  449    HG2  GLN  51           HG2      GLN  51   5.421  -6.207 -13.708
  450    HG3  GLN  51           HG3      GLN  51   5.965  -4.563 -13.427
  451   HE21  GLN  51          HE22      GLN  51   4.035  -6.674 -15.474
  452   HE22  GLN  51          HE21      GLN  51   3.364  -5.410 -16.486
  453    H    ALA  52           H        ALA  52   9.627  -7.035 -13.568
  454    HA   ALA  52           HA       ALA  52  11.300  -7.305 -15.932
  455    HB1  ALA  52           HB1      ALA  52  12.610  -6.823 -13.212
  456    HB2  ALA  52           HB2      ALA  52  13.442  -7.398 -14.671
  457    HB3  ALA  52           HB3      ALA  52  12.740  -5.777 -14.651
  458    H    PHE  53           H        PHE  53  12.618  -9.386 -15.681
  459    HA   PHE  53           HA       PHE  53  11.506 -11.260 -13.663
  460    HD1  PHE  53           HD2      PHE  53   9.600 -13.511 -14.391
  461    HD2  PHE  53           HD1      PHE  53  10.237 -10.703 -17.602
  462    HE1  PHE  53           HE2      PHE  53   7.189 -13.617 -14.973
  463    HE2  PHE  53           HE1      PHE  53   7.815 -10.794 -18.155
  464    HZ   PHE  53           HZ       PHE  53   6.291 -12.256 -16.839
  465    HB2  PHE  53           HB2      PHE  53  12.109 -11.895 -16.578
  466    HB3  PHE  53           HB3      PHE  53  11.843 -13.091 -15.334
  467    H    VAL  54           H        VAL  54  13.118 -12.765 -12.944
  468    HA   VAL  54           HA       VAL  54  15.773 -12.637 -14.099
  469    HB   VAL  54           HB       VAL  54  16.148 -10.788 -12.807
  470   HG11  VAL  54          HG11      VAL  54  15.596 -10.438 -10.448
  471   HG12  VAL  54          HG12      VAL  54  14.130 -10.717 -11.384
  472   HG13  VAL  54          HG13      VAL  54  14.807 -12.020 -10.384
  473   HG21  VAL  54          HG21      VAL  54  17.937 -12.389 -12.449
  474   HG22  VAL  54          HG22      VAL  54  17.677 -11.408 -11.000
  475   HG23  VAL  54          HG23      VAL  54  17.100 -13.080 -11.057
  476    H    ILE  55           H        ILE  55  16.978 -14.376 -13.587
  477    HA   ILE  55           HA       ILE  55  15.472 -16.738 -12.611
  478    HB   ILE  55           HB       ILE  55  17.489 -16.496 -14.891
  479   HG12  ILE  55          HG12      ILE  55  15.648 -17.228 -16.425
  480   HG13  ILE  55          HG13      ILE  55  14.487 -16.913 -15.152
  481   HG21  ILE  55          HG21      ILE  55  16.891 -18.840 -15.388
  482   HG22  ILE  55          HG22      ILE  55  17.545 -18.673 -13.765
  483   HG23  ILE  55          HG23      ILE  55  15.788 -18.855 -13.993
  484   HD11  ILE  55          HD11      ILE  55  16.294 -14.753 -16.311
  485   HD12  ILE  55          HD12      ILE  55  14.718 -15.180 -16.997
  486   HD13  ILE  55          HD13      ILE  55  14.798 -14.537 -15.367
  487    H    PHE  56           H        PHE  56  16.732 -18.075 -11.276
  488    HA   PHE  56           HA       PHE  56  19.413 -17.011 -10.469
  489    HD1  PHE  56           HD1      PHE  56  15.537 -16.429  -9.636
  490    HD2  PHE  56           HD2      PHE  56  19.295 -15.349  -7.845
  491    HE1  PHE  56           HE1      PHE  56  14.768 -14.086  -9.389
  492    HE2  PHE  56           HE2      PHE  56  18.481 -13.024  -7.516
  493    HZ   PHE  56           HZ       PHE  56  16.203 -12.397  -8.295
  494    HB2  PHE  56           HB2      PHE  56  17.203 -18.185  -8.751
  495    HB3  PHE  56           HB3      PHE  56  18.780 -17.651  -8.188
  496    H    LYS  57           H        LYS  57  20.657 -18.663  -9.146
  497    HA   LYS  57           HA       LYS  57  21.197 -20.918 -10.775
  498    HB2  LYS  57           HB2      LYS  57  21.897 -20.400  -7.850
  499    HB3  LYS  57           HB3      LYS  57  22.611 -21.681  -8.823
  500    HG2  LYS  57           HG2      LYS  57  22.825 -18.716  -9.505
  501    HG3  LYS  57           HG3      LYS  57  24.026 -19.622  -8.585
  502    HD2  LYS  57           HD2      LYS  57  24.481 -21.081 -10.482
  503    HD3  LYS  57           HD3      LYS  57  23.207 -20.298 -11.445
  504    HE2  LYS  57           HE2      LYS  57  24.362 -18.163 -11.380
  505    HE3  LYS  57           HE3      LYS  57  25.570 -18.798 -10.256
  506    HZ1  LYS  57           HZ1      LYS  57  26.429 -18.744 -12.507
  507    HZ2  LYS  57           HZ2      LYS  57  26.358 -20.284 -11.992
  508    HZ3  LYS  57           HZ3      LYS  57  25.251 -19.724 -13.055
  509    H    GLU  58           H        GLU  58  18.972 -20.676  -7.983
  510    HA   GLU  58           HA       GLU  58  17.996 -23.371  -8.532
  511    HB2  GLU  58           HB2      GLU  58  19.989 -23.704  -7.054
  512    HB3  GLU  58           HB3      GLU  58  19.306 -22.589  -5.879
  513    HG2  GLU  58           HG2      GLU  58  19.047 -24.914  -5.196
  514    HG3  GLU  58           HG3      GLU  58  17.486 -24.135  -5.391
  515    H    ILE  59           H        ILE  59  15.982 -23.770  -7.363
  516    HA   ILE  59           HA       ILE  59  14.293 -21.488  -7.309
  517    HB   ILE  59           HB       ILE  59  12.547 -22.954  -6.625
  518   HG12  ILE  59          HG12      ILE  59  14.672 -25.009  -5.866
  519   HG13  ILE  59          HG13      ILE  59  13.576 -24.169  -4.769
  520   HG21  ILE  59          HG21      ILE  59  14.334 -24.624  -8.425
  521   HG22  ILE  59          HG22      ILE  59  12.562 -24.511  -8.421
  522   HG23  ILE  59          HG23      ILE  59  13.528 -23.134  -8.944
  523   HD11  ILE  59          HD11      ILE  59  12.748 -26.387  -5.074
  524   HD12  ILE  59          HD12      ILE  59  11.635 -25.283  -5.907
  525   HD13  ILE  59          HD13      ILE  59  12.804 -26.253  -6.837
  526    H    GLY  60           H        GLY  60  16.104 -23.048  -4.662
  527    HA2  GLY  60           HA2      GLY  60  14.744 -21.668  -2.529
  528    HA3  GLY  60           HA3      GLY  60  16.339 -22.441  -2.457
  529    H    SER  61           H        SER  61  17.525 -20.897  -4.639
  530    HA   SER  61           HA       SER  61  18.409 -18.567  -3.169
  531    HG   SER  61           HG       SER  61  20.412 -20.055  -3.950
  532    HB2  SER  61           HB2      SER  61  18.793 -19.195  -6.129
  533    HB3  SER  61           HB3      SER  61  19.813 -18.181  -5.106
  534    H    ALA  62           H        ALA  62  16.297 -19.165  -6.013
  535    HA   ALA  62           HA       ALA  62  15.546 -16.487  -6.534
  536    HB1  ALA  62           HB1      ALA  62  15.063 -18.428  -8.026
  537    HB2  ALA  62           HB2      ALA  62  13.930 -19.062  -6.814
  538    HB3  ALA  62           HB3      ALA  62  13.592 -17.529  -7.623
  539    H    SER  63           H        SER  63  14.036 -18.942  -4.358
  540    HA   SER  63           HA       SER  63  11.921 -17.333  -3.413
  541    HG   SER  63           HG       SER  63  12.742 -20.322  -3.807
  542    HB2  SER  63           HB2      SER  63  13.448 -19.458  -1.844
  543    HB3  SER  63           HB3      SER  63  11.806 -18.878  -1.531
  544    H    ASN  64           H        ASN  64  15.241 -17.721  -2.140
  545    HA   ASN  64           HA       ASN  64  14.772 -16.050   0.129
  546    HB2  ASN  64           HB2      ASN  64  16.605 -17.745  -0.037
  547    HB3  ASN  64           HB3      ASN  64  17.435 -16.690  -1.184
  548   HD21  ASN  64          HD22      ASN  64  18.986 -15.430  -0.192
  549   HD22  ASN  64          HD21      ASN  64  18.917 -14.851   1.470
  550    H    ALA  65           H        ALA  65  16.129 -15.341  -3.109
  551    HA   ALA  65           HA       ALA  65  16.685 -12.587  -2.701
  552    HB1  ALA  65           HB1      ALA  65  16.438 -12.412  -5.159
  553    HB2  ALA  65           HB2      ALA  65  17.414 -13.818  -4.709
  554    HB3  ALA  65           HB3      ALA  65  15.726 -14.031  -5.228
  555    H    LEU  66           H        LEU  66  13.723 -14.182  -3.972
  556    HA   LEU  66           HA       LEU  66  12.109 -11.943  -4.357
  557    HG   LEU  66           HG       LEU  66   9.822 -12.883  -5.331
  558    HB2  LEU  66           HB2      LEU  66  11.741 -14.345  -5.014
  559    HB3  LEU  66           HB3      LEU  66  11.260 -14.711  -3.372
  560   HD11  LEU  66          HD11      LEU  66   9.711 -15.256  -5.923
  561   HD12  LEU  66          HD12      LEU  66   9.207 -15.678  -4.273
  562   HD13  LEU  66          HD13      LEU  66   8.137 -14.727  -5.316
  563   HD21  LEU  66          HD21      LEU  66   9.254 -12.054  -3.124
  564   HD22  LEU  66          HD22      LEU  66   7.906 -13.000  -3.721
  565   HD23  LEU  66          HD23      LEU  66   9.006 -13.710  -2.513
  566    H    ARG  67           H        ARG  67  12.254 -14.025  -1.409
  567    HA   ARG  67           HA       ARG  67  10.370 -12.397  -0.006
  568    HE   ARG  67           HE       ARG  67   9.478 -16.562   2.916
  569    HB2  ARG  67           HB2      ARG  67  12.382 -14.506   0.907
  570    HB3  ARG  67           HB3      ARG  67  11.195 -13.777   1.997
  571    HG2  ARG  67           HG2      ARG  67   9.337 -14.682   0.792
  572    HG3  ARG  67           HG3      ARG  67  10.332 -15.133  -0.589
  573    HD2  ARG  67           HD2      ARG  67   9.758 -17.112   0.641
  574    HD3  ARG  67           HD3      ARG  67  11.493 -16.848   0.733
  575   HH11  ARG  67          HH21      ARG  67  12.947 -16.528   2.083
  576   HH12  ARG  67          HH22      ARG  67  13.446 -16.608   3.732
  577   HH21  ARG  67          HH11      ARG  67  10.083 -16.692   4.938
  578   HH22  ARG  67          HH12      ARG  67  11.759 -16.709   5.455
  579    H    THR  68           H        THR  68  13.989 -12.374   0.002
  580    HA   THR  68           HA       THR  68  14.140 -10.530   2.201
  581    HB   THR  68           HB       THR  68  16.176 -11.041  -0.012
  582    HG1  THR  68           HG1      THR  68  15.812 -12.940   0.899
  583   HG21  THR  68          HG21      THR  68  16.796  -9.074   1.300
  584   HG22  THR  68          HG22      THR  68  16.476  -9.937   2.822
  585   HG23  THR  68          HG23      THR  68  17.825 -10.428   1.775
  586    H    MET  69           H        MET  69  14.047 -10.101  -1.373
  587    HA   MET  69           HA       MET  69  14.484  -7.227  -1.060
  588    HB2  MET  69           HB2      MET  69  14.095  -8.949  -3.534
  589    HB3  MET  69           HB3      MET  69  14.523  -7.241  -3.531
  590    HG2  MET  69           HG2      MET  69  16.173  -9.526  -2.376
  591    HG3  MET  69           HG3      MET  69  16.521  -8.632  -3.839
  592    HE1  MET  69           HE1      MET  69  17.557  -6.146  -3.894
  593    HE2  MET  69           HE2      MET  69  16.045  -5.616  -3.123
  594    HE3  MET  69           HE3      MET  69  17.618  -5.112  -2.459
  595    H    GLN  70           H        GLN  70  11.664  -9.231  -1.187
  596    HA   GLN  70           HA       GLN  70   9.797  -7.468  -2.310
  597    HB2  GLN  70           HB2      GLN  70   9.760  -9.808  -0.554
  598    HB3  GLN  70           HB3      GLN  70   8.572  -8.632   0.005
  599    HG2  GLN  70           HG2      GLN  70   8.742  -9.530  -2.868
  600    HG3  GLN  70           HG3      GLN  70   7.805 -10.367  -1.639
  601   HE21  GLN  70          HE22      GLN  70   6.065  -9.806  -3.253
  602   HE22  GLN  70          HE21      GLN  70   5.159  -8.346  -2.854
  603    H    GLY  71           H        GLY  71   9.010  -5.539  -1.791
  604    HA2  GLY  71           HA2      GLY  71   8.524  -3.635  -0.659
  605    HA3  GLY  71           HA3      GLY  71   8.936  -4.442   0.856
  606    H    PHE  72           H        PHE  72  11.725  -4.775  -1.019
  607    HA   PHE  72           HA       PHE  72  13.102  -2.875   0.633
  608    HD1  PHE  72           HD2      PHE  72  15.580  -4.044   1.561
  609    HD2  PHE  72           HD1      PHE  72  15.780  -2.891  -2.590
  610    HE1  PHE  72           HE2      PHE  72  17.818  -3.039   1.942
  611    HE2  PHE  72           HE1      PHE  72  18.013  -1.873  -2.200
  612    HZ   PHE  72           HZ       PHE  72  19.035  -1.948   0.066
  613    HB2  PHE  72           HB2      PHE  72  14.055  -5.025  -0.177
  614    HB3  PHE  72           HB3      PHE  72  14.055  -4.398  -1.825
  615    HA   PRO  73           HA       PRO  73  12.786   0.569  -2.333
  616    HB2  PRO  73           HB2      PRO  73  14.418   2.401  -1.186
  617    HB3  PRO  73           HB3      PRO  73  12.853   1.924  -0.467
  618    HG2  PRO  73           HG2      PRO  73  15.611   0.880   0.263
  619    HG3  PRO  73           HG3      PRO  73  14.330   1.481   1.362
  620    HD2  PRO  73           HD2      PRO  73  14.698  -1.181   0.818
  621    HD3  PRO  73           HD3      PRO  73  13.079  -0.491   1.135
  622    H    PHE  74           H        PHE  74  13.769  -1.038  -3.811
  623    HA   PHE  74           HA       PHE  74  16.579  -1.325  -4.289
  624    HD1  PHE  74           HD2      PHE  74  17.293  -3.540  -5.618
  625    HD2  PHE  74           HD1      PHE  74  14.632  -1.553  -8.367
  626    HE1  PHE  74           HE2      PHE  74  18.488  -4.579  -7.532
  627    HE2  PHE  74           HE1      PHE  74  15.827  -2.587 -10.273
  628    HZ   PHE  74           HZ       PHE  74  17.724  -4.139  -9.861
  629    HB2  PHE  74           HB2      PHE  74  14.821  -2.823  -5.087
  630    HB3  PHE  74           HB3      PHE  74  14.134  -1.543  -6.081
  631    H    TYR  75           H        TYR  75  14.190   1.028  -5.251
  632    HA   TYR  75           HA       TYR  75  16.139   3.061  -5.831
  633    HD1  TYR  75           HD1      TYR  75  17.090   4.476  -7.856
  634    HD2  TYR  75           HD2      TYR  75  15.968   0.488  -9.069
  635    HE1  TYR  75           HE1      TYR  75  19.238   4.247  -9.054
  636    HE2  TYR  75           HE2      TYR  75  18.122   0.247 -10.271
  637    HH   TYR  75           HH       TYR  75  20.566   2.891 -10.387
  638    HB2  TYR  75           HB2      TYR  75  14.334   1.929  -7.997
  639    HB3  TYR  75           HB3      TYR  75  14.661   3.648  -7.980
  640    H    ASP  76           H        ASP  76  14.084   4.915  -6.686
  641    HA   ASP  76           HA       ASP  76  12.910   5.544  -4.187
  642    HB2  ASP  76           HB2      ASP  76  13.686   7.139  -5.948
  643    HB3  ASP  76           HB3      ASP  76  12.299   6.682  -6.937
  644    H    LYS  77           H        LYS  77  11.969   2.894  -5.244
  645    HA   LYS  77           HA       LYS  77   9.170   3.301  -4.627
  646    HB2  LYS  77           HB2      LYS  77  10.051   1.722  -7.097
  647    HB3  LYS  77           HB3      LYS  77   8.482   1.547  -6.317
  648    HG2  LYS  77           HG2      LYS  77   8.076   4.018  -6.709
  649    HG3  LYS  77           HG3      LYS  77   9.553   4.034  -7.698
  650    HD2  LYS  77           HD2      LYS  77   8.548   2.186  -9.097
  651    HD3  LYS  77           HD3      LYS  77   7.054   2.336  -8.182
  652    HE2  LYS  77           HE2      LYS  77   8.343   4.586  -9.804
  653    HE3  LYS  77           HE3      LYS  77   7.048   3.540 -10.389
  654    HZ1  LYS  77           HZ1      LYS  77   5.629   4.400  -8.618
  655    HZ2  LYS  77           HZ2      LYS  77   6.817   5.399  -8.091
  656    HZ3  LYS  77           HZ3      LYS  77   6.165   5.606  -9.568
  657    HA   PRO  78           HA       PRO  78  10.519  -0.376  -2.324
  658    HB2  PRO  78           HB2      PRO  78   8.125  -1.171  -1.262
  659    HB3  PRO  78           HB3      PRO  78   9.045   0.233  -0.638
  660    HG2  PRO  78           HG2      PRO  78   6.693   0.238  -2.546
  661    HG3  PRO  78           HG3      PRO  78   6.976   1.292  -1.127
  662    HD2  PRO  78           HD2      PRO  78   7.545   2.057  -3.705
  663    HD3  PRO  78           HD3      PRO  78   8.508   2.624  -2.307
  664    H    MET  79           H        MET  79  10.842  -2.350  -3.248
  665    HA   MET  79           HA       MET  79   9.671  -3.072  -5.730
  666    HB2  MET  79           HB2      MET  79  11.176  -4.679  -3.632
  667    HB3  MET  79           HB3      MET  79  10.779  -5.318  -5.233
  668    HG2  MET  79           HG2      MET  79  12.357  -2.761  -4.833
  669    HG3  MET  79           HG3      MET  79  13.106  -4.347  -4.918
  670    HE1  MET  79           HE1      MET  79  13.734  -4.937  -8.466
  671    HE2  MET  79           HE2      MET  79  14.330  -4.877  -6.796
  672    HE3  MET  79           HE3      MET  79  12.959  -5.934  -7.212
  673    H    GLN  80           H        GLN  80   8.345  -4.885  -6.253
  674    HA   GLN  80           HA       GLN  80   6.780  -6.214  -4.144
  675    HB2  GLN  80           HB2      GLN  80   5.622  -4.924  -6.665
  676    HB3  GLN  80           HB3      GLN  80   4.758  -6.076  -5.652
  677    HG2  GLN  80           HG2      GLN  80   5.760  -3.363  -4.663
  678    HG3  GLN  80           HG3      GLN  80   4.144  -3.668  -5.279
  679   HE21  GLN  80          HE22      GLN  80   6.381  -4.390  -2.583
  680   HE22  GLN  80          HE21      GLN  80   5.146  -4.973  -1.493
  681    H    ILE  81           H        ILE  81   6.830  -8.436  -4.669
  682    HA   ILE  81           HA       ILE  81   7.888  -9.215  -7.295
  683    HB   ILE  81           HB       ILE  81   9.325 -10.198  -4.828
  684   HG12  ILE  81          HG12      ILE  81  10.123  -7.672  -6.319
  685   HG13  ILE  81          HG13      ILE  81   9.669  -7.826  -4.610
  686   HG21  ILE  81          HG21      ILE  81  10.202  -9.892  -7.735
  687   HG22  ILE  81          HG22      ILE  81  11.098 -10.724  -6.451
  688   HG23  ILE  81          HG23      ILE  81   9.585 -11.388  -7.032
  689   HD11  ILE  81          HD11      ILE  81  12.023  -7.582  -4.700
  690   HD12  ILE  81          HD12      ILE  81  11.682  -9.268  -4.248
  691   HD13  ILE  81          HD13      ILE  81  12.203  -8.860  -5.905
  692    H    ALA  82           H        ALA  82   7.516 -11.372  -7.750
  693    HA   ALA  82           HA       ALA  82   6.289 -13.198  -5.829
  694    HB1  ALA  82           HB1      ALA  82   4.303 -13.605  -7.249
  695    HB2  ALA  82           HB2      ALA  82   4.332 -11.918  -6.710
  696    HB3  ALA  82           HB3      ALA  82   4.825 -12.329  -8.371
  697    H    TYR  83           H        TYR  83   5.799 -15.348  -7.215
  698    HA   TYR  83           HA       TYR  83   8.208 -16.070  -8.684
  699    HD1  TYR  83           HD1      TYR  83   4.577 -17.843 -10.082
  700    HD2  TYR  83           HD2      TYR  83   5.448 -17.533  -5.871
  701    HE1  TYR  83           HE1      TYR  83   2.176 -18.119  -9.577
  702    HE2  TYR  83           HE2      TYR  83   3.026 -17.767  -5.351
  703    HH   TYR  83           HH       TYR  83   0.547 -18.231  -7.909
  704    HB2  TYR  83           HB2      TYR  83   6.917 -18.185  -9.118
  705    HB3  TYR  83           HB3      TYR  83   7.227 -17.806  -7.438
  706    H    SER  84           H        SER  84   8.120 -16.853 -10.943
  707    HA   SER  84           HA       SER  84   7.290 -14.898 -12.700
  708    HG   SER  84           HG       SER  84   8.555 -16.834 -15.292
  709    HB2  SER  84           HB2      SER  84   8.993 -16.748 -13.010
  710    HB3  SER  84           HB3      SER  84   7.644 -17.813 -13.457
  711    H    LYS  85           H        LYS  85   5.470 -14.342 -13.721
  712    HA   LYS  85           HA       LYS  85   3.417 -16.172 -14.529
  713    HB2  LYS  85           HB2      LYS  85   1.556 -14.978 -13.397
  714    HB3  LYS  85           HB3      LYS  85   2.607 -15.830 -12.272
  715    HG2  LYS  85           HG2      LYS  85   3.765 -13.598 -11.794
  716    HG3  LYS  85           HG3      LYS  85   2.541 -12.827 -12.807
  717    HD2  LYS  85           HD2      LYS  85   1.893 -12.569 -10.519
  718    HD3  LYS  85           HD3      LYS  85   0.771 -13.722 -11.262
  719    HE2  LYS  85           HE2      LYS  85   2.080 -15.603 -10.256
  720    HE3  LYS  85           HE3      LYS  85   3.202 -14.442  -9.545
  721    HZ1  LYS  85           HZ1      LYS  85   0.310 -14.649  -8.901
  722    HZ2  LYS  85           HZ2      LYS  85   1.528 -15.155  -7.947
  723    HZ3  LYS  85           HZ3      LYS  85   1.333 -13.561  -8.238
  724    H    SER  86           H        SER  86   2.064 -15.053 -16.168
  725    HA   SER  86           HA       SER  86   3.215 -12.454 -17.077
  726    HG   SER  86           HG       SER  86   5.218 -15.050 -18.651
  727    HB2  SER  86           HB2      SER  86   2.939 -14.945 -18.796
  728    HB3  SER  86           HB3      SER  86   3.720 -13.417 -19.230
  729    H    ASP  87           H        ASP  87   0.293 -13.635 -16.246
  730    HA   ASP  87           HA       ASP  87  -1.063 -12.166 -18.455
  731    HB2  ASP  87           HB2      ASP  87  -1.076 -14.484 -19.199
  732    HB3  ASP  87           HB3      ASP  87  -1.752 -15.012 -17.658
  733    H    SER  88           H        SER  88  -2.028 -14.186 -15.575
  734    HA   SER  88           HA       SER  88  -4.271 -12.703 -15.002
  735    HG   SER  88           HG       SER  88  -3.664 -15.959 -13.538
  736    HB2  SER  88           HB2      SER  88  -2.530 -14.047 -12.904
  737    HB3  SER  88           HB3      SER  88  -4.292 -13.853 -12.897
  738    H    ASP  89           H        ASP  89  -0.934 -12.106 -13.891
  739    HA   ASP  89           HA       ASP  89  -1.521 -10.021 -12.034
  740    HB2  ASP  89           HB2      ASP  89   0.650 -11.051 -11.993
  741    HB3  ASP  89           HB3      ASP  89   0.953 -10.627 -13.684
  742    H    ILE  90           H        ILE  90  -0.545  -9.836 -15.501
  743    HA   ILE  90           HA       ILE  90  -0.592  -6.976 -15.409
  744    HB   ILE  90           HB       ILE  90  -0.370  -6.971 -17.824
  745   HG12  ILE  90          HG12      ILE  90  -0.509 -10.010 -17.739
  746   HG13  ILE  90          HG13      ILE  90  -1.788  -8.960 -18.375
  747   HG21  ILE  90          HG21      ILE  90   1.533  -7.285 -16.226
  748   HG22  ILE  90          HG22      ILE  90   1.457  -9.033 -16.523
  749   HG23  ILE  90          HG23      ILE  90   1.856  -7.912 -17.846
  750   HD11  ILE  90          HD11      ILE  90   1.020  -9.268 -19.503
  751   HD12  ILE  90          HD12      ILE  90  -0.501  -9.818 -20.217
  752   HD13  ILE  90          HD13      ILE  90  -0.180  -8.079 -20.071
  753    H    VAL  91           H        VAL  91  -3.112  -9.369 -16.218
  754    HA   VAL  91           HA       VAL  91  -4.983  -7.434 -17.145
  755    HB   VAL  91           HB       VAL  91  -5.352 -10.155 -15.830
  756   HG11  VAL  91          HG11      VAL  91  -7.685 -10.098 -16.705
  757   HG12  VAL  91          HG12      VAL  91  -7.428  -8.893 -15.443
  758   HG13  VAL  91          HG13      VAL  91  -7.469  -8.389 -17.148
  759   HG21  VAL  91          HG21      VAL  91  -4.277 -10.131 -18.098
  760   HG22  VAL  91          HG22      VAL  91  -5.871 -10.886 -18.124
  761   HG23  VAL  91          HG23      VAL  91  -5.662  -9.229 -18.729
  762    H    ALA  92           H        ALA  92  -4.340  -8.740 -13.798
  763    HA   ALA  92           HA       ALA  92  -6.256  -7.053 -12.545
  764    HB1  ALA  92           HB1      ALA  92  -3.678  -8.193 -11.380
  765    HB2  ALA  92           HB2      ALA  92  -5.079  -7.590 -10.470
  766    HB3  ALA  92           HB3      ALA  92  -5.241  -9.044 -11.468
  767    H    LYS  93           H        LYS  93  -2.895  -6.446 -13.528
  768    HA   LYS  93           HA       LYS  93  -2.568  -4.016 -12.087
  769    HB2  LYS  93           HB2      LYS  93  -0.839  -5.583 -13.242
  770    HB3  LYS  93           HB3      LYS  93  -1.162  -4.646 -14.706
  771    HG2  LYS  93           HG2      LYS  93  -0.432  -2.585 -13.530
  772    HG3  LYS  93           HG3      LYS  93  -0.247  -3.511 -12.023
  773    HD2  LYS  93           HD2      LYS  93   1.460  -4.973 -13.195
  774    HD3  LYS  93           HD3      LYS  93   1.317  -3.929 -14.609
  775    HE2  LYS  93           HE2      LYS  93   3.285  -3.296 -13.404
  776    HE3  LYS  93           HE3      LYS  93   2.113  -1.987 -13.241
  777    HZ1  LYS  93           HZ1      LYS  93   1.706  -2.648 -10.998
  778    HZ2  LYS  93           HZ2      LYS  93   2.486  -4.090 -11.177
  779    HZ3  LYS  93           HZ3      LYS  93   3.345  -2.727 -11.167
  780    H    ILE  94           H        ILE  94  -3.664  -4.592 -15.512
  781    HA   ILE  94           HA       ILE  94  -4.095  -1.754 -15.871
  782    HB   ILE  94           HB       ILE  94  -5.087  -2.266 -17.987
  783   HG12  ILE  94          HG12      ILE  94  -4.926  -5.211 -17.264
  784   HG13  ILE  94          HG13      ILE  94  -6.408  -4.271 -17.428
  785   HG21  ILE  94          HG21      ILE  94  -2.641  -4.042 -17.596
  786   HG22  ILE  94          HG22      ILE  94  -3.131  -3.175 -19.061
  787   HG23  ILE  94          HG23      ILE  94  -2.594  -2.267 -17.649
  788   HD11  ILE  94          HD11      ILE  94  -4.462  -4.980 -19.651
  789   HD12  ILE  94          HD12      ILE  94  -6.112  -5.573 -19.417
  790   HD13  ILE  94          HD13      ILE  94  -5.843  -3.868 -19.835
  791    H    LYS  95           H        LYS  95  -6.205  -4.427 -14.830
  792    HA   LYS  95           HA       LYS  95  -8.625  -2.834 -14.850
  793    HB2  LYS  95           HB2      LYS  95  -7.822  -5.372 -13.360
  794    HB3  LYS  95           HB3      LYS  95  -9.427  -4.667 -13.240
  795    HG2  LYS  95           HG2      LYS  95  -8.183  -5.582 -15.872
  796    HG3  LYS  95           HG3      LYS  95  -9.238  -6.569 -14.856
  797    HD2  LYS  95           HD2      LYS  95 -11.053  -4.876 -15.115
  798    HD3  LYS  95           HD3      LYS  95 -10.000  -3.936 -16.199
  799    HE2  LYS  95           HE2      LYS  95  -9.830  -5.882 -17.728
  800    HE3  LYS  95           HE3      LYS  95 -10.871  -6.824 -16.654
  801    HZ1  LYS  95           HZ1      LYS  95 -11.691  -4.361 -18.087
  802    HZ2  LYS  95           HZ2      LYS  95 -12.119  -5.880 -18.488
  803    HZ3  LYS  95           HZ3      LYS  95 -12.653  -5.235 -17.093
  804    H    GLY  96           H        GLY  96  -5.988  -3.190 -12.529
  805    HA2  GLY  96           HA2      GLY  96  -5.502  -1.525 -10.915
  806    HA3  GLY  96           HA3      GLY  96  -7.213  -1.094 -10.813
  807    H    THR  97           H        THR  97  -7.519  -4.368 -10.861
  808    HA   THR  97           HA       THR  97  -7.954  -4.629  -8.072
  809    HB   THR  97           HB       THR  97  -8.012  -7.163  -8.890
  810    HG1  THR  97           HG1      THR  97  -8.377  -7.293 -11.090
  811   HG21  THR  97          HG21      THR  97  -9.984  -5.785  -8.274
  812   HG22  THR  97          HG22      THR  97  -9.988  -5.072  -9.903
  813   HG23  THR  97          HG23      THR  97 -10.310  -6.807  -9.683
  814    H    PHE  98           H        PHE  98  -5.007  -4.765  -9.849
  815    HA   PHE  98           HA       PHE  98  -3.424  -6.464  -8.270
  816    HD1  PHE  98           HD2      PHE  98  -0.902  -6.891  -8.607
  817    HD2  PHE  98           HD1      PHE  98  -1.031  -2.592  -8.974
  818    HE1  PHE  98           HE2      PHE  98   1.398  -6.739  -7.696
  819    HE2  PHE  98           HE1      PHE  98   1.273  -2.449  -8.060
  820    HZ   PHE  98           HZ       PHE  98   2.490  -4.521  -7.416
  821    HB2  PHE  98           HB2      PHE  98  -2.550  -5.479 -10.258
  822    HB3  PHE  98           HB3      PHE  98  -2.874  -3.842  -9.686
  823    H    LYS  99           H        LYS  99  -4.629  -3.179  -7.514
  824    HA   LYS  99           HA       LYS  99  -4.015  -3.603  -4.697
  825    HB2  LYS  99           HB2      LYS  99  -2.479  -1.763  -4.359
  826    HB3  LYS  99           HB3      LYS  99  -1.786  -2.915  -5.490
  827    HG2  LYS  99           HG2      LYS  99  -2.413  -1.416  -7.392
  828    HG3  LYS  99           HG3      LYS  99  -3.087  -0.252  -6.237
  829    HD2  LYS  99           HD2      LYS  99  -0.875  -0.010  -5.162
  830    HD3  LYS  99           HD3      LYS  99  -0.180  -1.160  -6.325
  831    HE2  LYS  99           HE2      LYS  99  -0.797   0.344  -8.196
  832    HE3  LYS  99           HE3      LYS  99  -1.557   1.467  -7.061
  833    HZ1  LYS  99           HZ1      LYS  99   1.333   0.809  -7.111
  834    HZ2  LYS  99           HZ2      LYS  99   0.661   2.188  -7.659
  835    HZ3  LYS  99           HZ3      LYS  99   0.618   1.848  -6.068
  836    H    GLU 100           H        GLU 100  -5.519  -1.600  -7.194
  837    HA   GLU 100           HA       GLU 100  -6.097   0.626  -5.510
  838    HB2  GLU 100           HB2      GLU 100  -5.956   0.546  -8.054
  839    HB3  GLU 100           HB3      GLU 100  -7.520  -0.263  -8.054
  840    HG2  GLU 100           HG2      GLU 100  -7.899   2.046  -8.511
  841    HG3  GLU 100           HG3      GLU 100  -8.506   1.749  -6.892
  842    H    ARG 101           H        ARG 101  -7.856  -2.371  -6.293
  843    HA   ARG 101           HA       ARG 101  -9.517  -1.988  -3.907
  844    HE   ARG 101           HE       ARG 101 -11.594  -2.205  -8.211
  845    HB2  ARG 101           HB2      ARG 101 -10.777  -2.999  -6.491
  846    HB3  ARG 101           HB3      ARG 101 -11.546  -2.775  -4.944
  847    HG2  ARG 101           HG2      ARG 101 -12.398  -1.001  -6.095
  848    HG3  ARG 101           HG3      ARG 101 -11.076  -0.234  -5.232
  849    HD2  ARG 101           HD2      ARG 101 -11.284   0.524  -7.591
  850    HD3  ARG 101           HD3      ARG 101  -9.720  -0.243  -7.296
  851   HH11  ARG 101          HH11      ARG 101  -9.676   0.484  -9.614
  852   HH12  ARG 101          HH12      ARG 101  -9.452  -0.387 -11.105
  853   HH21  ARG 101          HH21      ARG 101 -11.338  -3.182 -10.050
  854   HH22  ARG 101          HH22      ARG 101 -10.391  -2.491 -11.387
  855    HA   PRO 102           HA       PRO 102  -7.988  -6.110  -3.665
  856    HB2  PRO 102           HB2      PRO 102  -9.714  -7.390  -1.938
  857    HB3  PRO 102           HB3      PRO 102  -8.537  -6.141  -1.438
  858    HG2  PRO 102           HG2      PRO 102 -11.487  -5.789  -2.034
  859    HG3  PRO 102           HG3      PRO 102 -10.549  -5.151  -0.647
  860    HD2  PRO 102           HD2      PRO 102 -11.110  -3.624  -2.838
  861    HD3  PRO 102           HD3      PRO 102  -9.554  -3.472  -1.970
  862    H    LYS 103           H        LYS 103 -11.495  -5.948  -4.357
  863    HA   LYS 103           HA       LYS 103 -11.305  -8.069  -6.373
  864    HB2  LYS 103           HB2      LYS 103 -11.413  -9.153  -4.023
  865    HB3  LYS 103           HB3      LYS 103 -13.065  -8.553  -3.927
  866    HG2  LYS 103           HG2      LYS 103 -13.600  -9.868  -6.019
  867    HG3  LYS 103           HG3      LYS 103 -11.920 -10.424  -6.062
  868    HD2  LYS 103           HD2      LYS 103 -12.219 -11.512  -3.852
  869    HD3  LYS 103           HD3      LYS 103 -13.902 -10.937  -3.799
  870    HE2  LYS 103           HE2      LYS 103 -14.395 -12.210  -5.878
  871    HE3  LYS 103           HE3      LYS 103 -12.723 -12.782  -5.930
  872    HZ1  LYS 103           HZ1      LYS 103 -14.664 -13.392  -3.775
  873    HZ2  LYS 103           HZ2      LYS 103 -14.189 -14.421  -4.942
  874    HZ3  LYS 103           HZ3      LYS 103 -13.117 -13.921  -3.824
  875    H    LYS 104           H        LYS 104 -11.944  -5.498  -6.967
  876    HA   LYS 104           HA       LYS 104 -14.754  -5.701  -7.732
  877    HB2  LYS 104           HB2      LYS 104 -14.828  -4.415  -5.596
  878    HB3  LYS 104           HB3      LYS 104 -13.671  -3.251  -6.268
  879    HG2  LYS 104           HG2      LYS 104 -15.274  -2.589  -7.998
  880    HG3  LYS 104           HG3      LYS 104 -16.373  -3.892  -7.529
  881    HD2  LYS 104           HD2      LYS 104 -17.215  -1.790  -6.693
  882    HD3  LYS 104           HD3      LYS 104 -16.744  -2.821  -5.334
  883    HE2  LYS 104           HE2      LYS 104 -14.621  -1.561  -5.103
  884    HE3  LYS 104           HE3      LYS 104 -15.046  -0.566  -6.504
  885    HZ1  LYS 104           HZ1      LYS 104 -16.943   0.274  -5.245
  886    HZ2  LYS 104           HZ2      LYS 104 -16.553  -0.646  -3.952
  887    HZ3  LYS 104           HZ3      LYS 104 -15.564   0.555  -4.429
  Start of MODEL    8
    1    HA   MET   1           HA       MET   1   7.453 -18.405   4.294
    2    H1   MET   1           H1       MET   1   8.960 -20.246   4.572
    3    H2   MET   1           H2       MET   1   7.398 -20.737   4.540
    4    H3   MET   1           H3       MET   1   8.344 -20.988   3.238
    5    HB2  MET   1           HB2      MET   1   8.516 -17.298   2.436
    6    HB3  MET   1           HB3      MET   1   9.713 -18.197   3.356
    7    HG2  MET   1           HG2      MET   1   9.757 -19.958   1.619
    8    HG3  MET   1           HG3      MET   1   8.450 -19.151   0.750
    9    HE1  MET   1           HE1      MET   1  12.274 -19.141   1.652
   10    HE2  MET   1           HE2      MET   1  12.804 -17.565   1.024
   11    HE3  MET   1           HE3      MET   1  11.763 -17.638   2.455
   12    H    GLU   2           H        GLU   2   6.004 -17.200   2.782
   13    HA   GLU   2           HA       GLU   2   3.846 -18.901   2.041
   14    HB2  GLU   2           HB2      GLU   2   3.655 -16.587   2.926
   15    HB3  GLU   2           HB3      GLU   2   4.333 -15.956   1.419
   16    HG2  GLU   2           HG2      GLU   2   2.399 -16.841   0.160
   17    HG3  GLU   2           HG3      GLU   2   1.761 -17.586   1.628
   18    H    MET   3           H        MET   3   6.303 -17.188   0.113
   19    HA   MET   3           HA       MET   3   5.005 -17.596  -2.384
   20    HB2  MET   3           HB2      MET   3   7.994 -17.125  -2.037
   21    HB3  MET   3           HB3      MET   3   6.935 -16.629  -3.357
   22    HG2  MET   3           HG2      MET   3   7.211 -14.644  -2.235
   23    HG3  MET   3           HG3      MET   3   5.709 -15.198  -1.526
   24    HE1  MET   3           HE1      MET   3   6.122 -13.334   0.362
   25    HE2  MET   3           HE2      MET   3   7.594 -13.240   1.357
   26    HE3  MET   3           HE3      MET   3   7.681 -12.909  -0.387
   27    H    LEU   4           H        LEU   4   5.558 -18.933  -4.166
   28    HA   LEU   4           HA       LEU   4   6.515 -21.597  -3.499
   29    HG   LEU   4           HG       LEU   4   3.841 -20.388  -5.110
   30    HB2  LEU   4           HB2      LEU   4   5.973 -20.359  -6.233
   31    HB3  LEU   4           HB3      LEU   4   6.249 -22.059  -5.896
   32   HD11  LEU   4          HD11      LEU   4   2.615 -22.001  -6.466
   33   HD12  LEU   4          HD12      LEU   4   3.942 -21.315  -7.416
   34   HD13  LEU   4          HD13      LEU   4   4.094 -22.950  -6.741
   35   HD21  LEU   4          HD21      LEU   4   2.898 -22.448  -4.065
   36   HD22  LEU   4          HD22      LEU   4   4.506 -23.203  -4.168
   37   HD23  LEU   4          HD23      LEU   4   4.242 -21.751  -3.164
   38    HA   PRO   5           HA       PRO   5  10.740 -20.617  -4.056
   39    HB2  PRO   5           HB2      PRO   5  11.904 -23.036  -4.228
   40    HB3  PRO   5           HB3      PRO   5  10.874 -22.629  -2.833
   41    HG2  PRO   5           HG2      PRO   5  10.041 -24.096  -5.362
   42    HG3  PRO   5           HG3      PRO   5   9.874 -24.665  -3.663
   43    HD2  PRO   5           HD2      PRO   5   7.834 -23.380  -4.923
   44    HD3  PRO   5           HD3      PRO   5   8.187 -23.073  -3.196
   45    H    ASN   6           H        ASN   6   9.042 -21.518  -6.828
   46    HA   ASN   6           HA       ASN   6  10.751 -22.555  -8.655
   47    HB2  ASN   6           HB2      ASN   6   8.423 -22.098  -9.191
   48    HB3  ASN   6           HB3      ASN   6   8.676 -20.354  -9.045
   49   HD21  ASN   6          HD22      ASN   6   9.455 -19.187 -10.863
   50   HD22  ASN   6          HD21      ASN   6   9.932 -19.982 -12.355
   51    H    GLN   7           H        GLN   7  12.515 -21.979  -9.881
   52    HA   GLN   7           HA       GLN   7  14.065 -19.926  -8.812
   53    HB2  GLN   7           HB2      GLN   7  15.835 -20.598 -10.187
   54    HB3  GLN   7           HB3      GLN   7  14.963 -22.032  -9.675
   55    HG2  GLN   7           HG2      GLN   7  13.803 -22.043 -11.940
   56    HG3  GLN   7           HG3      GLN   7  14.867 -20.715 -12.423
   57   HE21  GLN   7          HE22      GLN   7  17.387 -21.259 -11.805
   58   HE22  GLN   7          HE21      GLN   7  17.877 -22.857 -12.318
   59    H    THR   8           H        THR   8  11.738 -19.538 -11.262
   60    HA   THR   8           HA       THR   8  12.970 -17.108 -12.415
   61    HB   THR   8           HB       THR   8  10.180 -17.858 -13.090
   62    HG1  THR   8           HG1      THR   8  12.227 -19.634 -13.908
   63   HG21  THR   8          HG21      THR   8  11.672 -16.203 -14.354
   64   HG22  THR   8          HG22      THR   8  12.498 -17.636 -15.017
   65   HG23  THR   8          HG23      THR   8  10.771 -17.390 -15.317
   66    H    ILE   9           H        ILE   9  12.440 -15.138 -11.519
   67    HA   ILE   9           HA       ILE   9   9.992 -14.937  -9.856
   68    HB   ILE   9           HB       ILE   9  11.035 -13.539  -8.269
   69   HG12  ILE   9          HG12      ILE   9  13.664 -13.770  -9.781
   70   HG13  ILE   9          HG13      ILE   9  12.615 -12.350  -9.760
   71   HG21  ILE   9          HG21      ILE   9  12.525 -15.092  -7.127
   72   HG22  ILE   9          HG22      ILE   9  11.259 -16.014  -7.954
   73   HG23  ILE   9          HG23      ILE   9  12.895 -15.922  -8.644
   74   HD11  ILE   9          HD11      ILE   9  12.905 -12.194  -7.277
   75   HD12  ILE   9          HD12      ILE   9  14.124 -13.489  -7.385
   76   HD13  ILE   9          HD13      ILE   9  14.388 -11.949  -8.217
   77    H    TYR  10           H        TYR  10   9.178 -12.765  -9.691
   78    HA   TYR  10           HA       TYR  10   9.403 -11.209 -12.228
   79    HD1  TYR  10           HD2      TYR  10   7.841  -9.939 -13.467
   80    HD2  TYR  10           HD1      TYR  10   4.816 -12.004 -11.176
   81    HE1  TYR  10           HE2      TYR  10   6.088  -8.590 -14.563
   82    HE2  TYR  10           HE1      TYR  10   3.060 -10.659 -12.268
   83    HH   TYR  10           HH       TYR  10   2.585  -9.042 -13.865
   84    HB2  TYR  10           HB2      TYR  10   7.608 -12.827 -12.330
   85    HB3  TYR  10           HB3      TYR  10   7.062 -12.419 -10.713
   86    H    ILE  11           H        ILE  11   9.633  -9.089 -11.809
   87    HA   ILE  11           HA       ILE  11   9.237  -8.063  -9.034
   88    HB   ILE  11           HB       ILE  11  11.374  -7.494 -11.133
   89   HG12  ILE  11          HG12      ILE  11  11.629  -8.380  -8.222
   90   HG13  ILE  11          HG13      ILE  11  11.668  -9.486  -9.599
   91   HG21  ILE  11          HG21      ILE  11  10.868  -5.954  -8.542
   92   HG22  ILE  11          HG22      ILE  11  12.280  -5.751  -9.614
   93   HG23  ILE  11          HG23      ILE  11  10.690  -5.318 -10.191
   94   HD11  ILE  11          HD11      ILE  11  13.723  -7.369  -8.906
   95   HD12  ILE  11          HD12      ILE  11  13.918  -9.127  -8.958
   96   HD13  ILE  11          HD13      ILE  11  13.677  -8.220 -10.467
   97    H    ASN  12           H        ASN  12   8.121  -6.162  -8.894
   98    HA   ASN  12           HA       ASN  12   7.109  -4.832 -11.321
   99    HB2  ASN  12           HB2      ASN  12   5.635  -6.850 -10.026
  100    HB3  ASN  12           HB3      ASN  12   5.020  -5.380  -9.285
  101   HD21  ASN  12          HD22      ASN  12   5.161  -7.312 -12.174
  102   HD22  ASN  12          HD21      ASN  12   4.296  -6.243 -13.245
  103    H    ASN  13           H        ASN  13   5.657  -2.943 -10.539
  104    HA   ASN  13           HA       ASN  13   5.805  -0.830  -9.816
  105    HB2  ASN  13           HB2      ASN  13   4.850  -1.924  -7.745
  106    HB3  ASN  13           HB3      ASN  13   6.486  -1.948  -7.077
  107   HD21  ASN  13          HD21      ASN  13   6.605  -0.302  -5.547
  108   HD22  ASN  13          HD22      ASN  13   5.902   1.295  -5.753
  109    H    LEU  14           H        LEU  14   8.094  -1.911 -11.035
  110    HA   LEU  14           HA       LEU  14  10.561  -1.203  -9.673
  111    HG   LEU  14           HG       LEU  14  12.293  -2.671 -10.809
  112    HB2  LEU  14           HB2      LEU  14   9.961  -2.945 -11.577
  113    HB3  LEU  14           HB3      LEU  14  10.142  -1.570 -12.659
  114   HD11  LEU  14          HD11      LEU  14  11.854  -2.985 -13.816
  115   HD12  LEU  14          HD12      LEU  14  13.224  -3.626 -12.890
  116   HD13  LEU  14          HD13      LEU  14  11.604  -4.244 -12.584
  117   HD21  LEU  14          HD21      LEU  14  12.863  -0.362 -11.280
  118   HD22  LEU  14          HD22      LEU  14  13.835  -1.357 -12.356
  119   HD23  LEU  14          HD23      LEU  14  12.401  -0.532 -12.990
  120    H    ASN  15           H        ASN  15  11.605   0.861  -9.866
  121    HA   ASN  15           HA       ASN  15  10.051   3.091 -10.855
  122    HB2  ASN  15           HB2      ASN  15  11.724   3.278  -9.007
  123    HB3  ASN  15           HB3      ASN  15  13.019   3.088 -10.197
  124   HD21  ASN  15          HD22      ASN  15  12.329   5.431  -8.456
  125   HD22  ASN  15          HD21      ASN  15  12.003   6.767  -9.550
  126    H    GLU  16           H        GLU  16   9.582   3.215 -12.905
  127    HA   GLU  16           HA       GLU  16  10.969   1.970 -14.963
  128    HB2  GLU  16           HB2      GLU  16   9.365   3.012 -16.417
  129    HB3  GLU  16           HB3      GLU  16   8.562   2.478 -14.955
  130    HG2  GLU  16           HG2      GLU  16   9.387   5.350 -15.581
  131    HG3  GLU  16           HG3      GLU  16   7.784   4.677 -15.825
  132    H    LYS  17           H        LYS  17  11.969   4.935 -13.466
  133    HA   LYS  17           HA       LYS  17  13.092   6.119 -15.822
  134    HB2  LYS  17           HB2      LYS  17  14.190   7.619 -14.436
  135    HB3  LYS  17           HB3      LYS  17  12.705   7.238 -13.572
  136    HG2  LYS  17           HG2      LYS  17  14.126   5.542 -12.214
  137    HG3  LYS  17           HG3      LYS  17  15.540   6.278 -12.984
  138    HD2  LYS  17           HD2      LYS  17  14.815   8.518 -12.104
  139    HD3  LYS  17           HD3      LYS  17  13.445   7.732 -11.322
  140    HE2  LYS  17           HE2      LYS  17  15.040   7.989  -9.606
  141    HE3  LYS  17           HE3      LYS  17  15.098   6.280 -10.042
  142    HZ1  LYS  17           HZ1      LYS  17  17.114   6.790 -11.354
  143    HZ2  LYS  17           HZ2      LYS  17  17.021   8.366 -10.930
  144    HZ3  LYS  17           HZ3      LYS  17  17.314   7.237  -9.798
  145    H    ILE  18           H        ILE  18  14.011   3.361 -13.904
  146    HA   ILE  18           HA       ILE  18  16.847   3.459 -14.369
  147    HB   ILE  18           HB       ILE  18  14.967   1.218 -13.505
  148   HG12  ILE  18          HG12      ILE  18  14.875   3.071 -11.912
  149   HG13  ILE  18          HG13      ILE  18  15.709   1.707 -11.208
  150   HG21  ILE  18          HG21      ILE  18  17.060   0.255 -14.298
  151   HG22  ILE  18          HG22      ILE  18  17.990   1.341 -13.244
  152   HG23  ILE  18          HG23      ILE  18  16.936   0.102 -12.545
  153   HD11  ILE  18          HD11      ILE  18  16.746   3.875 -10.637
  154   HD12  ILE  18          HD12      ILE  18  17.884   2.848 -11.524
  155   HD13  ILE  18          HD13      ILE  18  17.066   4.204 -12.337
  156    H    LYS  19           H        LYS  19  17.915   3.005 -16.165
  157    HA   LYS  19           HA       LYS  19  16.679   2.085 -18.601
  158    HB2  LYS  19           HB2      LYS  19  18.670   3.607 -18.356
  159    HB3  LYS  19           HB3      LYS  19  19.603   2.247 -17.736
  160    HG2  LYS  19           HG2      LYS  19  19.372   1.108 -19.946
  161    HG3  LYS  19           HG3      LYS  19  18.465   2.511 -20.551
  162    HD2  LYS  19           HD2      LYS  19  20.429   3.959 -20.145
  163    HD3  LYS  19           HD3      LYS  19  21.304   2.598 -19.420
  164    HE2  LYS  19           HE2      LYS  19  21.019   1.374 -21.653
  165    HE3  LYS  19           HE3      LYS  19  20.425   2.901 -22.323
  166    HZ1  LYS  19           HZ1      LYS  19  23.110   2.416 -21.136
  167    HZ2  LYS  19           HZ2      LYS  19  22.779   2.653 -22.721
  168    HZ3  LYS  19           HZ3      LYS  19  22.585   3.885 -21.671
  169    H    LYS  20           H        LYS  20  17.223   0.027 -19.724
  170    HA   LYS  20           HA       LYS  20  16.973  -2.357 -18.253
  171    HB2  LYS  20           HB2      LYS  20  16.613  -2.048 -20.731
  172    HB3  LYS  20           HB3      LYS  20  18.373  -1.956 -20.936
  173    HG2  LYS  20           HG2      LYS  20  18.555  -4.291 -19.996
  174    HG3  LYS  20           HG3      LYS  20  16.800  -4.329 -19.831
  175    HD2  LYS  20           HD2      LYS  20  17.421  -5.533 -21.821
  176    HD3  LYS  20           HD3      LYS  20  16.588  -4.051 -22.311
  177    HE2  LYS  20           HE2      LYS  20  18.762  -2.977 -22.817
  178    HE3  LYS  20           HE3      LYS  20  19.620  -4.410 -22.240
  179    HZ1  LYS  20           HZ1      LYS  20  18.602  -5.667 -24.056
  180    HZ2  LYS  20           HZ2      LYS  20  17.820  -4.335 -24.597
  181    HZ3  LYS  20           HZ3      LYS  20  19.446  -4.404 -24.640
  182    H    GLU  21           H        GLU  21  19.930  -0.766 -19.470
  183    HA   GLU  21           HA       GLU  21  21.828  -2.654 -18.575
  184    HB2  GLU  21           HB2      GLU  21  22.253  -0.947 -20.227
  185    HB3  GLU  21           HB3      GLU  21  21.895   0.342 -19.077
  186    HG2  GLU  21           HG2      GLU  21  23.900  -0.145 -17.787
  187    HG3  GLU  21           HG3      GLU  21  24.225  -1.584 -18.769
  188    H    GLU  22           H        GLU  22  20.403   0.204 -16.915
  189    HA   GLU  22           HA       GLU  22  22.058  -0.021 -14.575
  190    HB2  GLU  22           HB2      GLU  22  19.407   1.368 -15.079
  191    HB3  GLU  22           HB3      GLU  22  20.337   1.520 -13.581
  192    HG2  GLU  22           HG2      GLU  22  22.212   2.513 -14.781
  193    HG3  GLU  22           HG3      GLU  22  21.386   2.328 -16.325
  194    H    LEU  23           H        LEU  23  18.835  -1.258 -15.488
  195    HA   LEU  23           HA       LEU  23  18.108  -2.417 -12.992
  196    HG   LEU  23           HG       LEU  23  15.360  -4.105 -15.186
  197    HB2  LEU  23           HB2      LEU  23  16.471  -2.107 -14.690
  198    HB3  LEU  23           HB3      LEU  23  17.397  -2.943 -15.906
  199   HD11  LEU  23          HD11      LEU  23  17.765  -5.825 -14.585
  200   HD12  LEU  23          HD12      LEU  23  16.177  -6.314 -15.164
  201   HD13  LEU  23          HD13      LEU  23  17.241  -5.353 -16.207
  202   HD21  LEU  23          HD21      LEU  23  16.811  -4.651 -12.563
  203   HD22  LEU  23          HD22      LEU  23  15.502  -3.479 -12.759
  204   HD23  LEU  23          HD23      LEU  23  15.196  -5.208 -13.037
  205    H    LYS  24           H        LYS  24  19.865  -3.864 -15.822
  206    HA   LYS  24           HA       LYS  24  20.334  -6.358 -14.513
  207    HB2  LYS  24           HB2      LYS  24  21.898  -4.929 -16.706
  208    HB3  LYS  24           HB3      LYS  24  22.291  -6.548 -16.114
  209    HG2  LYS  24           HG2      LYS  24  19.930  -7.264 -16.662
  210    HG3  LYS  24           HG3      LYS  24  19.692  -5.715 -17.470
  211    HD2  LYS  24           HD2      LYS  24  21.761  -7.842 -18.175
  212    HD3  LYS  24           HD3      LYS  24  20.258  -7.520 -19.049
  213    HE2  LYS  24           HE2      LYS  24  21.057  -5.243 -19.620
  214    HE3  LYS  24           HE3      LYS  24  22.558  -5.535 -18.732
  215    HZ1  LYS  24           HZ1      LYS  24  23.082  -7.306 -20.296
  216    HZ2  LYS  24           HZ2      LYS  24  21.696  -7.060 -21.124
  217    HZ3  LYS  24           HZ3      LYS  24  22.853  -5.910 -21.098
  218    H    LYS  25           H        LYS  25  22.400  -3.402 -14.656
  219    HA   LYS  25           HA       LYS  25  24.518  -4.414 -13.110
  220    HB2  LYS  25           HB2      LYS  25  24.532  -2.277 -14.383
  221    HB3  LYS  25           HB3      LYS  25  23.444  -1.557 -13.185
  222    HG2  LYS  25           HG2      LYS  25  25.163  -1.876 -11.423
  223    HG3  LYS  25           HG3      LYS  25  26.235  -2.651 -12.608
  224    HD2  LYS  25           HD2      LYS  25  26.288  -0.549 -13.930
  225    HD3  LYS  25           HD3      LYS  25  25.207   0.222 -12.744
  226    HE2  LYS  25           HE2      LYS  25  26.899  -0.163 -10.962
  227    HE3  LYS  25           HE3      LYS  25  27.972  -0.930 -12.139
  228    HZ1  LYS  25           HZ1      LYS  25  28.081   1.190 -13.319
  229    HZ2  LYS  25           HZ2      LYS  25  27.092   1.899 -12.226
  230    HZ3  LYS  25           HZ3      LYS  25  28.566   1.377 -11.777
  231    H    SER  26           H        SER  26  21.530  -2.737 -11.978
  232    HA   SER  26           HA       SER  26  22.187  -2.751  -9.237
  233    HG   SER  26           HG       SER  26  20.528  -1.120 -11.323
  234    HB2  SER  26           HB2      SER  26  19.433  -2.861 -10.519
  235    HB3  SER  26           HB3      SER  26  19.804  -2.342  -8.864
  236    H    LEU  27           H        LEU  27  20.327  -5.123 -11.167
  237    HA   LEU  27           HA       LEU  27  19.694  -6.826  -8.973
  238    HG   LEU  27           HG       LEU  27  17.827  -6.047 -11.041
  239    HB2  LEU  27           HB2      LEU  27  19.864  -7.180 -11.967
  240    HB3  LEU  27           HB3      LEU  27  19.532  -8.565 -10.940
  241   HD11  LEU  27          HD11      LEU  27  17.344  -8.851 -12.150
  242   HD12  LEU  27          HD12      LEU  27  16.189  -7.496 -12.200
  243   HD13  LEU  27          HD13      LEU  27  17.707  -7.400 -13.094
  244   HD21  LEU  27          HD21      LEU  27  16.159  -7.468  -9.818
  245   HD22  LEU  27          HD22      LEU  27  17.424  -8.695  -9.590
  246   HD23  LEU  27          HD23      LEU  27  17.576  -7.075  -8.860
  247    H    TYR  28           H        TYR  28  22.477  -6.997 -11.310
  248    HA   TYR  28           HA       TYR  28  23.619  -9.266  -9.979
  249    HD1  TYR  28           HD2      TYR  28  24.007 -10.793 -11.593
  250    HD2  TYR  28           HD1      TYR  28  24.529  -7.249 -13.998
  251    HE1  TYR  28           HE2      TYR  28  23.343 -12.068 -13.594
  252    HE2  TYR  28           HE1      TYR  28  23.861  -8.521 -16.015
  253    HH   TYR  28           HH       TYR  28  22.996 -12.007 -15.905
  254    HB2  TYR  28           HB2      TYR  28  24.905  -7.096 -11.680
  255    HB3  TYR  28           HB3      TYR  28  25.735  -8.542 -11.130
  256    H    ALA  29           H        ALA  29  23.809  -5.765  -9.288
  257    HA   ALA  29           HA       ALA  29  26.046  -5.957  -7.521
  258    HB1  ALA  29           HB1      ALA  29  25.353  -3.833  -8.549
  259    HB2  ALA  29           HB2      ALA  29  23.836  -3.858  -7.616
  260    HB3  ALA  29           HB3      ALA  29  25.393  -3.710  -6.783
  261    H    ILE  30           H        ILE  30  22.490  -6.134  -6.894
  262    HA   ILE  30           HA       ILE  30  23.183  -6.821  -4.056
  263    HB   ILE  30           HB       ILE  30  20.936  -5.874  -3.491
  264   HG12  ILE  30          HG12      ILE  30  21.226  -4.183  -5.991
  265   HG13  ILE  30          HG13      ILE  30  20.173  -5.601  -5.943
  266   HG21  ILE  30          HG21      ILE  30  21.909  -3.616  -3.202
  267   HG22  ILE  30          HG22      ILE  30  23.123  -4.858  -2.903
  268   HG23  ILE  30          HG23      ILE  30  23.131  -3.969  -4.441
  269   HD11  ILE  30          HD11      ILE  30  19.928  -3.105  -4.217
  270   HD12  ILE  30          HD12      ILE  30  18.852  -3.629  -5.521
  271   HD13  ILE  30          HD13      ILE  30  18.940  -4.569  -4.020
  272    H    PHE  31           H        PHE  31  20.719  -7.627  -6.599
  273    HA   PHE  31           HA       PHE  31  19.431  -9.514  -4.864
  274    HD1  PHE  31           HD1      PHE  31  18.272  -6.950  -6.192
  275    HD2  PHE  31           HD2      PHE  31  16.571 -10.856  -6.880
  276    HE1  PHE  31           HE1      PHE  31  16.023  -6.069  -5.691
  277    HE2  PHE  31           HE2      PHE  31  14.319  -9.967  -6.356
  278    HZ   PHE  31           HZ       PHE  31  14.036  -7.562  -5.786
  279    HB2  PHE  31           HB2      PHE  31  19.324  -8.951  -7.795
  280    HB3  PHE  31           HB3      PHE  31  18.825 -10.534  -7.251
  281    H    SER  32           H        SER  32  22.165  -9.948  -7.220
  282    HA   SER  32           HA       SER  32  22.360 -12.729  -6.857
  283    HG   SER  32           HG       SER  32  24.247 -11.634  -9.502
  284    HB2  SER  32           HB2      SER  32  24.480 -10.649  -7.447
  285    HB3  SER  32           HB3      SER  32  24.815 -12.389  -7.415
  286    H    GLN  33           H        GLN  33  23.131 -10.258  -4.423
  287    HA   GLN  33           HA       GLN  33  25.000 -11.883  -2.950
  288    HB2  GLN  33           HB2      GLN  33  23.138  -9.702  -1.915
  289    HB3  GLN  33           HB3      GLN  33  24.511 -10.407  -1.067
  290    HG2  GLN  33           HG2      GLN  33  26.048  -9.559  -2.851
  291    HG3  GLN  33           HG3      GLN  33  24.674  -8.803  -3.655
  292   HE21  GLN  33          HE22      GLN  33  25.419  -6.634  -3.439
  293   HE22  GLN  33          HE21      GLN  33  25.568  -5.853  -1.876
  294    H    PHE  34           H        PHE  34  21.539 -12.098  -3.406
  295    HA   PHE  34           HA       PHE  34  21.107 -13.627  -0.940
  296    HD1  PHE  34           HD1      PHE  34  20.060 -10.410  -2.927
  297    HD2  PHE  34           HD2      PHE  34  18.487 -12.654   0.402
  298    HE1  PHE  34           HE1      PHE  34  19.886  -8.327  -1.613
  299    HE2  PHE  34           HE2      PHE  34  18.349 -10.565   1.726
  300    HZ   PHE  34           HZ       PHE  34  19.031  -8.396   0.724
  301    HB2  PHE  34           HB2      PHE  34  19.245 -12.803  -3.197
  302    HB3  PHE  34           HB3      PHE  34  18.754 -13.709  -1.779
  303    H    GLY  35           H        GLY  35  22.373 -14.440  -3.990
  304    HA2  GLY  35           HA2      GLY  35  23.006 -16.911  -3.492
  305    HA3  GLY  35           HA3      GLY  35  21.318 -17.229  -3.846
  306    H    GLN  36           H        GLN  36  23.391 -14.895  -5.585
  307    HA   GLN  36           HA       GLN  36  24.049 -14.638  -7.645
  308    HB2  GLN  36           HB2      GLN  36  25.526 -16.462  -6.954
  309    HB3  GLN  36           HB3      GLN  36  24.418 -17.639  -7.661
  310    HG2  GLN  36           HG2      GLN  36  26.321 -17.197  -9.142
  311    HG3  GLN  36           HG3      GLN  36  24.803 -16.751  -9.897
  312   HE21  GLN  36          HE22      GLN  36  24.801 -14.748 -10.912
  313   HE22  GLN  36          HE21      GLN  36  25.905 -13.440 -10.536
  314    H    ILE  37           H        ILE  37  22.758 -13.794  -9.087
  315    HA   ILE  37           HA       ILE  37  20.472 -15.102 -10.256
  316    HB   ILE  37           HB       ILE  37  22.131 -12.648 -10.937
  317   HG12  ILE  37          HG12      ILE  37  19.326 -13.111  -9.814
  318   HG13  ILE  37          HG13      ILE  37  20.727 -12.547  -8.904
  319   HG21  ILE  37          HG21      ILE  37  20.509 -12.015 -12.612
  320   HG22  ILE  37          HG22      ILE  37  21.241 -13.515 -13.081
  321   HG23  ILE  37          HG23      ILE  37  19.599 -13.523 -12.379
  322   HD11  ILE  37          HD11      ILE  37  19.270 -10.694  -9.384
  323   HD12  ILE  37          HD12      ILE  37  20.789 -10.487 -10.286
  324   HD13  ILE  37          HD13      ILE  37  19.286 -11.018 -11.101
  325    H    LEU  38           H        LEU  38  20.302 -16.061 -12.260
  326    HA   LEU  38           HA       LEU  38  22.772 -17.054 -13.574
  327    HG   LEU  38           HG       LEU  38  20.923 -18.610 -15.721
  328    HB2  LEU  38           HB2      LEU  38  21.277 -18.788 -12.691
  329    HB3  LEU  38           HB3      LEU  38  19.899 -18.070 -13.528
  330   HD11  LEU  38          HD11      LEU  38  22.862 -20.179 -15.798
  331   HD12  LEU  38          HD12      LEU  38  23.317 -18.603 -15.150
  332   HD13  LEU  38          HD13      LEU  38  23.084 -19.976 -14.045
  333   HD21  LEU  38          HD21      LEU  38  20.714 -20.982 -13.821
  334   HD22  LEU  38          HD22      LEU  38  19.355 -20.165 -14.620
  335   HD23  LEU  38          HD23      LEU  38  20.555 -21.031 -15.591
  336    H    ASP  39           H        ASP  39  19.536 -15.442 -14.120
  337    HA   ASP  39           HA       ASP  39  20.624 -14.110 -16.465
  338    HB2  ASP  39           HB2      ASP  39  19.956 -16.326 -17.394
  339    HB3  ASP  39           HB3      ASP  39  18.319 -16.062 -16.817
  340    H    ILE  40           H        ILE  40  18.921 -12.594 -17.461
  341    HA   ILE  40           HA       ILE  40  16.941 -11.601 -15.492
  342    HB   ILE  40           HB       ILE  40  19.217  -9.910 -16.633
  343   HG12  ILE  40          HG12      ILE  40  18.759 -10.866 -13.778
  344   HG13  ILE  40          HG13      ILE  40  20.077 -11.348 -14.852
  345   HG21  ILE  40          HG21      ILE  40  16.952  -9.172 -14.719
  346   HG22  ILE  40          HG22      ILE  40  18.282  -8.100 -15.214
  347   HG23  ILE  40          HG23      ILE  40  17.128  -8.616 -16.401
  348   HD11  ILE  40          HD11      ILE  40  20.916  -8.998 -14.860
  349   HD12  ILE  40          HD12      ILE  40  19.701  -8.617 -13.620
  350   HD13  ILE  40          HD13      ILE  40  20.962  -9.793 -13.272
  351    H    VAL  41           H        VAL  41  15.260 -10.421 -16.529
  352    HA   VAL  41           HA       VAL  41  15.513  -9.882 -19.426
  353    HB   VAL  41           HB       VAL  41  13.134 -11.343 -18.219
  354   HG11  VAL  41          HG11      VAL  41  12.533  -9.873 -20.113
  355   HG12  VAL  41          HG12      VAL  41  13.798 -10.627 -21.108
  356   HG13  VAL  41          HG13      VAL  41  12.396 -11.573 -20.565
  357   HG21  VAL  41          HG21      VAL  41  14.970 -12.946 -18.360
  358   HG22  VAL  41          HG22      VAL  41  13.790 -13.274 -19.625
  359   HG23  VAL  41          HG23      VAL  41  15.311 -12.449 -20.034
  360    H    ALA  42           H        ALA  42  15.320  -7.742 -19.467
  361    HA   ALA  42           HA       ALA  42  12.834  -6.484 -18.621
  362    HB1  ALA  42           HB1      ALA  42  15.589  -5.354 -17.931
  363    HB2  ALA  42           HB2      ALA  42  14.044  -4.494 -17.762
  364    HB3  ALA  42           HB3      ALA  42  14.367  -5.921 -16.763
  365    H    LEU  43           H        LEU  43  12.807  -4.263 -19.890
  366    HA   LEU  43           HA       LEU  43  14.329  -4.387 -22.408
  367    HG   LEU  43           HG       LEU  43  12.248  -3.855 -24.637
  368    HB2  LEU  43           HB2      LEU  43  12.161  -5.903 -22.396
  369    HB3  LEU  43           HB3      LEU  43  11.305  -4.363 -22.468
  370   HD11  LEU  43          HD11      LEU  43  13.645  -5.581 -25.841
  371   HD12  LEU  43          HD12      LEU  43  14.503  -4.793 -24.523
  372   HD13  LEU  43          HD13      LEU  43  13.852  -6.432 -24.294
  373   HD21  LEU  43          HD21      LEU  43  11.211  -5.689 -25.911
  374   HD22  LEU  43          HD22      LEU  43  11.293  -6.755 -24.487
  375   HD23  LEU  43          HD23      LEU  43  10.246  -5.327 -24.472
  376    H    LYS  44           H        LYS  44  13.685  -2.400 -23.817
  377    HA   LYS  44           HA       LYS  44  13.690  -0.100 -22.044
  378    HB2  LYS  44           HB2      LYS  44  13.614  -0.298 -25.091
  379    HB3  LYS  44           HB3      LYS  44  13.780   1.207 -24.176
  380    HG2  LYS  44           HG2      LYS  44  15.885   0.368 -23.145
  381    HG3  LYS  44           HG3      LYS  44  15.731  -1.137 -24.053
  382    HD2  LYS  44           HD2      LYS  44  17.321   0.239 -25.187
  383    HD3  LYS  44           HD3      LYS  44  15.865   0.149 -26.189
  384    HE2  LYS  44           HE2      LYS  44  15.160   2.390 -25.328
  385    HE3  LYS  44           HE3      LYS  44  16.619   2.456 -24.328
  386    HZ1  LYS  44           HZ1      LYS  44  16.898   3.676 -26.390
  387    HZ2  LYS  44           HZ2      LYS  44  17.933   2.420 -26.371
  388    HZ3  LYS  44           HZ3      LYS  44  16.583   2.358 -27.292
  389    H    THR  45           H        THR  45  11.103  -1.829 -23.691
  390    HA   THR  45           HA       THR  45   9.254   0.357 -23.887
  391    HB   THR  45           HB       THR  45   7.628  -1.663 -23.926
  392    HG1  THR  45           HG1      THR  45   8.578  -3.660 -24.094
  393   HG21  THR  45          HG21      THR  45   8.327  -2.352 -26.182
  394   HG22  THR  45          HG22      THR  45   8.506  -0.599 -25.994
  395   HG23  THR  45          HG23      THR  45   9.939  -1.649 -25.928
  396    H    LEU  46           H        LEU  46   7.693   1.049 -22.348
  397    HA   LEU  46           HA       LEU  46   8.343   0.776 -19.636
  398    HG   LEU  46           HG       LEU  46   4.752   2.796 -20.590
  399    HB2  LEU  46           HB2      LEU  46   6.487   2.001 -19.058
  400    HB3  LEU  46           HB3      LEU  46   7.062   2.633 -20.571
  401   HD11  LEU  46          HD11      LEU  46   5.671   2.024 -22.741
  402   HD12  LEU  46          HD12      LEU  46   5.261   0.344 -22.314
  403   HD13  LEU  46          HD13      LEU  46   3.987   1.553 -22.502
  404   HD21  LEU  46          HD21      LEU  46   3.104   1.173 -20.132
  405   HD22  LEU  46          HD22      LEU  46   4.271  -0.140 -20.003
  406   HD23  LEU  46          HD23      LEU  46   4.245   1.150 -18.782
  407    H    LYS  47           H        LYS  47   6.299  -1.260 -21.616
  408    HA   LYS  47           HA       LYS  47   4.957  -2.800 -19.718
  409    HB2  LYS  47           HB2      LYS  47   4.593  -2.880 -22.163
  410    HB3  LYS  47           HB3      LYS  47   6.171  -3.653 -22.388
  411    HG2  LYS  47           HG2      LYS  47   5.404  -5.628 -21.125
  412    HG3  LYS  47           HG3      LYS  47   3.843  -4.846 -20.812
  413    HD2  LYS  47           HD2      LYS  47   3.357  -4.829 -23.225
  414    HD3  LYS  47           HD3      LYS  47   4.938  -5.528 -23.585
  415    HE2  LYS  47           HE2      LYS  47   2.755  -6.871 -21.915
  416    HE3  LYS  47           HE3      LYS  47   3.046  -7.184 -23.624
  417    HZ1  LYS  47           HZ1      LYS  47   4.120  -8.869 -22.326
  418    HZ2  LYS  47           HZ2      LYS  47   5.297  -7.959 -22.997
  419    HZ3  LYS  47           HZ3      LYS  47   4.918  -7.780 -21.411
  420    H    MET  48           H        MET  48   8.439  -2.856 -20.451
  421    HA   MET  48           HA       MET  48   8.753  -4.905 -18.336
  422    HB2  MET  48           HB2      MET  48   9.746  -5.046 -21.185
  423    HB3  MET  48           HB3      MET  48  10.618  -5.881 -19.901
  424    HG2  MET  48           HG2      MET  48   7.729  -6.297 -20.722
  425    HG3  MET  48           HG3      MET  48   9.078  -7.389 -21.008
  426    HE1  MET  48           HE1      MET  48  10.429  -6.961 -17.938
  427    HE2  MET  48           HE2      MET  48   9.815  -8.436 -17.178
  428    HE3  MET  48           HE3      MET  48  10.470  -8.490 -18.845
  429    H    ARG  49           H        ARG  49   8.940  -2.022 -18.394
  430    HA   ARG  49           HA       ARG  49  11.670  -1.883 -17.213
  431    HE   ARG  49           HE       ARG  49  12.039   1.537 -20.738
  432    HB2  ARG  49           HB2      ARG  49  11.635  -0.599 -19.263
  433    HB3  ARG  49           HB3      ARG  49  10.211   0.294 -18.744
  434    HG2  ARG  49           HG2      ARG  49  11.385   1.522 -17.150
  435    HG3  ARG  49           HG3      ARG  49  12.734   0.381 -17.078
  436    HD2  ARG  49           HD2      ARG  49  13.245   2.563 -18.275
  437    HD3  ARG  49           HD3      ARG  49  13.616   1.084 -19.151
  438   HH11  ARG  49          HH21      ARG  49  11.522   3.893 -18.113
  439   HH12  ARG  49          HH22      ARG  49  10.437   4.859 -19.058
  440   HH21  ARG  49          HH11      ARG  49  10.691   2.750 -21.927
  441   HH22  ARG  49          HH12      ARG  49   9.935   4.192 -21.309
  442    H    GLY  50           H        GLY  50   8.180  -1.117 -16.933
  443    HA2  GLY  50           HA2      GLY  50   8.500  -0.105 -14.196
  444    HA3  GLY  50           HA3      GLY  50   6.993  -0.493 -15.048
  445    H    GLN  51           H        GLN  51   8.848  -3.140 -15.624
  446    HA   GLN  51           HA       GLN  51   8.652  -4.620 -13.168
  447    HB2  GLN  51           HB2      GLN  51   7.102  -6.331 -14.136
  448    HB3  GLN  51           HB3      GLN  51   6.343  -4.770 -13.819
  449    HG2  GLN  51           HG2      GLN  51   6.517  -4.221 -16.268
  450    HG3  GLN  51           HG3      GLN  51   7.200  -5.821 -16.546
  451   HE21  GLN  51          HE22      GLN  51   5.330  -5.955 -18.036
  452   HE22  GLN  51          HE21      GLN  51   3.788  -6.536 -17.404
  453    H    ALA  52           H        ALA  52   9.528  -6.901 -13.643
  454    HA   ALA  52           HA       ALA  52  11.247  -7.212 -15.979
  455    HB1  ALA  52           HB1      ALA  52  12.590  -5.619 -14.670
  456    HB2  ALA  52           HB2      ALA  52  12.446  -6.661 -13.230
  457    HB3  ALA  52           HB3      ALA  52  13.336  -7.223 -14.660
  458    H    PHE  53           H        PHE  53  12.544  -9.289 -15.664
  459    HA   PHE  53           HA       PHE  53  11.479 -11.080 -13.549
  460    HD1  PHE  53           HD1      PHE  53   9.280 -12.845 -14.118
  461    HD2  PHE  53           HD2      PHE  53  10.431 -10.845 -17.761
  462    HE1  PHE  53           HE1      PHE  53   6.893 -12.676 -14.789
  463    HE2  PHE  53           HE2      PHE  53   8.042 -10.668 -18.417
  464    HZ   PHE  53           HZ       PHE  53   6.270 -11.578 -16.924
  465    HB2  PHE  53           HB2      PHE  53  12.083 -11.940 -16.401
  466    HB3  PHE  53           HB3      PHE  53  11.614 -12.983 -15.081
  467    H    VAL  54           H        VAL  54  13.052 -12.659 -12.886
  468    HA   VAL  54           HA       VAL  54  15.729 -12.514 -14.005
  469    HB   VAL  54           HB       VAL  54  16.677 -11.203 -12.545
  470   HG11  VAL  54          HG11      VAL  54  15.603 -10.072 -10.636
  471   HG12  VAL  54          HG12      VAL  54  14.684  -9.914 -12.124
  472   HG13  VAL  54          HG13      VAL  54  14.153 -11.061 -10.871
  473   HG21  VAL  54          HG21      VAL  54  17.045 -11.812 -10.190
  474   HG22  VAL  54          HG22      VAL  54  15.828 -13.091 -10.330
  475   HG23  VAL  54          HG23      VAL  54  17.330 -13.162 -11.284
  476    H    ILE  55           H        ILE  55  16.978 -14.350 -13.397
  477    HA   ILE  55           HA       ILE  55  15.364 -16.652 -12.453
  478    HB   ILE  55           HB       ILE  55  17.251 -16.569 -14.852
  479   HG12  ILE  55          HG12      ILE  55  14.887 -17.311 -15.951
  480   HG13  ILE  55          HG13      ILE  55  14.258 -16.312 -14.648
  481   HG21  ILE  55          HG21      ILE  55  15.446 -18.782 -13.781
  482   HG22  ILE  55          HG22      ILE  55  16.461 -18.872 -15.237
  483   HG23  ILE  55          HG23      ILE  55  17.221 -18.734 -13.651
  484   HD11  ILE  55          HD11      ILE  55  15.612 -14.376 -15.567
  485   HD12  ILE  55          HD12      ILE  55  16.135 -15.444 -16.882
  486   HD13  ILE  55          HD13      ILE  55  14.426 -15.029 -16.702
  487    H    PHE  56           H        PHE  56  16.420 -17.615 -10.784
  488    HA   PHE  56           HA       PHE  56  19.274 -16.893 -10.270
  489    HD1  PHE  56           HD1      PHE  56  16.330 -15.311  -8.951
  490    HD2  PHE  56           HD2      PHE  56  20.019 -16.540  -7.084
  491    HE1  PHE  56           HE1      PHE  56  16.591 -13.049  -7.962
  492    HE2  PHE  56           HE2      PHE  56  20.268 -14.278  -6.093
  493    HZ   PHE  56           HZ       PHE  56  18.551 -12.552  -6.514
  494    HB2  PHE  56           HB2      PHE  56  16.978 -17.827  -8.553
  495    HB3  PHE  56           HB3      PHE  56  18.620 -18.162  -8.059
  496    H    LYS  57           H        LYS  57  20.706 -18.640  -9.507
  497    HA   LYS  57           HA       LYS  57  20.754 -20.804 -11.340
  498    HB2  LYS  57           HB2      LYS  57  22.578 -21.710  -9.936
  499    HB3  LYS  57           HB3      LYS  57  22.805 -20.011 -10.351
  500    HG2  LYS  57           HG2      LYS  57  22.239 -19.282  -8.147
  501    HG3  LYS  57           HG3      LYS  57  21.608 -20.861  -7.680
  502    HD2  LYS  57           HD2      LYS  57  23.840 -21.849  -7.779
  503    HD3  LYS  57           HD3      LYS  57  24.519 -20.329  -8.372
  504    HE2  LYS  57           HE2      LYS  57  24.968 -20.663  -5.973
  505    HE3  LYS  57           HE3      LYS  57  24.022 -19.202  -6.275
  506    HZ1  LYS  57           HZ1      LYS  57  23.231 -20.546  -4.386
  507    HZ2  LYS  57           HZ2      LYS  57  22.064 -20.306  -5.496
  508    HZ3  LYS  57           HZ3      LYS  57  22.825 -21.772  -5.396
  509    H    GLU  58           H        GLU  58  19.183 -20.625  -8.157
  510    HA   GLU  58           HA       GLU  58  18.328 -23.447  -8.382
  511    HB2  GLU  58           HB2      GLU  58  19.879 -22.207  -6.060
  512    HB3  GLU  58           HB3      GLU  58  18.968 -23.713  -5.938
  513    HG2  GLU  58           HG2      GLU  58  20.396 -24.749  -7.665
  514    HG3  GLU  58           HG3      GLU  58  21.338 -23.261  -7.798
  515    H    ILE  59           H        ILE  59  16.506 -23.897  -7.048
  516    HA   ILE  59           HA       ILE  59  14.642 -21.770  -6.881
  517    HB   ILE  59           HB       ILE  59  13.183 -23.439  -5.814
  518   HG12  ILE  59          HG12      ILE  59  15.487 -25.405  -5.960
  519   HG13  ILE  59          HG13      ILE  59  14.818 -24.708  -4.477
  520   HG21  ILE  59          HG21      ILE  59  12.889 -24.787  -7.751
  521   HG22  ILE  59          HG22      ILE  59  13.440 -23.202  -8.254
  522   HG23  ILE  59          HG23      ILE  59  14.584 -24.564  -8.250
  523   HD11  ILE  59          HD11      ILE  59  13.861 -26.885  -4.741
  524   HD12  ILE  59          HD12      ILE  59  12.582 -25.694  -5.066
  525   HD13  ILE  59          HD13      ILE  59  13.370 -26.553  -6.409
  526    H    GLY  60           H        GLY  60  16.719 -23.207  -4.308
  527    HA2  GLY  60           HA2      GLY  60  15.460 -21.874  -2.124
  528    HA3  GLY  60           HA3      GLY  60  17.142 -22.437  -2.183
  529    H    SER  61           H        SER  61  17.841 -20.802  -4.521
  530    HA   SER  61           HA       SER  61  18.635 -18.391  -3.108
  531    HG   SER  61           HG       SER  61  20.378 -19.855  -3.740
  532    HB2  SER  61           HB2      SER  61  18.922 -19.146  -6.053
  533    HB3  SER  61           HB3      SER  61  19.828 -17.913  -5.177
  534    H    ALA  62           H        ALA  62  16.395 -19.178  -5.831
  535    HA   ALA  62           HA       ALA  62  15.415 -16.533  -6.234
  536    HB1  ALA  62           HB1      ALA  62  14.064 -19.253  -6.559
  537    HB2  ALA  62           HB2      ALA  62  13.385 -17.723  -7.122
  538    HB3  ALA  62           HB3      ALA  62  14.918 -18.294  -7.803
  539    H    SER  63           H        SER  63  14.311 -19.152  -4.032
  540    HA   SER  63           HA       SER  63  12.105 -17.884  -2.881
  541    HG   SER  63           HG       SER  63  13.396 -20.677  -3.340
  542    HB2  SER  63           HB2      SER  63  14.113 -19.659  -1.420
  543    HB3  SER  63           HB3      SER  63  12.431 -19.386  -0.990
  544    H    ASN  64           H        ASN  64  15.492 -17.836  -1.736
  545    HA   ASN  64           HA       ASN  64  15.066 -16.099   0.456
  546    HB2  ASN  64           HB2      ASN  64  17.072 -17.535   0.153
  547    HB3  ASN  64           HB3      ASN  64  17.581 -16.536  -1.210
  548   HD21  ASN  64          HD22      ASN  64  19.521 -15.761  -0.308
  549   HD22  ASN  64          HD21      ASN  64  19.575 -14.806   1.164
  550    H    ALA  65           H        ALA  65  16.176 -15.358  -2.868
  551    HA   ALA  65           HA       ALA  65  16.579 -12.587  -2.524
  552    HB1  ALA  65           HB1      ALA  65  17.365 -13.912  -4.469
  553    HB2  ALA  65           HB2      ALA  65  15.690 -14.108  -5.031
  554    HB3  ALA  65           HB3      ALA  65  16.424 -12.493  -4.978
  555    H    LEU  66           H        LEU  66  13.706 -14.313  -3.822
  556    HA   LEU  66           HA       LEU  66  12.052 -12.093  -4.290
  557    HG   LEU  66           HG       LEU  66   9.846 -13.242  -5.484
  558    HB2  LEU  66           HB2      LEU  66  11.786 -14.518  -4.987
  559    HB3  LEU  66           HB3      LEU  66  11.247 -14.878  -3.351
  560   HD11  LEU  66          HD11      LEU  66   8.124 -15.048  -5.174
  561   HD12  LEU  66          HD12      LEU  66   9.686 -15.646  -5.753
  562   HD13  LEU  66          HD13      LEU  66   9.230 -15.858  -4.053
  563   HD21  LEU  66          HD21      LEU  66   9.044 -13.608  -2.575
  564   HD22  LEU  66          HD22      LEU  66   9.305 -12.087  -3.443
  565   HD23  LEU  66          HD23      LEU  66   7.922 -13.082  -3.863
  566    H    ARG  67           H        ARG  67  12.045 -14.309  -1.440
  567    HA   ARG  67           HA       ARG  67  10.030 -12.958  -0.058
  568    HE   ARG  67           HE       ARG  67  13.736 -13.466   2.810
  569    HB2  ARG  67           HB2      ARG  67  10.716 -15.219   0.383
  570    HB3  ARG  67           HB3      ARG  67  12.328 -14.746   0.879
  571    HG2  ARG  67           HG2      ARG  67   9.800 -13.973   2.399
  572    HG3  ARG  67           HG3      ARG  67  10.679 -15.466   2.677
  573    HD2  ARG  67           HD2      ARG  67  11.639 -12.651   3.246
  574    HD3  ARG  67           HD3      ARG  67  11.334 -13.940   4.388
  575   HH11  ARG  67          HH11      ARG  67  12.037 -15.896   4.762
  576   HH12  ARG  67          HH12      ARG  67  13.424 -16.902   4.944
  577   HH21  ARG  67          HH21      ARG  67  15.540 -14.811   2.975
  578   HH22  ARG  67          HH22      ARG  67  15.472 -16.247   3.931
  579    H    THR  68           H        THR  68  13.632 -12.524   0.197
  580    HA   THR  68           HA       THR  68  13.241 -10.688   2.397
  581    HB   THR  68           HB       THR  68  15.852 -11.046   0.911
  582    HG1  THR  68           HG1      THR  68  15.388 -13.089   1.186
  583   HG21  THR  68          HG21      THR  68  15.885  -9.477   2.799
  584   HG22  THR  68          HG22      THR  68  15.070 -10.663   3.846
  585   HG23  THR  68          HG23      THR  68  16.721 -10.967   3.279
  586    H    MET  69           H        MET  69  13.657 -10.264  -1.134
  587    HA   MET  69           HA       MET  69  14.166  -7.397  -0.781
  588    HB2  MET  69           HB2      MET  69  13.856  -9.113  -3.270
  589    HB3  MET  69           HB3      MET  69  14.196  -7.389  -3.279
  590    HG2  MET  69           HG2      MET  69  15.947  -9.535  -2.013
  591    HG3  MET  69           HG3      MET  69  16.264  -8.711  -3.529
  592    HE1  MET  69           HE1      MET  69  15.627  -5.706  -3.059
  593    HE2  MET  69           HE2      MET  69  17.141  -5.061  -2.382
  594    HE3  MET  69           HE3      MET  69  17.197  -6.207  -3.728
  595    H    GLN  70           H        GLN  70  11.281  -9.318  -1.022
  596    HA   GLN  70           HA       GLN  70   9.472  -7.509  -2.147
  597    HB2  GLN  70           HB2      GLN  70   9.263  -9.289   0.308
  598    HB3  GLN  70           HB3      GLN  70   7.891  -8.340  -0.266
  599    HG2  GLN  70           HG2      GLN  70   9.235 -10.052  -2.296
  600    HG3  GLN  70           HG3      GLN  70   8.360 -10.874  -1.007
  601   HE21  GLN  70          HE22      GLN  70   6.454 -11.543  -2.019
  602   HE22  GLN  70          HE21      GLN  70   5.530 -10.535  -3.100
  603    H    GLY  71           H        GLY  71   8.860  -5.488  -1.792
  604    HA2  GLY  71           HA2      GLY  71   8.322  -3.564  -0.715
  605    HA3  GLY  71           HA3      GLY  71   8.667  -4.329   0.841
  606    H    PHE  72           H        PHE  72  11.468  -4.722  -1.053
  607    HA   PHE  72           HA       PHE  72  12.987  -2.864   0.498
  608    HD1  PHE  72           HD2      PHE  72  15.727  -3.774   0.873
  609    HD2  PHE  72           HD1      PHE  72  15.033  -2.695  -3.247
  610    HE1  PHE  72           HE2      PHE  72  17.969  -2.714   0.768
  611    HE2  PHE  72           HE1      PHE  72  17.286  -1.647  -3.347
  612    HZ   PHE  72           HZ       PHE  72  18.753  -1.654  -1.342
  613    HB2  PHE  72           HB2      PHE  72  13.944  -4.877  -0.525
  614    HB3  PHE  72           HB3      PHE  72  13.583  -4.265  -2.136
  615    HA   PRO  73           HA       PRO  73  12.087   0.718  -2.160
  616    HB2  PRO  73           HB2      PRO  73  13.731   2.597  -1.086
  617    HB3  PRO  73           HB3      PRO  73  12.244   2.016  -0.278
  618    HG2  PRO  73           HG2      PRO  73  15.102   1.144   0.244
  619    HG3  PRO  73           HG3      PRO  73  13.834   1.562   1.434
  620    HD2  PRO  73           HD2      PRO  73  14.424  -1.026   0.687
  621    HD3  PRO  73           HD3      PRO  73  12.784  -0.515   1.186
  622    H    PHE  74           H        PHE  74  12.840  -0.046  -4.152
  623    HA   PHE  74           HA       PHE  74  15.576  -0.691  -4.691
  624    HD1  PHE  74           HD1      PHE  74  16.069  -2.588  -6.123
  625    HD2  PHE  74           HD2      PHE  74  14.098   0.088  -8.877
  626    HE1  PHE  74           HE1      PHE  74  17.455  -3.471  -7.976
  627    HE2  PHE  74           HE2      PHE  74  15.499  -0.793 -10.723
  628    HZ   PHE  74           HZ       PHE  74  17.161  -2.582 -10.287
  629    HB2  PHE  74           HB2      PHE  74  13.573  -1.564  -5.877
  630    HB3  PHE  74           HB3      PHE  74  13.335  -0.019  -6.649
  631    H    TYR  75           H        TYR  75  13.584   1.995  -5.906
  632    HA   TYR  75           HA       TYR  75  15.664   4.002  -5.536
  633    HD1  TYR  75           HD1      TYR  75  17.627   5.159  -6.958
  634    HD2  TYR  75           HD2      TYR  75  16.461   1.424  -8.771
  635    HE1  TYR  75           HE1      TYR  75  20.009   4.565  -7.254
  636    HE2  TYR  75           HE2      TYR  75  18.838   0.815  -9.073
  637    HH   TYR  75           HH       TYR  75  21.522   2.975  -8.026
  638    HB2  TYR  75           HB2      TYR  75  14.790   3.101  -8.311
  639    HB3  TYR  75           HB3      TYR  75  15.312   4.746  -7.995
  640    H    ASP  76           H        ASP  76  14.046   4.658  -4.049
  641    HA   ASP  76           HA       ASP  76  12.251   5.728  -3.276
  642    HB2  ASP  76           HB2      ASP  76  13.342   7.459  -4.689
  643    HB3  ASP  76           HB3      ASP  76  12.209   7.084  -5.986
  644    H    LYS  77           H        LYS  77  11.693   3.169  -4.796
  645    HA   LYS  77           HA       LYS  77   8.787   3.386  -4.501
  646    HB2  LYS  77           HB2      LYS  77  10.119   2.157  -6.967
  647    HB3  LYS  77           HB3      LYS  77   8.479   1.784  -6.438
  648    HG2  LYS  77           HG2      LYS  77   7.967   4.282  -6.573
  649    HG3  LYS  77           HG3      LYS  77   9.523   4.465  -7.411
  650    HD2  LYS  77           HD2      LYS  77   8.744   2.846  -9.150
  651    HD3  LYS  77           HD3      LYS  77   7.207   2.675  -8.291
  652    HE2  LYS  77           HE2      LYS  77   6.794   5.116  -8.525
  653    HE3  LYS  77           HE3      LYS  77   8.288   5.292  -9.450
  654    HZ1  LYS  77           HZ1      LYS  77   6.203   5.103 -10.771
  655    HZ2  LYS  77           HZ2      LYS  77   7.340   4.055 -11.241
  656    HZ3  LYS  77           HZ3      LYS  77   6.060   3.543 -10.325
  657    HA   PRO  78           HA       PRO  78  10.069  -0.400  -2.384
  658    HB2  PRO  78           HB2      PRO  78   7.635  -1.347  -1.568
  659    HB3  PRO  78           HB3      PRO  78   8.450   0.044  -0.788
  660    HG2  PRO  78           HG2      PRO  78   6.255   0.094  -2.878
  661    HG3  PRO  78           HG3      PRO  78   6.381   1.059  -1.375
  662    HD2  PRO  78           HD2      PRO  78   7.128   2.023  -3.837
  663    HD3  PRO  78           HD3      PRO  78   7.954   2.516  -2.329
  664    H    MET  79           H        MET  79  10.552  -2.296  -3.383
  665    HA   MET  79           HA       MET  79   9.471  -3.063  -5.923
  666    HB2  MET  79           HB2      MET  79  11.001  -4.703  -3.839
  667    HB3  MET  79           HB3      MET  79  10.712  -5.190  -5.520
  668    HG2  MET  79           HG2      MET  79  11.913  -3.159  -6.297
  669    HG3  MET  79           HG3      MET  79  12.229  -2.721  -4.630
  670    HE1  MET  79           HE1      MET  79  13.591  -4.005  -7.666
  671    HE2  MET  79           HE2      MET  79  14.674  -5.358  -7.302
  672    HE3  MET  79           HE3      MET  79  12.917  -5.616  -7.303
  673    H    GLN  80           H        GLN  80   8.050  -4.734  -6.458
  674    HA   GLN  80           HA       GLN  80   6.620  -6.157  -4.265
  675    HB2  GLN  80           HB2      GLN  80   5.439  -4.995  -6.835
  676    HB3  GLN  80           HB3      GLN  80   4.593  -6.093  -5.744
  677    HG2  GLN  80           HG2      GLN  80   5.607  -3.319  -4.942
  678    HG3  GLN  80           HG3      GLN  80   3.981  -3.666  -5.503
  679   HE21  GLN  80          HE22      GLN  80   6.290  -4.287  -2.814
  680   HE22  GLN  80          HE21      GLN  80   5.050  -4.715  -1.654
  681    H    ILE  81           H        ILE  81   6.744  -8.359  -4.642
  682    HA   ILE  81           HA       ILE  81   7.893  -9.231  -7.226
  683    HB   ILE  81           HB       ILE  81   9.016 -10.247  -4.622
  684   HG12  ILE  81          HG12      ILE  81   9.923  -7.707  -5.995
  685   HG13  ILE  81          HG13      ILE  81   9.424  -7.958  -4.308
  686   HG21  ILE  81          HG21      ILE  81  10.301  -9.982  -7.374
  687   HG22  ILE  81          HG22      ILE  81  10.957 -10.870  -5.984
  688   HG23  ILE  81          HG23      ILE  81   9.533 -11.455  -6.802
  689   HD11  ILE  81          HD11      ILE  81  11.782  -7.631  -4.372
  690   HD12  ILE  81          HD12      ILE  81  11.467  -9.329  -3.943
  691   HD13  ILE  81          HD13      ILE  81  12.008  -8.891  -5.584
  692    H    ALA  82           H        ALA  82   7.804 -11.548  -7.447
  693    HA   ALA  82           HA       ALA  82   6.331 -13.313  -5.754
  694    HB1  ALA  82           HB1      ALA  82   4.364 -12.149  -6.796
  695    HB2  ALA  82           HB2      ALA  82   5.024 -12.500  -8.410
  696    HB3  ALA  82           HB3      ALA  82   4.489 -13.822  -7.353
  697    H    TYR  83           H        TYR  83   6.037 -15.448  -7.181
  698    HA   TYR  83           HA       TYR  83   8.521 -15.970  -8.690
  699    HD1  TYR  83           HD2      TYR  83   6.011 -17.110  -5.696
  700    HD2  TYR  83           HD1      TYR  83   5.190 -18.660  -9.639
  701    HE1  TYR  83           HE2      TYR  83   3.641 -17.472  -5.054
  702    HE2  TYR  83           HE1      TYR  83   2.840 -19.080  -8.988
  703    HH   TYR  83           HH       TYR  83   1.553 -18.251  -5.737
  704    HB2  TYR  83           HB2      TYR  83   7.492 -18.246  -8.912
  705    HB3  TYR  83           HB3      TYR  83   7.844 -17.753  -7.267
  706    H    SER  84           H        SER  84   8.361 -16.502 -11.037
  707    HA   SER  84           HA       SER  84   6.644 -14.756 -12.409
  708    HG   SER  84           HG       SER  84   9.605 -15.336 -13.972
  709    HB2  SER  84           HB2      SER  84   8.060 -17.188 -13.545
  710    HB3  SER  84           HB3      SER  84   7.511 -15.747 -14.428
  711    H    LYS  85           H        LYS  85   4.751 -14.904 -13.429
  712    HA   LYS  85           HA       LYS  85   3.209 -17.443 -13.536
  713    HB2  LYS  85           HB2      LYS  85   2.349 -14.813 -12.246
  714    HB3  LYS  85           HB3      LYS  85   1.206 -16.075 -12.719
  715    HG2  LYS  85           HG2      LYS  85   2.223 -17.691 -11.226
  716    HG3  LYS  85           HG3      LYS  85   3.454 -16.533 -10.721
  717    HD2  LYS  85           HD2      LYS  85   0.465 -16.091 -10.337
  718    HD3  LYS  85           HD3      LYS  85   1.525 -16.816  -9.122
  719    HE2  LYS  85           HE2      LYS  85   2.944 -14.776  -9.120
  720    HE3  LYS  85           HE3      LYS  85   1.866 -14.024 -10.302
  721    HZ1  LYS  85           HZ1      LYS  85   0.074 -14.164  -8.671
  722    HZ2  LYS  85           HZ2      LYS  85   1.067 -14.848  -7.568
  723    HZ3  LYS  85           HZ3      LYS  85   1.322 -13.315  -8.064
  724    H    SER  86           H        SER  86   4.704 -16.006 -15.527
  725    HA   SER  86           HA       SER  86   3.334 -14.085 -16.971
  726    HG   SER  86           HG       SER  86   6.951 -14.631 -16.965
  727    HB2  SER  86           HB2      SER  86   5.416 -15.959 -18.117
  728    HB3  SER  86           HB3      SER  86   5.228 -14.215 -18.369
  729    H    ASP  87           H        ASP  87   1.721 -16.727 -16.714
  730    HA   ASP  87           HA       ASP  87   1.779 -18.302 -19.006
  731    HB2  ASP  87           HB2      ASP  87   0.601 -18.932 -16.984
  732    HB3  ASP  87           HB3      ASP  87  -0.557 -17.615 -17.199
  733    H    SER  88           H        SER  88  -0.396 -15.452 -18.424
  734    HA   SER  88           HA       SER  88  -1.720 -15.588 -20.887
  735    HG   SER  88           HG       SER  88  -2.978 -13.581 -18.149
  736    HB2  SER  88           HB2      SER  88  -1.076 -13.051 -19.336
  737    HB3  SER  88           HB3      SER  88  -2.476 -13.359 -20.379
  738    H    ASP  89           H        ASP  89   1.464 -14.190 -20.109
  739    HA   ASP  89           HA       ASP  89   1.593 -12.583 -22.539
  740    HB2  ASP  89           HB2      ASP  89   2.730 -11.934 -20.418
  741    HB3  ASP  89           HB3      ASP  89   3.799 -13.332 -20.583
  742    H    ILE  90           H        ILE  90   3.038 -15.648 -21.366
  743    HA   ILE  90           HA       ILE  90   4.428 -16.103 -23.860
  744    HB   ILE  90           HB       ILE  90   4.891 -18.336 -23.091
  745   HG12  ILE  90          HG12      ILE  90   3.109 -17.769 -20.697
  746   HG13  ILE  90          HG13      ILE  90   2.737 -18.904 -21.998
  747   HG21  ILE  90          HG21      ILE  90   6.168 -16.328 -22.308
  748   HG22  ILE  90          HG22      ILE  90   5.207 -16.337 -20.813
  749   HG23  ILE  90          HG23      ILE  90   6.274 -17.703 -21.208
  750   HD11  ILE  90          HD11      ILE  90   4.776 -20.222 -21.376
  751   HD12  ILE  90          HD12      ILE  90   4.983 -19.152 -19.965
  752   HD13  ILE  90          HD13      ILE  90   3.531 -20.152 -20.113
  753    H    VAL  91           H        VAL  91   1.148 -16.959 -22.692
  754    HA   VAL  91           HA       VAL  91   0.519 -18.548 -24.952
  755    HB   VAL  91           HB       VAL  91  -1.166 -16.941 -23.020
  756   HG11  VAL  91          HG11      VAL  91  -2.459 -16.858 -25.099
  757   HG12  VAL  91          HG12      VAL  91  -2.206 -18.598 -25.362
  758   HG13  VAL  91          HG13      VAL  91  -3.188 -18.025 -23.994
  759   HG21  VAL  91          HG21      VAL  91  -1.862 -19.164 -22.271
  760   HG22  VAL  91          HG22      VAL  91  -0.994 -19.939 -23.614
  761   HG23  VAL  91          HG23      VAL  91  -0.095 -19.137 -22.322
  762    H    ALA  92           H        ALA  92   0.247 -14.947 -24.421
  763    HA   ALA  92           HA       ALA  92  -0.729 -14.393 -27.016
  764    HB1  ALA  92           HB1      ALA  92   0.108 -12.110 -26.647
  765    HB2  ALA  92           HB2      ALA  92  -0.751 -12.734 -25.227
  766    HB3  ALA  92           HB3      ALA  92   1.023 -12.661 -25.227
  767    H    LYS  93           H        LYS  93   2.696 -14.764 -25.894
  768    HA   LYS  93           HA       LYS  93   3.930 -14.153 -28.368
  769    HB2  LYS  93           HB2      LYS  93   4.796 -16.156 -26.237
  770    HB3  LYS  93           HB3      LYS  93   5.731 -15.776 -27.675
  771    HG2  LYS  93           HG2      LYS  93   5.759 -13.362 -26.983
  772    HG3  LYS  93           HG3      LYS  93   5.012 -13.838 -25.442
  773    HD2  LYS  93           HD2      LYS  93   6.952 -15.368 -25.005
  774    HD3  LYS  93           HD3      LYS  93   7.635 -14.912 -26.567
  775    HE2  LYS  93           HE2      LYS  93   8.860 -13.566 -25.187
  776    HE3  LYS  93           HE3      LYS  93   7.577 -12.462 -25.683
  777    HZ1  LYS  93           HZ1      LYS  93   7.682 -13.953 -23.118
  778    HZ2  LYS  93           HZ2      LYS  93   7.999 -12.371 -23.308
  779    HZ3  LYS  93           HZ3      LYS  93   6.479 -12.910 -23.521
  780    H    ILE  94           H        ILE  94   2.828 -17.461 -27.253
  781    HA   ILE  94           HA       ILE  94   3.568 -18.523 -29.826
  782    HB   ILE  94           HB       ILE  94   2.564 -20.603 -29.163
  783   HG12  ILE  94          HG12      ILE  94   1.532 -19.188 -26.688
  784   HG13  ILE  94          HG13      ILE  94   0.529 -19.763 -28.020
  785   HG21  ILE  94          HG21      ILE  94   4.080 -19.391 -26.810
  786   HG22  ILE  94          HG22      ILE  94   4.052 -21.089 -27.322
  787   HG23  ILE  94          HG23      ILE  94   4.828 -19.882 -28.345
  788   HD11  ILE  94          HD11      ILE  94   0.374 -21.338 -26.216
  789   HD12  ILE  94          HD12      ILE  94   1.289 -22.101 -27.534
  790   HD13  ILE  94          HD13      ILE  94   2.132 -21.481 -26.090
  791    H    LYS  95           H        LYS  95   0.536 -17.135 -28.640
  792    HA   LYS  95           HA       LYS  95  -1.075 -18.002 -30.859
  793    HB2  LYS  95           HB2      LYS  95  -1.288 -15.683 -28.899
  794    HB3  LYS  95           HB3      LYS  95  -2.474 -15.933 -30.160
  795    HG2  LYS  95           HG2      LYS  95  -1.814 -18.029 -28.049
  796    HG3  LYS  95           HG3      LYS  95  -3.127 -16.855 -27.931
  797    HD2  LYS  95           HD2      LYS  95  -4.131 -17.806 -30.017
  798    HD3  LYS  95           HD3      LYS  95  -2.842 -19.030 -30.054
  799    HE2  LYS  95           HE2      LYS  95  -3.524 -19.820 -27.801
  800    HE3  LYS  95           HE3      LYS  95  -4.814 -18.613 -27.765
  801    HZ1  LYS  95           HZ1      LYS  95  -5.642 -20.773 -28.443
  802    HZ2  LYS  95           HZ2      LYS  95  -5.820 -19.726 -29.675
  803    HZ3  LYS  95           HZ3      LYS  95  -4.625 -20.842 -29.711
  804    H    GLY  96           H        GLY  96   1.209 -15.267 -30.486
  805    HA2  GLY  96           HA2      GLY  96   1.680 -15.296 -33.267
  806    HA3  GLY  96           HA3      GLY  96   0.575 -13.952 -32.933
  807    H    THR  97           H        THR  97   1.394 -12.826 -30.625
  808    HA   THR  97           HA       THR  97   4.220 -12.483 -30.310
  809    HB   THR  97           HB       THR  97   2.601 -10.404 -31.854
  810    HG1  THR  97           HG1      THR  97   4.042 -12.205 -32.746
  811   HG21  THR  97          HG21      THR  97   3.816  -9.090 -30.192
  812   HG22  THR  97          HG22      THR  97   5.320  -9.976 -30.533
  813   HG23  THR  97          HG23      THR  97   4.599  -8.908 -31.756
  814    H    PHE  98           H        PHE  98   4.544 -11.179 -28.382
  815    HA   PHE  98           HA       PHE  98   2.618 -11.545 -26.410
  816    HD1  PHE  98           HD1      PHE  98   4.223  -7.788 -25.493
  817    HD2  PHE  98           HD2      PHE  98   6.679 -10.679 -27.554
  818    HE1  PHE  98           HE1      PHE  98   5.747  -5.975 -26.228
  819    HE2  PHE  98           HE2      PHE  98   8.173  -8.856 -28.317
  820    HZ   PHE  98           HZ       PHE  98   7.717  -6.504 -27.653
  821    HB2  PHE  98           HB2      PHE  98   4.108 -10.255 -24.975
  822    HB3  PHE  98           HB3      PHE  98   4.983 -11.405 -25.948
  823    H    LYS  99           H        LYS  99   2.429  -9.077 -28.732
  824    HA   LYS  99           HA       LYS  99   0.578  -7.479 -27.066
  825    HB2  LYS  99           HB2      LYS  99   1.596  -5.388 -27.887
  826    HB3  LYS  99           HB3      LYS  99   2.704  -6.321 -26.896
  827    HG2  LYS  99           HG2      LYS  99   3.946  -7.083 -28.844
  828    HG3  LYS  99           HG3      LYS  99   2.754  -6.376 -29.949
  829    HD2  LYS  99           HD2      LYS  99   3.324  -4.117 -29.168
  830    HD3  LYS  99           HD3      LYS  99   4.481  -4.791 -28.000
  831    HE2  LYS  99           HE2      LYS  99   5.790  -5.787 -29.853
  832    HE3  LYS  99           HE3      LYS  99   4.625  -5.164 -31.028
  833    HZ1  LYS  99           HZ1      LYS  99   5.246  -2.917 -30.363
  834    HZ2  LYS  99           HZ2      LYS  99   6.324  -3.485 -29.272
  835    HZ3  LYS  99           HZ3      LYS  99   6.559  -3.736 -30.863
  836    H    GLU 100           H        GLU 100   0.272  -9.523 -29.363
  837    HA   GLU 100           HA       GLU 100  -1.350  -7.752 -31.106
  838    HB2  GLU 100           HB2      GLU 100   0.942  -8.188 -32.126
  839    HB3  GLU 100           HB3      GLU 100   0.505  -9.904 -32.190
  840    HG2  GLU 100           HG2      GLU 100  -1.431  -9.359 -33.635
  841    HG3  GLU 100           HG3      GLU 100  -1.053  -7.642 -33.514
  842    H    ARG 101           H        ARG 101  -3.287  -8.654 -31.656
  843    HA   ARG 101           HA       ARG 101  -4.188 -11.027 -30.278
  844    HE   ARG 101           HE       ARG 101  -8.127 -10.699 -30.807
  845    HB2  ARG 101           HB2      ARG 101  -5.354  -9.167 -32.398
  846    HB3  ARG 101           HB3      ARG 101  -6.200 -10.620 -31.925
  847    HG2  ARG 101           HG2      ARG 101  -5.374  -8.488 -29.923
  848    HG3  ARG 101           HG3      ARG 101  -6.923  -8.477 -30.763
  849    HD2  ARG 101           HD2      ARG 101  -5.961 -10.765 -28.990
  850    HD3  ARG 101           HD3      ARG 101  -7.025  -9.451 -28.471
  851   HH11  ARG 101          HH11      ARG 101  -7.499 -11.572 -27.424
  852   HH12  ARG 101          HH12      ARG 101  -8.941 -12.500 -27.256
  853   HH21  ARG 101          HH21      ARG 101 -10.173 -11.659 -30.492
  854   HH22  ARG 101          HH22      ARG 101 -10.449 -12.646 -29.088
  855    HA   PRO 102           HA       PRO 102  -3.235 -13.915 -33.610
  856    HB2  PRO 102           HB2      PRO 102  -5.023 -15.946 -33.058
  857    HB3  PRO 102           HB3      PRO 102  -3.511 -15.679 -32.152
  858    HG2  PRO 102           HG2      PRO 102  -6.318 -14.829 -31.405
  859    HG3  PRO 102           HG3      PRO 102  -5.066 -15.556 -30.357
  860    HD2  PRO 102           HD2      PRO 102  -5.569 -12.858 -30.436
  861    HD3  PRO 102           HD3      PRO 102  -3.933 -13.514 -30.130
  862    H    LYS 103           H        LYS 103  -6.601 -13.096 -32.776
  863    HA   LYS 103           HA       LYS 103  -7.334 -12.471 -35.540
  864    HB2  LYS 103           HB2      LYS 103  -8.852 -14.516 -33.830
  865    HB3  LYS 103           HB3      LYS 103  -9.461 -13.786 -35.317
  866    HG2  LYS 103           HG2      LYS 103  -7.564 -14.815 -36.579
  867    HG3  LYS 103           HG3      LYS 103  -7.058 -15.642 -35.087
  868    HD2  LYS 103           HD2      LYS 103  -9.282 -16.736 -34.944
  869    HD3  LYS 103           HD3      LYS 103  -9.761 -15.982 -36.468
  870    HE2  LYS 103           HE2      LYS 103  -7.399 -17.887 -36.099
  871    HE3  LYS 103           HE3      LYS 103  -8.997 -18.366 -36.671
  872    HZ1  LYS 103           HZ1      LYS 103  -7.193 -16.484 -38.076
  873    HZ2  LYS 103           HZ2      LYS 103  -7.504 -18.021 -38.512
  874    HZ3  LYS 103           HZ3      LYS 103  -8.690 -16.909 -38.586
  875    H    LYS 104           H        LYS 104  -9.369 -11.185 -35.487
  876    HA   LYS 104           HA       LYS 104  -9.662  -9.456 -33.213
  877    HB2  LYS 104           HB2      LYS 104 -10.333  -8.823 -35.524
  878    HB3  LYS 104           HB3      LYS 104 -11.628 -10.040 -35.469
  879    HG2  LYS 104           HG2      LYS 104 -12.703  -8.845 -33.600
  880    HG3  LYS 104           HG3      LYS 104 -11.344  -7.725 -33.510
  881    HD2  LYS 104           HD2      LYS 104 -13.145  -6.599 -34.548
  882    HD3  LYS 104           HD3      LYS 104 -11.923  -6.847 -35.782
  883    HE2  LYS 104           HE2      LYS 104 -14.299  -8.735 -35.441
  884    HE3  LYS 104           HE3      LYS 104 -14.452  -7.216 -36.320
  885    HZ1  LYS 104           HZ1      LYS 104 -12.735  -7.963 -37.848
  886    HZ2  LYS 104           HZ2      LYS 104 -12.609  -9.402 -37.074
  887    HZ3  LYS 104           HZ3      LYS 104 -13.991  -8.996 -37.831
  Start of MODEL    9
    1    HA   MET   1           HA       MET   1   9.153 -20.135   1.727
    2    H1   MET   1           H1       MET   1   8.358 -21.011   4.409
    3    H2   MET   1           H2       MET   1   9.786 -21.366   3.677
    4    H3   MET   1           H3       MET   1   9.416 -19.817   4.065
    5    HB2  MET   1           HB2      MET   1   8.640 -22.598   1.982
    6    HB3  MET   1           HB3      MET   1   6.993 -22.177   2.437
    7    HG2  MET   1           HG2      MET   1   8.322 -21.323  -0.166
    8    HG3  MET   1           HG3      MET   1   7.470 -22.845   0.009
    9    HE1  MET   1           HE1      MET   1   4.805 -22.303   1.572
   10    HE2  MET   1           HE2      MET   1   3.732 -21.896   0.218
   11    HE3  MET   1           HE3      MET   1   4.928 -23.198   0.038
   12    H    GLU   2           H        GLU   2   7.820 -18.584   0.772
   13    HA   GLU   2           HA       GLU   2   5.341 -17.780   2.163
   14    HB2  GLU   2           HB2      GLU   2   7.304 -16.445   3.051
   15    HB3  GLU   2           HB3      GLU   2   7.479 -15.749   1.433
   16    HG2  GLU   2           HG2      GLU   2   5.129 -14.892   1.611
   17    HG3  GLU   2           HG3      GLU   2   5.021 -15.575   3.234
   18    H    MET   3           H        MET   3   7.523 -17.367  -0.610
   19    HA   MET   3           HA       MET   3   5.179 -17.428  -2.455
   20    HB2  MET   3           HB2      MET   3   7.818 -15.917  -2.628
   21    HB3  MET   3           HB3      MET   3   6.915 -16.368  -4.067
   22    HG2  MET   3           HG2      MET   3   6.357 -14.114  -3.539
   23    HG3  MET   3           HG3      MET   3   4.953 -15.133  -3.304
   24    HE1  MET   3           HE1      MET   3   7.301 -13.123   0.184
   25    HE2  MET   3           HE2      MET   3   8.022 -14.408  -0.805
   26    HE3  MET   3           HE3      MET   3   7.665 -12.817  -1.524
   27    H    LEU   4           H        LEU   4   5.391 -18.949  -4.158
   28    HA   LEU   4           HA       LEU   4   6.552 -21.341  -3.315
   29    HG   LEU   4           HG       LEU   4   3.731 -20.374  -4.580
   30    HB2  LEU   4           HB2      LEU   4   5.619 -20.625  -6.115
   31    HB3  LEU   4           HB3      LEU   4   5.936 -22.249  -5.522
   32   HD11  LEU   4          HD11      LEU   4   3.382 -21.482  -6.776
   33   HD12  LEU   4          HD12      LEU   4   3.622 -23.065  -6.013
   34   HD13  LEU   4          HD13      LEU   4   2.236 -22.048  -5.553
   35   HD21  LEU   4          HD21      LEU   4   2.925 -22.313  -3.216
   36   HD22  LEU   4          HD22      LEU   4   4.452 -23.159  -3.558
   37   HD23  LEU   4          HD23      LEU   4   4.443 -21.641  -2.627
   38    HA   PRO   5           HA       PRO   5  10.788 -21.005  -4.887
   39    HB2  PRO   5           HB2      PRO   5  10.616 -24.007  -4.669
   40    HB3  PRO   5           HB3      PRO   5  11.921 -22.906  -4.134
   41    HG2  PRO   5           HG2      PRO   5  10.182 -23.930  -2.333
   42    HG3  PRO   5           HG3      PRO   5  10.669 -22.205  -2.242
   43    HD2  PRO   5           HD2      PRO   5   8.131 -23.374  -3.419
   44    HD3  PRO   5           HD3      PRO   5   8.341 -21.954  -2.348
   45    H    ASN   6           H        ASN   6  11.359 -20.764  -6.916
   46    HA   ASN   6           HA       ASN   6  11.309 -22.841  -8.866
   47    HB2  ASN   6           HB2      ASN   6   9.007 -21.903  -9.332
   48    HB3  ASN   6           HB3      ASN   6   9.726 -20.295  -9.503
   49   HD21  ASN   6          HD22      ASN   6   9.727 -23.628 -10.882
   50   HD22  ASN   6          HD21      ASN   6  10.455 -23.194 -12.408
   51    H    GLN   7           H        GLN   7  12.906 -22.117 -10.615
   52    HA   GLN   7           HA       GLN   7  14.959 -20.488  -9.475
   53    HB2  GLN   7           HB2      GLN   7  14.525 -21.539 -12.301
   54    HB3  GLN   7           HB3      GLN   7  15.915 -20.555 -11.837
   55    HG2  GLN   7           HG2      GLN   7  16.495 -22.219 -10.061
   56    HG3  GLN   7           HG3      GLN   7  15.193 -23.262 -10.654
   57   HE21  GLN   7          HE22      GLN   7  18.159 -21.510 -11.776
   58   HE22  GLN   7          HE21      GLN   7  18.613 -22.717 -12.967
   59    H    THR   8           H        THR   8  12.166 -19.573 -11.467
   60    HA   THR   8           HA       THR   8  13.392 -16.945 -12.045
   61    HB   THR   8           HB       THR   8  10.841 -18.196 -13.092
   62    HG1  THR   8           HG1      THR   8  11.924 -19.048 -14.685
   63   HG21  THR   8          HG21      THR   8  12.609 -15.931 -14.127
   64   HG22  THR   8          HG22      THR   8  11.276 -16.665 -15.047
   65   HG23  THR   8          HG23      THR   8  10.943 -15.796 -13.546
   66    H    ILE   9           H        ILE   9  12.414 -15.026 -11.406
   67    HA   ILE   9           HA       ILE   9   9.915 -15.127  -9.830
   68    HB   ILE   9           HB       ILE   9  10.676 -13.794  -8.104
   69   HG12  ILE   9          HG12      ILE   9  13.116 -13.098  -9.744
   70   HG13  ILE   9          HG13      ILE   9  11.779 -12.034  -9.328
   71   HG21  ILE   9          HG21      ILE   9  12.567 -14.932  -7.056
   72   HG22  ILE   9          HG22      ILE   9  11.607 -16.115  -7.952
   73   HG23  ILE   9          HG23      ILE   9  13.144 -15.515  -8.613
   74   HD11  ILE   9          HD11      ILE   9  13.844 -13.083  -7.363
   75   HD12  ILE   9          HD12      ILE   9  13.627 -11.430  -7.948
   76   HD13  ILE   9          HD13      ILE   9  12.391 -12.179  -6.922
   77    H    TYR  10           H        TYR  10   8.940 -12.916  -9.735
   78    HA   TYR  10           HA       TYR  10   9.267 -11.400 -12.289
   79    HD1  TYR  10           HD2      TYR  10   7.613 -10.149 -13.670
   80    HD2  TYR  10           HD1      TYR  10   4.678 -12.006 -11.105
   81    HE1  TYR  10           HE2      TYR  10   5.852  -8.720 -14.648
   82    HE2  TYR  10           HE1      TYR  10   2.914 -10.580 -12.073
   83    HH   TYR  10           HH       TYR  10   3.562  -8.126 -14.602
   84    HB2  TYR  10           HB2      TYR  10   7.423 -12.916 -12.512
   85    HB3  TYR  10           HB3      TYR  10   6.878 -12.624 -10.873
   86    H    ILE  11           H        ILE  11   9.098  -9.184 -12.018
   87    HA   ILE  11           HA       ILE  11   8.813  -8.145  -9.238
   88    HB   ILE  11           HB       ILE  11  10.907  -7.526 -11.362
   89   HG12  ILE  11          HG12      ILE  11  11.192  -8.584  -8.512
   90   HG13  ILE  11          HG13      ILE  11  11.268  -9.588  -9.959
   91   HG21  ILE  11          HG21      ILE  11  10.481  -6.123  -8.681
   92   HG22  ILE  11          HG22      ILE  11  11.849  -5.854  -9.787
   93   HG23  ILE  11          HG23      ILE  11  10.241  -5.400 -10.287
   94   HD11  ILE  11          HD11      ILE  11  13.275  -8.300 -10.720
   95   HD12  ILE  11          HD12      ILE  11  13.279  -7.469  -9.142
   96   HD13  ILE  11          HD13      ILE  11  13.495  -9.222  -9.219
   97    H    ASN  12           H        ASN  12   7.846  -6.143  -9.076
   98    HA   ASN  12           HA       ASN  12   6.701  -4.782 -11.419
   99    HB2  ASN  12           HB2      ASN  12   5.223  -6.684  -9.736
  100    HB3  ASN  12           HB3      ASN  12   4.594  -5.066  -9.478
  101   HD21  ASN  12          HD22      ASN  12   5.844  -6.948 -12.321
  102   HD22  ASN  12          HD21      ASN  12   4.465  -6.574 -13.347
  103    H    ASN  13           H        ASN  13   5.488  -2.800 -10.601
  104    HA   ASN  13           HA       ASN  13   5.848  -0.725  -9.845
  105    HB2  ASN  13           HB2      ASN  13   4.701  -1.771  -7.829
  106    HB3  ASN  13           HB3      ASN  13   6.301  -1.921  -7.095
  107   HD21  ASN  13          HD22      ASN  13   6.348  -0.311  -5.496
  108   HD22  ASN  13          HD21      ASN  13   5.791   1.333  -5.749
  109    H    LEU  14           H        LEU  14   7.989  -1.972 -11.034
  110    HA   LEU  14           HA       LEU  14  10.508  -1.189  -9.743
  111    HG   LEU  14           HG       LEU  14  12.208  -2.868 -10.849
  112    HB2  LEU  14           HB2      LEU  14   9.893  -3.103 -11.497
  113    HB3  LEU  14           HB3      LEU  14  10.011  -1.808 -12.666
  114   HD11  LEU  14          HD11      LEU  14  11.780  -3.070 -13.857
  115   HD12  LEU  14          HD12      LEU  14  13.133  -3.756 -12.938
  116   HD13  LEU  14          HD13      LEU  14  11.501  -4.362 -12.669
  117   HD21  LEU  14          HD21      LEU  14  12.775  -0.547 -11.213
  118   HD22  LEU  14          HD22      LEU  14  13.773  -1.510 -12.292
  119   HD23  LEU  14          HD23      LEU  14  12.368  -0.648 -12.938
  120    H    ASN  15           H        ASN  15  11.631   0.813 -10.505
  121    HA   ASN  15           HA       ASN  15   9.801   2.942 -11.289
  122    HB2  ASN  15           HB2      ASN  15  12.613   2.793 -10.368
  123    HB3  ASN  15           HB3      ASN  15  12.319   3.994 -11.620
  124   HD21  ASN  15          HD22      ASN  15  10.242   5.438 -11.288
  125   HD22  ASN  15          HD21      ASN  15  10.064   5.996  -9.633
  126    H    GLU  16           H        GLU  16   9.014   2.919 -13.206
  127    HA   GLU  16           HA       GLU  16   9.747   2.032 -15.642
  128    HB2  GLU  16           HB2      GLU  16   8.344   3.761 -16.548
  129    HB3  GLU  16           HB3      GLU  16   7.654   3.190 -15.036
  130    HG2  GLU  16           HG2      GLU  16   9.147   5.814 -15.496
  131    HG3  GLU  16           HG3      GLU  16   7.426   5.613 -15.250
  132    H    LYS  17           H        LYS  17  11.195   4.971 -14.147
  133    HA   LYS  17           HA       LYS  17  12.451   5.859 -16.533
  134    HB2  LYS  17           HB2      LYS  17  13.715   7.350 -15.168
  135    HB3  LYS  17           HB3      LYS  17  12.010   7.330 -14.718
  136    HG2  LYS  17           HG2      LYS  17  12.516   5.929 -12.747
  137    HG3  LYS  17           HG3      LYS  17  14.238   5.875 -13.205
  138    HD2  LYS  17           HD2      LYS  17  14.343   8.330 -13.071
  139    HD3  LYS  17           HD3      LYS  17  12.624   8.386 -12.629
  140    HE2  LYS  17           HE2      LYS  17  13.097   7.061 -10.578
  141    HE3  LYS  17           HE3      LYS  17  14.805   6.960 -11.025
  142    HZ1  LYS  17           HZ1      LYS  17  14.940   9.376 -10.800
  143    HZ2  LYS  17           HZ2      LYS  17  13.362   9.471 -10.385
  144    HZ3  LYS  17           HZ3      LYS  17  14.422   8.711  -9.408
  145    H    ILE  18           H        ILE  18  13.365   3.198 -14.491
  146    HA   ILE  18           HA       ILE  18  16.222   3.479 -14.723
  147    HB   ILE  18           HB       ILE  18  14.431   1.129 -13.987
  148   HG12  ILE  18          HG12      ILE  18  14.184   3.007 -12.429
  149   HG13  ILE  18          HG13      ILE  18  14.976   1.650 -11.664
  150   HG21  ILE  18          HG21      ILE  18  16.593   0.251 -14.650
  151   HG22  ILE  18          HG22      ILE  18  17.426   1.383 -13.567
  152   HG23  ILE  18          HG23      ILE  18  16.381   0.109 -12.909
  153   HD11  ILE  18          HD11      ILE  18  16.338   4.203 -12.648
  154   HD12  ILE  18          HD12      ILE  18  15.948   3.793 -10.976
  155   HD13  ILE  18          HD13      ILE  18  17.162   2.844 -11.846
  156    H    LYS  19           H        LYS  19  17.529   2.982 -16.358
  157    HA   LYS  19           HA       LYS  19  16.554   2.004 -18.898
  158    HB2  LYS  19           HB2      LYS  19  18.453   3.615 -18.484
  159    HB3  LYS  19           HB3      LYS  19  19.382   2.290 -17.789
  160    HG2  LYS  19           HG2      LYS  19  19.364   1.142 -20.008
  161    HG3  LYS  19           HG3      LYS  19  18.455   2.510 -20.684
  162    HD2  LYS  19           HD2      LYS  19  20.326   4.032 -20.122
  163    HD3  LYS  19           HD3      LYS  19  21.200   2.698 -19.349
  164    HE2  LYS  19           HE2      LYS  19  21.126   1.490 -21.603
  165    HE3  LYS  19           HE3      LYS  19  20.508   2.992 -22.304
  166    HZ1  LYS  19           HZ1      LYS  19  22.888   2.863 -22.547
  167    HZ2  LYS  19           HZ2      LYS  19  22.570   4.071 -21.500
  168    HZ3  LYS  19           HZ3      LYS  19  23.127   2.619 -20.948
  169    H    LYS  20           H        LYS  20  17.215  -0.047 -19.921
  170    HA   LYS  20           HA       LYS  20  16.961  -2.394 -18.379
  171    HB2  LYS  20           HB2      LYS  20  16.685  -2.182 -20.886
  172    HB3  LYS  20           HB3      LYS  20  18.450  -2.067 -21.027
  173    HG2  LYS  20           HG2      LYS  20  18.610  -4.359 -19.937
  174    HG3  LYS  20           HG3      LYS  20  16.848  -4.414 -19.914
  175    HD2  LYS  20           HD2      LYS  20  17.612  -5.700 -21.780
  176    HD3  LYS  20           HD3      LYS  20  16.857  -4.234 -22.426
  177    HE2  LYS  20           HE2      LYS  20  19.091  -3.222 -22.774
  178    HE3  LYS  20           HE3      LYS  20  19.860  -4.624 -22.021
  179    HZ1  LYS  20           HZ1      LYS  20  19.034  -5.987 -23.846
  180    HZ2  LYS  20           HZ2      LYS  20  18.314  -4.697 -24.550
  181    HZ3  LYS  20           HZ3      LYS  20  19.936  -4.763 -24.425
  182    H    GLU  21           H        GLU  21  19.916  -0.735 -19.516
  183    HA   GLU  21           HA       GLU  21  21.828  -2.534 -18.487
  184    HB2  GLU  21           HB2      GLU  21  22.323  -0.861 -20.137
  185    HB3  GLU  21           HB3      GLU  21  21.820   0.447 -19.064
  186    HG2  GLU  21           HG2      GLU  21  23.734   0.102 -17.609
  187    HG3  GLU  21           HG3      GLU  21  24.202  -1.355 -18.505
  188    H    GLU  22           H        GLU  22  20.201   0.277 -16.931
  189    HA   GLU  22           HA       GLU  22  21.790   0.192 -14.536
  190    HB2  GLU  22           HB2      GLU  22  19.076   1.395 -15.165
  191    HB3  GLU  22           HB3      GLU  22  19.899   1.599 -13.613
  192    HG2  GLU  22           HG2      GLU  22  21.776   2.718 -14.695
  193    HG3  GLU  22           HG3      GLU  22  21.063   2.482 -16.287
  194    H    LEU  23           H        LEU  23  18.607  -1.151 -15.471
  195    HA   LEU  23           HA       LEU  23  17.931  -2.410 -13.013
  196    HG   LEU  23           HG       LEU  23  15.265  -4.139 -15.251
  197    HB2  LEU  23           HB2      LEU  23  16.311  -2.120 -14.751
  198    HB3  LEU  23           HB3      LEU  23  17.290  -2.915 -15.952
  199   HD11  LEU  23          HD11      LEU  23  16.161  -6.324 -15.276
  200   HD12  LEU  23          HD12      LEU  23  17.187  -5.302 -16.302
  201   HD13  LEU  23          HD13      LEU  23  17.735  -5.784 -14.696
  202   HD21  LEU  23          HD21      LEU  23  16.735  -4.691 -12.640
  203   HD22  LEU  23          HD22      LEU  23  15.402  -3.544 -12.813
  204   HD23  LEU  23          HD23      LEU  23  15.130  -5.275 -13.120
  205    H    LYS  24           H        LYS  24  19.741  -3.693 -15.856
  206    HA   LYS  24           HA       LYS  24  20.228  -6.235 -14.732
  207    HB2  LYS  24           HB2      LYS  24  20.518  -5.540 -17.142
  208    HB3  LYS  24           HB3      LYS  24  22.015  -4.714 -16.684
  209    HG2  LYS  24           HG2      LYS  24  22.936  -6.911 -15.878
  210    HG3  LYS  24           HG3      LYS  24  21.408  -7.684 -16.320
  211    HD2  LYS  24           HD2      LYS  24  23.012  -8.154 -18.035
  212    HD3  LYS  24           HD3      LYS  24  21.790  -7.063 -18.704
  213    HE2  LYS  24           HE2      LYS  24  23.332  -5.138 -18.393
  214    HE3  LYS  24           HE3      LYS  24  24.527  -6.203 -17.642
  215    HZ1  LYS  24           HZ1      LYS  24  23.601  -6.409 -20.451
  216    HZ2  LYS  24           HZ2      LYS  24  25.033  -5.803 -19.967
  217    HZ3  LYS  24           HZ3      LYS  24  24.712  -7.382 -19.751
  218    H    LYS  25           H        LYS  25  22.267  -3.263 -14.629
  219    HA   LYS  25           HA       LYS  25  24.358  -4.400 -13.106
  220    HB2  LYS  25           HB2      LYS  25  24.540  -2.250 -14.299
  221    HB3  LYS  25           HB3      LYS  25  23.335  -1.526 -13.238
  222    HG2  LYS  25           HG2      LYS  25  25.568  -0.799 -12.634
  223    HG3  LYS  25           HG3      LYS  25  24.851  -1.716 -11.311
  224    HD2  LYS  25           HD2      LYS  25  26.179  -3.710 -11.946
  225    HD3  LYS  25           HD3      LYS  25  26.874  -2.840 -13.318
  226    HE2  LYS  25           HE2      LYS  25  27.169  -2.045 -10.380
  227    HE3  LYS  25           HE3      LYS  25  28.347  -3.002 -11.280
  228    HZ1  LYS  25           HZ1      LYS  25  27.593  -0.210 -11.921
  229    HZ2  LYS  25           HZ2      LYS  25  28.986  -0.695 -11.234
  230    HZ3  LYS  25           HZ3      LYS  25  28.662  -1.115 -12.772
  231    H    SER  26           H        SER  26  21.369  -2.700 -11.994
  232    HA   SER  26           HA       SER  26  22.018  -2.705  -9.251
  233    HG   SER  26           HG       SER  26  20.368  -1.130 -11.367
  234    HB2  SER  26           HB2      SER  26  19.255  -2.891 -10.498
  235    HB3  SER  26           HB3      SER  26  19.647  -2.311  -8.871
  236    H    LEU  27           H        LEU  27  20.135  -5.051 -11.164
  237    HA   LEU  27           HA       LEU  27  19.512  -6.832  -9.039
  238    HG   LEU  27           HG       LEU  27  17.609  -6.097 -11.020
  239    HB2  LEU  27           HB2      LEU  27  19.710  -7.071 -12.051
  240    HB3  LEU  27           HB3      LEU  27  19.457  -8.515 -11.088
  241   HD11  LEU  27          HD11      LEU  27  16.070  -7.537 -12.315
  242   HD12  LEU  27          HD12      LEU  27  17.590  -7.284 -13.180
  243   HD13  LEU  27          HD13      LEU  27  17.301  -8.823 -12.355
  244   HD21  LEU  27          HD21      LEU  27  17.411  -7.316  -8.957
  245   HD22  LEU  27          HD22      LEU  27  16.042  -7.781  -9.956
  246   HD23  LEU  27          HD23      LEU  27  17.432  -8.885  -9.805
  247    H    TYR  28           H        TYR  28  22.216  -6.960 -11.446
  248    HA   TYR  28           HA       TYR  28  23.415  -9.267 -10.332
  249    HD1  TYR  28           HD2      TYR  28  24.725 -10.684 -12.242
  250    HD2  TYR  28           HD1      TYR  28  27.042  -7.192 -11.202
  251    HE1  TYR  28           HE2      TYR  28  26.782 -12.058 -12.242
  252    HE2  TYR  28           HE1      TYR  28  29.107  -8.560 -11.197
  253    HH   TYR  28           HH       TYR  28  29.092 -12.083 -11.926
  254    HB2  TYR  28           HB2      TYR  28  23.873  -8.298 -12.580
  255    HB3  TYR  28           HB3      TYR  28  24.726  -6.958 -11.819
  256    H    ALA  29           H        ALA  29  23.800  -5.807  -9.471
  257    HA   ALA  29           HA       ALA  29  26.028  -6.205  -7.736
  258    HB1  ALA  29           HB1      ALA  29  25.489  -4.022  -8.713
  259    HB2  ALA  29           HB2      ALA  29  23.953  -3.970  -7.815
  260    HB3  ALA  29           HB3      ALA  29  25.500  -3.923  -6.943
  261    H    ILE  30           H        ILE  30  22.470  -6.272  -7.102
  262    HA   ILE  30           HA       ILE  30  23.137  -6.741  -4.210
  263    HB   ILE  30           HB       ILE  30  20.651  -5.533  -5.420
  264   HG12  ILE  30          HG12      ILE  30  22.897  -4.150  -3.860
  265   HG13  ILE  30          HG13      ILE  30  22.735  -4.065  -5.611
  266   HG21  ILE  30          HG21      ILE  30  20.192  -6.674  -3.288
  267   HG22  ILE  30          HG22      ILE  30  21.542  -5.810  -2.516
  268   HG23  ILE  30          HG23      ILE  30  20.088  -4.947  -3.046
  269   HD11  ILE  30          HD11      ILE  30  20.665  -2.965  -3.673
  270   HD12  ILE  30          HD12      ILE  30  21.885  -2.043  -4.564
  271   HD13  ILE  30          HD13      ILE  30  20.617  -2.897  -5.451
  272    H    PHE  31           H        PHE  31  20.708  -7.802  -6.738
  273    HA   PHE  31           HA       PHE  31  19.461  -9.600  -4.856
  274    HD1  PHE  31           HD2      PHE  31  18.337  -6.947  -6.448
  275    HD2  PHE  31           HD1      PHE  31  16.445 -10.816  -6.560
  276    HE1  PHE  31           HE2      PHE  31  16.114  -5.884  -6.143
  277    HE2  PHE  31           HE1      PHE  31  14.240  -9.755  -6.240
  278    HZ   PHE  31           HZ       PHE  31  14.062  -7.281  -6.065
  279    HB2  PHE  31           HB2      PHE  31  19.257  -9.125  -7.812
  280    HB3  PHE  31           HB3      PHE  31  18.681 -10.645  -7.176
  281    H    SER  32           H        SER  32  22.193 -10.013  -7.187
  282    HA   SER  32           HA       SER  32  22.430 -12.802  -6.852
  283    HG   SER  32           HG       SER  32  24.314 -11.356  -9.402
  284    HB2  SER  32           HB2      SER  32  24.576 -10.694  -7.267
  285    HB3  SER  32           HB3      SER  32  24.846 -12.444  -7.393
  286    H    GLN  33           H        GLN  33  23.408 -10.183  -4.575
  287    HA   GLN  33           HA       GLN  33  24.993 -11.926  -2.902
  288    HB2  GLN  33           HB2      GLN  33  23.566  -9.334  -2.152
  289    HB3  GLN  33           HB3      GLN  33  24.795 -10.172  -1.217
  290    HG2  GLN  33           HG2      GLN  33  26.424  -9.827  -3.112
  291    HG3  GLN  33           HG3      GLN  33  25.194  -8.867  -3.938
  292   HE21  GLN  33          HE22      GLN  33  25.691  -6.692  -3.727
  293   HE22  GLN  33          HE21      GLN  33  26.281  -5.940  -2.257
  294    H    PHE  34           H        PHE  34  21.596 -11.688  -3.464
  295    HA   PHE  34           HA       PHE  34  20.975 -13.048  -0.896
  296    HD1  PHE  34           HD1      PHE  34  20.028 -11.752   0.933
  297    HD2  PHE  34           HD2      PHE  34  19.816  -9.034  -2.427
  298    HE1  PHE  34           HE1      PHE  34  20.594  -9.858   2.424
  299    HE2  PHE  34           HE2      PHE  34  20.349  -7.152  -0.909
  300    HZ   PHE  34           HZ       PHE  34  20.752  -7.551   1.505
  301    HB2  PHE  34           HB2      PHE  34  19.234 -11.360  -2.733
  302    HB3  PHE  34           HB3      PHE  34  18.668 -12.213  -1.302
  303    H    GLY  35           H        GLY  35  21.634 -13.961  -4.060
  304    HA2  GLY  35           HA2      GLY  35  20.605 -16.538  -3.537
  305    HA3  GLY  35           HA3      GLY  35  19.424 -15.709  -4.553
  306    H    GLN  36           H        GLN  36  22.718 -14.871  -5.243
  307    HA   GLN  36           HA       GLN  36  23.639 -14.735  -7.233
  308    HB2  GLN  36           HB2      GLN  36  24.844 -16.526  -6.136
  309    HB3  GLN  36           HB3      GLN  36  23.802 -17.730  -6.904
  310    HG2  GLN  36           HG2      GLN  36  26.002 -17.442  -8.063
  311    HG3  GLN  36           HG3      GLN  36  24.633 -17.138  -9.116
  312   HE21  GLN  36          HE22      GLN  36  24.621 -15.175 -10.273
  313   HE22  GLN  36          HE21      GLN  36  25.615 -13.796  -9.867
  314    H    ILE  37           H        ILE  37  22.561 -13.897  -8.808
  315    HA   ILE  37           HA       ILE  37  20.420 -14.992 -10.293
  316    HB   ILE  37           HB       ILE  37  22.516 -12.855 -10.790
  317   HG12  ILE  37          HG12      ILE  37  19.549 -12.805 -10.051
  318   HG13  ILE  37          HG13      ILE  37  20.883 -12.504  -8.939
  319   HG21  ILE  37          HG21      ILE  37  21.255 -12.005 -12.647
  320   HG22  ILE  37          HG22      ILE  37  21.784 -13.611 -13.020
  321   HG23  ILE  37          HG23      ILE  37  20.084 -13.344 -12.541
  322   HD11  ILE  37          HD11      ILE  37  19.942 -10.412  -9.512
  323   HD12  ILE  37          HD12      ILE  37  21.526 -10.511 -10.310
  324   HD13  ILE  37          HD13      ILE  37  20.023 -10.748 -11.241
  325    H    LEU  38           H        LEU  38  20.355 -15.863 -12.296
  326    HA   LEU  38           HA       LEU  38  22.758 -17.126 -13.486
  327    HG   LEU  38           HG       LEU  38  20.852 -18.887 -15.414
  328    HB2  LEU  38           HB2      LEU  38  21.302 -18.787 -12.393
  329    HB3  LEU  38           HB3      LEU  38  19.896 -18.148 -13.250
  330   HD11  LEU  38          HD11      LEU  38  23.265 -18.807 -14.929
  331   HD12  LEU  38          HD12      LEU  38  23.084 -20.072 -13.694
  332   HD13  LEU  38          HD13      LEU  38  22.806 -20.441 -15.411
  333   HD21  LEU  38          HD21      LEU  38  20.530 -21.295 -15.037
  334   HD22  LEU  38          HD22      LEU  38  20.730 -21.064 -13.285
  335   HD23  LEU  38          HD23      LEU  38  19.341 -20.348 -14.132
  336    H    ASP  39           H        ASP  39  19.575 -15.400 -13.971
  337    HA   ASP  39           HA       ASP  39  20.692 -14.202 -16.362
  338    HB2  ASP  39           HB2      ASP  39  19.797 -16.359 -17.296
  339    HB3  ASP  39           HB3      ASP  39  18.200 -15.923 -16.699
  340    H    ILE  40           H        ILE  40  19.100 -12.512 -17.271
  341    HA   ILE  40           HA       ILE  40  17.173 -11.475 -15.266
  342    HB   ILE  40           HB       ILE  40  19.572  -9.977 -16.419
  343   HG12  ILE  40          HG12      ILE  40  18.832 -10.421 -13.496
  344   HG13  ILE  40          HG13      ILE  40  19.989 -11.411 -14.378
  345   HG21  ILE  40          HG21      ILE  40  17.203  -8.918 -14.825
  346   HG22  ILE  40          HG22      ILE  40  18.691  -7.996 -15.142
  347   HG23  ILE  40          HG23      ILE  40  17.672  -8.465 -16.479
  348   HD11  ILE  40          HD11      ILE  40  21.452  -9.471 -14.741
  349   HD12  ILE  40          HD12      ILE  40  20.341  -8.460 -13.779
  350   HD13  ILE  40          HD13      ILE  40  21.190  -9.807 -13.028
  351    H    VAL  41           H        VAL  41  15.467 -10.324 -16.296
  352    HA   VAL  41           HA       VAL  41  15.635  -9.934 -19.233
  353    HB   VAL  41           HB       VAL  41  13.337 -11.312 -17.802
  354   HG11  VAL  41          HG11      VAL  41  12.610 -10.011 -19.772
  355   HG12  VAL  41          HG12      VAL  41  13.841 -10.817 -20.769
  356   HG13  VAL  41          HG13      VAL  41  12.487 -11.742 -20.084
  357   HG21  VAL  41          HG21      VAL  41  13.951 -13.342 -19.088
  358   HG22  VAL  41          HG22      VAL  41  15.438 -12.534 -19.630
  359   HG23  VAL  41          HG23      VAL  41  15.182 -12.905 -17.909
  360    H    ALA  42           H        ALA  42  15.393  -7.834 -19.473
  361    HA   ALA  42           HA       ALA  42  12.917  -6.522 -18.742
  362    HB1  ALA  42           HB1      ALA  42  14.139  -4.453 -18.025
  363    HB2  ALA  42           HB2      ALA  42  14.366  -5.795 -16.888
  364    HB3  ALA  42           HB3      ALA  42  15.658  -5.365 -18.040
  365    H    LEU  43           H        LEU  43  12.895  -4.428 -20.189
  366    HA   LEU  43           HA       LEU  43  14.553  -4.589 -22.611
  367    HG   LEU  43           HG       LEU  43  12.821  -7.162 -22.465
  368    HB2  LEU  43           HB2      LEU  43  11.532  -5.000 -22.657
  369    HB3  LEU  43           HB3      LEU  43  12.479  -4.595 -24.067
  370   HD11  LEU  43          HD11      LEU  43  11.672  -8.238 -24.355
  371   HD12  LEU  43          HD12      LEU  43  10.629  -7.049 -23.564
  372   HD13  LEU  43          HD13      LEU  43  11.404  -6.650 -25.112
  373   HD21  LEU  43          HD21      LEU  43  14.108  -7.920 -24.451
  374   HD22  LEU  43          HD22      LEU  43  13.953  -6.305 -25.176
  375   HD23  LEU  43          HD23      LEU  43  14.888  -6.538 -23.683
  376    H    LYS  44           H        LYS  44  13.886  -2.701 -24.095
  377    HA   LYS  44           HA       LYS  44  13.789  -0.327 -22.449
  378    HB2  LYS  44           HB2      LYS  44  13.688  -0.683 -25.483
  379    HB3  LYS  44           HB3      LYS  44  13.833   0.871 -24.655
  380    HG2  LYS  44           HG2      LYS  44  15.965   0.139 -23.613
  381    HG3  LYS  44           HG3      LYS  44  15.859  -1.403 -24.484
  382    HD2  LYS  44           HD2      LYS  44  15.884  -0.187 -26.649
  383    HD3  LYS  44           HD3      LYS  44  15.998   1.357 -25.777
  384    HE2  LYS  44           HE2      LYS  44  18.143   0.621 -24.759
  385    HE3  LYS  44           HE3      LYS  44  18.029  -0.918 -25.624
  386    HZ1  LYS  44           HZ1      LYS  44  18.163   0.319 -27.709
  387    HZ2  LYS  44           HZ2      LYS  44  18.269   1.742 -26.911
  388    HZ3  LYS  44           HZ3      LYS  44  19.461   0.641 -26.780
  389    H    THR  45           H        THR  45  11.198  -2.243 -23.768
  390    HA   THR  45           HA       THR  45   9.296  -0.134 -24.189
  391    HB   THR  45           HB       THR  45   7.722  -2.168 -23.792
  392    HG1  THR  45           HG1      THR  45   8.764  -4.164 -23.871
  393   HG21  THR  45          HG21      THR  45   8.379  -1.361 -26.044
  394   HG22  THR  45          HG22      THR  45   9.855  -2.350 -25.973
  395   HG23  THR  45          HG23      THR  45   8.256  -3.126 -25.996
  396    H    LEU  46           H        LEU  46   7.848   0.810 -22.675
  397    HA   LEU  46           HA       LEU  46   8.846   1.072 -20.043
  398    HG   LEU  46           HG       LEU  46   7.633   2.495 -18.574
  399    HB2  LEU  46           HB2      LEU  46   7.494   2.743 -21.237
  400    HB3  LEU  46           HB3      LEU  46   6.048   1.754 -21.053
  401   HD11  LEU  46          HD11      LEU  46   7.477   4.614 -19.807
  402   HD12  LEU  46          HD12      LEU  46   5.724   4.395 -19.999
  403   HD13  LEU  46          HD13      LEU  46   6.431   4.638 -18.384
  404   HD21  LEU  46          HD21      LEU  46   5.384   2.627 -17.539
  405   HD22  LEU  46          HD22      LEU  46   4.627   2.276 -19.106
  406   HD23  LEU  46          HD23      LEU  46   5.615   1.053 -18.286
  407    H    LYS  47           H        LYS  47   6.276  -1.058 -21.314
  408    HA   LYS  47           HA       LYS  47   5.438  -2.127 -18.830
  409    HB2  LYS  47           HB2      LYS  47   4.494  -3.956 -20.091
  410    HB3  LYS  47           HB3      LYS  47   4.192  -2.431 -20.920
  411    HG2  LYS  47           HG2      LYS  47   6.089  -2.914 -22.473
  412    HG3  LYS  47           HG3      LYS  47   6.345  -4.472 -21.681
  413    HD2  LYS  47           HD2      LYS  47   3.799  -3.612 -23.124
  414    HD3  LYS  47           HD3      LYS  47   5.074  -4.634 -23.804
  415    HE2  LYS  47           HE2      LYS  47   4.681  -6.320 -22.007
  416    HE3  LYS  47           HE3      LYS  47   3.371  -5.320 -21.364
  417    HZ1  LYS  47           HZ1      LYS  47   3.408  -6.542 -24.062
  418    HZ2  LYS  47           HZ2      LYS  47   2.525  -7.059 -22.797
  419    HZ3  LYS  47           HZ3      LYS  47   2.200  -5.612 -23.470
  420    H    MET  48           H        MET  48   8.560  -2.476 -20.229
  421    HA   MET  48           HA       MET  48   9.121  -4.720 -18.372
  422    HB2  MET  48           HB2      MET  48  10.111  -4.196 -21.172
  423    HB3  MET  48           HB3      MET  48  11.002  -5.242 -20.063
  424    HG2  MET  48           HG2      MET  48   8.101  -5.862 -20.353
  425    HG3  MET  48           HG3      MET  48   9.125  -6.150 -21.755
  426    HE1  MET  48           HE1      MET  48  10.118  -6.612 -17.857
  427    HE2  MET  48           HE2      MET  48   8.401  -7.070 -18.014
  428    HE3  MET  48           HE3      MET  48   9.629  -8.302 -17.664
  429    H    ARG  49           H        ARG  49   9.175  -1.658 -18.250
  430    HA   ARG  49           HA       ARG  49  11.792  -1.567 -16.820
  431    HE   ARG  49           HE       ARG  49  11.936   1.277 -21.342
  432    HB2  ARG  49           HB2      ARG  49  10.318   0.698 -18.236
  433    HB3  ARG  49           HB3      ARG  49  11.564   0.936 -16.998
  434    HG2  ARG  49           HG2      ARG  49  13.198  -0.319 -18.318
  435    HG3  ARG  49           HG3      ARG  49  12.007  -0.549 -19.607
  436    HD2  ARG  49           HD2      ARG  49  12.761   2.231 -18.622
  437    HD3  ARG  49           HD3      ARG  49  13.750   1.374 -19.794
  438   HH11  ARG  49          HH11      ARG  49  11.250   3.561 -18.681
  439   HH12  ARG  49          HH12      ARG  49  10.315   4.603 -19.697
  440   HH21  ARG  49          HH21      ARG  49  10.709   2.545 -22.587
  441   HH22  ARG  49          HH22      ARG  49   9.934   3.981 -21.987
  442    H    GLY  50           H        GLY  50   8.262  -0.931 -16.794
  443    HA2  GLY  50           HA2      GLY  50   8.246  -0.283 -13.951
  444    HA3  GLY  50           HA3      GLY  50   6.858  -0.645 -14.991
  445    H    GLN  51           H        GLN  51   8.779  -3.155 -15.716
  446    HA   GLN  51           HA       GLN  51   8.166  -4.922 -13.447
  447    HB2  GLN  51           HB2      GLN  51   7.492  -5.674 -16.320
  448    HB3  GLN  51           HB3      GLN  51   7.083  -6.539 -14.844
  449    HG2  GLN  51           HG2      GLN  51   5.514  -4.611 -14.272
  450    HG3  GLN  51           HG3      GLN  51   5.849  -3.949 -15.874
  451   HE21  GLN  51          HE22      GLN  51   5.348  -5.332 -17.785
  452   HE22  GLN  51          HE21      GLN  51   4.030  -6.494 -17.663
  453    H    ALA  52           H        ALA  52   9.412  -7.005 -13.751
  454    HA   ALA  52           HA       ALA  52  11.243  -7.306 -15.956
  455    HB1  ALA  52           HB1      ALA  52  12.423  -6.763 -13.187
  456    HB2  ALA  52           HB2      ALA  52  13.324  -7.350 -14.600
  457    HB3  ALA  52           HB3      ALA  52  12.613  -5.735 -14.630
  458    H    PHE  53           H        PHE  53  12.629  -9.356 -15.476
  459    HA   PHE  53           HA       PHE  53  11.493 -11.128 -13.410
  460    HD1  PHE  53           HD1      PHE  53  10.280 -10.479 -17.260
  461    HD2  PHE  53           HD2      PHE  53   9.280 -13.380 -14.226
  462    HE1  PHE  53           HE1      PHE  53   7.877 -10.288 -17.868
  463    HE2  PHE  53           HE2      PHE  53   6.888 -13.215 -14.866
  464    HZ   PHE  53           HZ       PHE  53   6.179 -11.659 -16.672
  465    HB2  PHE  53           HB2      PHE  53  11.980 -12.036 -16.277
  466    HB3  PHE  53           HB3      PHE  53  11.570 -13.063 -14.929
  467    H    VAL  54           H        VAL  54  13.103 -12.766 -12.806
  468    HA   VAL  54           HA       VAL  54  15.745 -12.624 -13.989
  469    HB   VAL  54           HB       VAL  54  16.075 -10.730 -12.722
  470   HG11  VAL  54          HG11      VAL  54  15.578 -10.354 -10.377
  471   HG12  VAL  54          HG12      VAL  54  14.088 -10.773 -11.218
  472   HG13  VAL  54          HG13      VAL  54  14.922 -11.984 -10.218
  473   HG21  VAL  54          HG21      VAL  54  17.172 -12.963 -10.988
  474   HG22  VAL  54          HG22      VAL  54  17.930 -12.257 -12.423
  475   HG23  VAL  54          HG23      VAL  54  17.698 -11.269 -10.980
  476    H    ILE  55           H        ILE  55  17.021 -14.355 -13.377
  477    HA   ILE  55           HA       ILE  55  15.514 -16.686 -12.332
  478    HB   ILE  55           HB       ILE  55  17.489 -16.576 -14.651
  479   HG12  ILE  55          HG12      ILE  55  15.705 -17.237 -16.176
  480   HG13  ILE  55          HG13      ILE  55  14.490 -17.030 -14.924
  481   HG21  ILE  55          HG21      ILE  55  17.467 -18.737 -13.452
  482   HG22  ILE  55          HG22      ILE  55  15.704 -18.843 -13.672
  483   HG23  ILE  55          HG23      ILE  55  16.798 -18.913 -15.067
  484   HD11  ILE  55          HD11      ILE  55  16.199 -14.734 -15.967
  485   HD12  ILE  55          HD12      ILE  55  14.699 -15.256 -16.752
  486   HD13  ILE  55          HD13      ILE  55  14.637 -14.646 -15.108
  487    H    PHE  56           H        PHE  56  16.799 -17.999 -10.976
  488    HA   PHE  56           HA       PHE  56  19.550 -17.041 -10.297
  489    HD1  PHE  56           HD1      PHE  56  15.750 -16.290  -9.286
  490    HD2  PHE  56           HD2      PHE  56  19.600 -15.284  -7.628
  491    HE1  PHE  56           HE1      PHE  56  15.061 -13.933  -9.095
  492    HE2  PHE  56           HE2      PHE  56  18.869 -12.939  -7.351
  493    HZ   PHE  56           HZ       PHE  56  16.608 -12.244  -8.150
  494    HB2  PHE  56           HB2      PHE  56  17.359 -18.055  -8.463
  495    HB3  PHE  56           HB3      PHE  56  18.972 -17.604  -7.963
  496    H    LYS  57           H        LYS  57  20.806 -18.700  -9.057
  497    HA   LYS  57           HA       LYS  57  21.134 -20.920 -10.726
  498    HB2  LYS  57           HB2      LYS  57  22.785 -21.718  -9.134
  499    HB3  LYS  57           HB3      LYS  57  22.958 -19.993  -9.441
  500    HG2  LYS  57           HG2      LYS  57  22.003 -19.435  -7.269
  501    HG3  LYS  57           HG3      LYS  57  21.570 -21.124  -6.965
  502    HD2  LYS  57           HD2      LYS  57  23.950 -21.777  -6.992
  503    HD3  LYS  57           HD3      LYS  57  24.412 -20.112  -7.339
  504    HE2  LYS  57           HE2      LYS  57  24.776 -20.591  -4.999
  505    HE3  LYS  57           HE3      LYS  57  23.503 -19.377  -5.157
  506    HZ1  LYS  57           HZ1      LYS  57  23.080 -21.208  -3.529
  507    HZ2  LYS  57           HZ2      LYS  57  21.877 -21.007  -4.604
  508    HZ3  LYS  57           HZ3      LYS  57  22.908 -22.269  -4.770
  509    H    GLU  58           H        GLU  58  19.166 -20.788  -7.747
  510    HA   GLU  58           HA       GLU  58  18.307 -23.584  -8.144
  511    HB2  GLU  58           HB2      GLU  58  19.712 -22.518  -5.649
  512    HB3  GLU  58           HB3      GLU  58  18.761 -24.002  -5.682
  513    HG2  GLU  58           HG2      GLU  58  20.306 -24.989  -7.334
  514    HG3  GLU  58           HG3      GLU  58  21.276 -23.511  -7.331
  515    H    ILE  59           H        ILE  59  16.333 -24.008  -6.961
  516    HA   ILE  59           HA       ILE  59  14.579 -21.795  -6.979
  517    HB   ILE  59           HB       ILE  59  12.874 -23.325  -6.261
  518   HG12  ILE  59          HG12      ILE  59  15.084 -25.300  -5.542
  519   HG13  ILE  59          HG13      ILE  59  13.959 -24.517  -4.427
  520   HG21  ILE  59          HG21      ILE  59  13.874 -23.444  -8.595
  521   HG22  ILE  59          HG22      ILE  59  14.710 -24.918  -8.080
  522   HG23  ILE  59          HG23      ILE  59  12.936 -24.844  -8.075
  523   HD11  ILE  59          HD11      ILE  59  13.265 -26.606  -6.520
  524   HD12  ILE  59          HD12      ILE  59  13.217 -26.762  -4.759
  525   HD13  ILE  59          HD13      ILE  59  12.059 -25.694  -5.577
  526    H    GLY  60           H        GLY  60  16.324 -23.271  -4.233
  527    HA2  GLY  60           HA2      GLY  60  14.815 -21.885  -2.196
  528    HA3  GLY  60           HA3      GLY  60  16.406 -22.652  -2.015
  529    H    SER  61           H        SER  61  17.799 -21.183  -4.060
  530    HA   SER  61           HA       SER  61  18.508 -18.814  -2.597
  531    HG   SER  61           HG       SER  61  20.130 -20.614  -2.999
  532    HB2  SER  61           HB2      SER  61  19.264 -19.493  -5.462
  533    HB3  SER  61           HB3      SER  61  20.175 -18.561  -4.255
  534    H    ALA  62           H        ALA  62  16.659 -19.450  -5.619
  535    HA   ALA  62           HA       ALA  62  15.985 -16.788  -6.281
  536    HB1  ALA  62           HB1      ALA  62  14.228 -19.275  -6.505
  537    HB2  ALA  62           HB2      ALA  62  14.075 -17.780  -7.442
  538    HB3  ALA  62           HB3      ALA  62  15.479 -18.838  -7.677
  539    H    SER  63           H        SER  63  14.288 -19.131  -4.111
  540    HA   SER  63           HA       SER  63  12.194 -17.418  -3.341
  541    HG   SER  63           HG       SER  63  12.889 -20.451  -3.626
  542    HB2  SER  63           HB2      SER  63  13.505 -19.583  -1.644
  543    HB3  SER  63           HB3      SER  63  11.878 -18.914  -1.446
  544    H    ASN  64           H        ASN  64  15.447 -17.809  -1.914
  545    HA   ASN  64           HA       ASN  64  14.971 -16.096   0.311
  546    HB2  ASN  64           HB2      ASN  64  16.897 -17.665   0.163
  547    HB3  ASN  64           HB3      ASN  64  17.630 -16.636  -1.073
  548   HD21  ASN  64          HD22      ASN  64  18.728 -14.750  -0.401
  549   HD22  ASN  64          HD21      ASN  64  18.814 -14.228   1.277
  550    H    ALA  65           H        ALA  65  16.410 -15.374  -2.910
  551    HA   ALA  65           HA       ALA  65  16.795 -12.610  -2.548
  552    HB1  ALA  65           HB1      ALA  65  17.632 -13.955  -4.492
  553    HB2  ALA  65           HB2      ALA  65  15.967 -14.068  -5.115
  554    HB3  ALA  65           HB3      ALA  65  16.768 -12.492  -4.992
  555    H    LEU  66           H        LEU  66  13.980 -14.365  -3.867
  556    HA   LEU  66           HA       LEU  66  12.282 -12.245  -4.441
  557    HG   LEU  66           HG       LEU  66  10.367 -13.434  -5.740
  558    HB2  LEU  66           HB2      LEU  66  12.137 -14.797  -4.866
  559    HB3  LEU  66           HB3      LEU  66  11.377 -14.918  -3.293
  560   HD11  LEU  66          HD11      LEU  66   8.617 -15.213  -5.694
  561   HD12  LEU  66          HD12      LEU  66  10.243 -15.853  -5.949
  562   HD13  LEU  66          HD13      LEU  66   9.484 -16.000  -4.358
  563   HD21  LEU  66          HD21      LEU  66   9.530 -12.241  -3.762
  564   HD22  LEU  66          HD22      LEU  66   8.226 -13.172  -4.478
  565   HD23  LEU  66          HD23      LEU  66   9.049 -13.782  -3.020
  566    H    ARG  67           H        ARG  67  12.345 -14.192  -1.384
  567    HA   ARG  67           HA       ARG  67  10.307 -12.586  -0.213
  568    HE   ARG  67           HE       ARG  67  12.106 -15.294   3.997
  569    HB2  ARG  67           HB2      ARG  67  11.096 -15.039   0.314
  570    HB3  ARG  67           HB3      ARG  67  12.270 -14.273   1.394
  571    HG2  ARG  67           HG2      ARG  67  10.264 -13.089   2.501
  572    HG3  ARG  67           HG3      ARG  67   9.229 -14.070   1.460
  573    HD2  ARG  67           HD2      ARG  67   9.264 -15.387   3.370
  574    HD3  ARG  67           HD3      ARG  67  10.574 -16.110   2.456
  575   HH11  ARG  67          HH11      ARG  67   8.891 -13.848   4.665
  576   HH12  ARG  67          HH12      ARG  67   9.388 -13.182   6.184
  577   HH21  ARG  67          HH21      ARG  67  12.718 -14.394   6.021
  578   HH22  ARG  67          HH22      ARG  67  11.589 -13.505   6.970
  579    H    THR  68           H        THR  68  13.904 -12.475   0.083
  580    HA   THR  68           HA       THR  68  13.912 -10.593   2.232
  581    HB   THR  68           HB       THR  68  16.045 -11.047   0.097
  582    HG1  THR  68           HG1      THR  68  15.706 -12.959   0.984
  583   HG21  THR  68          HG21      THR  68  17.610 -10.404   1.943
  584   HG22  THR  68          HG22      THR  68  16.564  -9.072   1.440
  585   HG23  THR  68          HG23      THR  68  16.213  -9.953   2.944
  586    H    MET  69           H        MET  69  13.887 -10.183  -1.344
  587    HA   MET  69           HA       MET  69  14.133  -7.278  -1.043
  588    HB2  MET  69           HB2      MET  69  13.894  -9.042  -3.506
  589    HB3  MET  69           HB3      MET  69  14.223  -7.310  -3.504
  590    HG2  MET  69           HG2      MET  69  15.995  -9.494  -2.322
  591    HG3  MET  69           HG3      MET  69  16.299  -8.594  -3.786
  592    HE1  MET  69           HE1      MET  69  17.085  -6.032  -3.872
  593    HE2  MET  69           HE2      MET  69  15.604  -5.552  -3.009
  594    HE3  MET  69           HE3      MET  69  17.203  -4.994  -2.447
  595    H    GLN  70           H        GLN  70  11.480  -9.439  -1.027
  596    HA   GLN  70           HA       GLN  70   9.476  -8.019  -2.319
  597    HB2  GLN  70           HB2      GLN  70   9.225 -10.252  -1.202
  598    HB3  GLN  70           HB3      GLN  70   9.341  -9.460   0.371
  599    HG2  GLN  70           HG2      GLN  70   7.047  -9.929  -0.021
  600    HG3  GLN  70           HG3      GLN  70   7.226  -8.187  -0.168
  601   HE21  GLN  70          HE22      GLN  70   6.073 -11.041  -1.729
  602   HE22  GLN  70          HE21      GLN  70   5.900 -10.394  -3.349
  603    H    GLY  71           H        GLY  71   8.627  -6.022  -2.105
  604    HA2  GLY  71           HA2      GLY  71   7.850  -4.106  -1.171
  605    HA3  GLY  71           HA3      GLY  71   8.187  -4.750   0.441
  606    H    PHE  72           H        PHE  72  11.091  -4.967  -1.352
  607    HA   PHE  72           HA       PHE  72  12.243  -3.030   0.416
  608    HD1  PHE  72           HD1      PHE  72  14.661  -4.198   1.554
  609    HD2  PHE  72           HD2      PHE  72  15.171  -2.745  -2.469
  610    HE1  PHE  72           HE1      PHE  72  16.786  -3.101   2.219
  611    HE2  PHE  72           HE2      PHE  72  17.295  -1.633  -1.799
  612    HZ   PHE  72           HZ       PHE  72  18.104  -1.815   0.544
  613    HB2  PHE  72           HB2      PHE  72  13.352  -5.117  -0.350
  614    HB3  PHE  72           HB3      PHE  72  13.494  -4.436  -1.971
  615    HA   PRO  73           HA       PRO  73  11.916   0.476  -2.463
  616    HB2  PRO  73           HB2      PRO  73  13.236   2.388  -1.096
  617    HB3  PRO  73           HB3      PRO  73  11.651   1.748  -0.571
  618    HG2  PRO  73           HG2      PRO  73  14.401   0.927   0.434
  619    HG3  PRO  73           HG3      PRO  73  12.954   1.357   1.401
  620    HD2  PRO  73           HD2      PRO  73  13.641  -1.235   0.804
  621    HD3  PRO  73           HD3      PRO  73  11.940  -0.713   0.978
  622    H    PHE  74           H        PHE  74  13.167  -0.979  -3.879
  623    HA   PHE  74           HA       PHE  74  16.043  -0.956  -3.900
  624    HD1  PHE  74           HD1      PHE  74  16.957  -3.053  -4.062
  625    HD2  PHE  74           HD2      PHE  74  15.436  -2.526  -8.054
  626    HE1  PHE  74           HE1      PHE  74  18.815  -4.385  -4.954
  627    HE2  PHE  74           HE2      PHE  74  17.336  -3.822  -8.959
  628    HZ   PHE  74           HZ       PHE  74  19.047  -4.758  -7.404
  629    HB2  PHE  74           HB2      PHE  74  14.297  -2.649  -4.880
  630    HB3  PHE  74           HB3      PHE  74  14.261  -1.565  -6.268
  631    H    TYR  75           H        TYR  75  13.606   1.134  -5.163
  632    HA   TYR  75           HA       TYR  75  15.568   3.073  -6.162
  633    HD1  TYR  75           HD1      TYR  75  16.749   2.760  -8.457
  634    HD2  TYR  75           HD2      TYR  75  13.344   0.116  -8.687
  635    HE1  TYR  75           HE1      TYR  75  18.107   1.134  -9.739
  636    HE2  TYR  75           HE2      TYR  75  14.687  -1.490 -10.015
  637    HH   TYR  75           HH       TYR  75  18.148  -0.939 -10.742
  638    HB2  TYR  75           HB2      TYR  75  13.080   2.252  -7.720
  639    HB3  TYR  75           HB3      TYR  75  14.218   3.522  -8.165
  640    H    ASP  76           H        ASP  76  13.344   4.847  -6.955
  641    HA   ASP  76           HA       ASP  76  12.505   5.821  -4.387
  642    HB2  ASP  76           HB2      ASP  76  13.098   7.236  -6.362
  643    HB3  ASP  76           HB3      ASP  76  11.650   6.654  -7.184
  644    H    LYS  77           H        LYS  77  11.543   3.050  -5.259
  645    HA   LYS  77           HA       LYS  77   8.681   3.358  -4.717
  646    HB2  LYS  77           HB2      LYS  77   9.899   2.101  -7.210
  647    HB3  LYS  77           HB3      LYS  77   8.392   1.491  -6.539
  648    HG2  LYS  77           HG2      LYS  77   7.293   3.638  -6.807
  649    HG3  LYS  77           HG3      LYS  77   8.789   4.376  -7.424
  650    HD2  LYS  77           HD2      LYS  77   8.824   2.934  -9.339
  651    HD3  LYS  77           HD3      LYS  77   7.519   1.935  -8.738
  652    HE2  LYS  77           HE2      LYS  77   7.216   4.865  -9.518
  653    HE3  LYS  77           HE3      LYS  77   6.860   3.492 -10.568
  654    HZ1  LYS  77           HZ1      LYS  77   5.450   4.172  -8.062
  655    HZ2  LYS  77           HZ2      LYS  77   4.836   4.151  -9.570
  656    HZ3  LYS  77           HZ3      LYS  77   5.246   2.740  -8.834
  657    HA   PRO  78           HA       PRO  78   9.984  -0.444  -2.525
  658    HB2  PRO  78           HB2      PRO  78   7.562  -1.231  -1.539
  659    HB3  PRO  78           HB3      PRO  78   8.508   0.114  -0.832
  660    HG2  PRO  78           HG2      PRO  78   6.164   0.279  -2.740
  661    HG3  PRO  78           HG3      PRO  78   6.485   1.262  -1.280
  662    HD2  PRO  78           HD2      PRO  78   7.072   2.105  -3.834
  663    HD3  PRO  78           HD3      PRO  78   8.028   2.610  -2.410
  664    H    MET  79           H        MET  79  10.481  -2.105  -3.925
  665    HA   MET  79           HA       MET  79   8.824  -2.625  -6.255
  666    HB2  MET  79           HB2      MET  79  11.219  -4.162  -5.127
  667    HB3  MET  79           HB3      MET  79  10.397  -4.480  -6.669
  668    HG2  MET  79           HG2      MET  79  10.829  -1.875  -7.052
  669    HG3  MET  79           HG3      MET  79  12.096  -2.135  -5.869
  670    HE1  MET  79           HE1      MET  79  12.554  -5.473  -7.093
  671    HE2  MET  79           HE2      MET  79  14.073  -5.092  -7.925
  672    HE3  MET  79           HE3      MET  79  13.773  -4.455  -6.295
  673    H    GLN  80           H        GLN  80   7.698  -4.545  -6.731
  674    HA   GLN  80           HA       GLN  80   6.721  -6.107  -4.372
  675    HB2  GLN  80           HB2      GLN  80   5.235  -5.156  -6.867
  676    HB3  GLN  80           HB3      GLN  80   4.590  -6.285  -5.666
  677    HG2  GLN  80           HG2      GLN  80   4.704  -4.554  -3.917
  678    HG3  GLN  80           HG3      GLN  80   5.472  -3.431  -5.037
  679   HE21  GLN  80          HE22      GLN  80   3.793  -1.856  -4.744
  680   HE22  GLN  80          HE21      GLN  80   2.220  -2.072  -5.469
  681    H    ILE  81           H        ILE  81   6.747  -8.349  -4.729
  682    HA   ILE  81           HA       ILE  81   7.877  -9.264  -7.320
  683    HB   ILE  81           HB       ILE  81   8.918 -10.126  -4.600
  684   HG12  ILE  81          HG12      ILE  81   9.942  -7.863  -6.352
  685   HG13  ILE  81          HG13      ILE  81   9.475  -7.814  -4.644
  686   HG21  ILE  81          HG21      ILE  81  10.208 -10.327  -7.359
  687   HG22  ILE  81          HG22      ILE  81  10.775 -11.056  -5.841
  688   HG23  ILE  81          HG23      ILE  81   9.308 -11.641  -6.595
  689   HD11  ILE  81          HD11      ILE  81  11.841  -7.660  -4.763
  690   HD12  ILE  81          HD12      ILE  81  11.449  -9.274  -4.125
  691   HD13  ILE  81          HD13      ILE  81  11.970  -9.070  -5.816
  692    H    ALA  82           H        ALA  82   7.467 -11.464  -7.799
  693    HA   ALA  82           HA       ALA  82   5.883 -13.112  -5.964
  694    HB1  ALA  82           HB1      ALA  82   4.138 -11.906  -7.275
  695    HB2  ALA  82           HB2      ALA  82   4.917 -12.429  -8.785
  696    HB3  ALA  82           HB3      ALA  82   4.183 -13.626  -7.700
  697    H    TYR  83           H        TYR  83   5.657 -15.352  -7.055
  698    HA   TYR  83           HA       TYR  83   8.289 -16.157  -8.085
  699    HD1  TYR  83           HD2      TYR  83   4.996 -16.882  -5.511
  700    HD2  TYR  83           HD1      TYR  83   5.448 -19.132  -9.170
  701    HE1  TYR  83           HE2      TYR  83   2.599 -17.470  -5.434
  702    HE2  TYR  83           HE1      TYR  83   3.043 -19.713  -9.110
  703    HH   TYR  83           HH       TYR  83   0.850 -18.597  -6.485
  704    HB2  TYR  83           HB2      TYR  83   7.409 -18.423  -7.861
  705    HB3  TYR  83           HB3      TYR  83   7.238 -17.517  -6.373
  706    H    SER  84           H        SER  84   8.223 -17.783  -9.944
  707    HA   SER  84           HA       SER  84   6.221 -17.242 -12.047
  708    HG   SER  84           HG       SER  84   7.316 -15.007 -12.105
  709    HB2  SER  84           HB2      SER  84   9.211 -17.053 -12.527
  710    HB3  SER  84           HB3      SER  84   7.913 -16.685 -13.673
  711    H    LYS  85           H        LYS  85   7.554 -18.721 -14.051
  712    HA   LYS  85           HA       LYS  85   8.110 -21.348 -12.788
  713    HB2  LYS  85           HB2      LYS  85   6.380 -20.828 -15.231
  714    HB3  LYS  85           HB3      LYS  85   7.090 -22.405 -14.840
  715    HG2  LYS  85           HG2      LYS  85   6.027 -22.302 -12.576
  716    HG3  LYS  85           HG3      LYS  85   5.215 -20.799 -13.046
  717    HD2  LYS  85           HD2      LYS  85   4.004 -21.985 -14.832
  718    HD3  LYS  85           HD3      LYS  85   4.863 -23.494 -14.428
  719    HE2  LYS  85           HE2      LYS  85   3.955 -23.382 -12.112
  720    HE3  LYS  85           HE3      LYS  85   3.086 -21.902 -12.519
  721    HZ1  LYS  85           HZ1      LYS  85   2.608 -24.551 -13.766
  722    HZ2  LYS  85           HZ2      LYS  85   1.648 -23.835 -12.664
  723    HZ3  LYS  85           HZ3      LYS  85   1.803 -23.178 -14.145
  724    H    SER  86           H        SER  86   9.345 -22.764 -14.319
  725    HA   SER  86           HA       SER  86  11.831 -21.684 -14.395
  726    HG   SER  86           HG       SER  86  11.229 -25.170 -14.013
  727    HB2  SER  86           HB2      SER  86  10.866 -24.069 -16.009
  728    HB3  SER  86           HB3      SER  86  12.497 -23.794 -15.360
  729    H    ASP  87           H        ASP  87  13.238 -20.875 -15.807
  730    HA   ASP  87           HA       ASP  87  12.525 -19.505 -18.175
  731    HB2  ASP  87           HB2      ASP  87  14.455 -18.986 -16.825
  732    HB3  ASP  87           HB3      ASP  87  15.177 -20.567 -17.163
  733    H    SER  88           H        SER  88  13.413 -19.964 -20.321
  734    HA   SER  88           HA       SER  88  13.232 -21.044 -22.252
  735    HG   SER  88           HG       SER  88  16.074 -23.028 -21.483
  736    HB2  SER  88           HB2      SER  88  13.953 -23.617 -20.824
  737    HB3  SER  88           HB3      SER  88  14.056 -23.274 -22.555
  738    H    ASP  89           H        ASP  89  11.511 -22.871 -19.647
  739    HA   ASP  89           HA       ASP  89   9.520 -23.932 -21.438
  740    HB2  ASP  89           HB2      ASP  89   9.958 -24.935 -19.248
  741    HB3  ASP  89           HB3      ASP  89   9.415 -23.469 -18.435
  742    H    ILE  90           H        ILE  90   9.422 -21.171 -19.129
  743    HA   ILE  90           HA       ILE  90   6.941 -20.174 -20.136
  744    HB   ILE  90           HB       ILE  90   7.433 -18.063 -19.064
  745   HG12  ILE  90          HG12      ILE  90  10.214 -19.127 -18.415
  746   HG13  ILE  90          HG13      ILE  90   9.847 -17.842 -19.563
  747   HG21  ILE  90          HG21      ILE  90   7.445 -18.888 -16.787
  748   HG22  ILE  90          HG22      ILE  90   6.569 -20.028 -17.809
  749   HG23  ILE  90          HG23      ILE  90   8.223 -20.402 -17.287
  750   HD11  ILE  90          HD11      ILE  90  10.606 -16.845 -17.522
  751   HD12  ILE  90          HD12      ILE  90   8.887 -16.463 -17.739
  752   HD13  ILE  90          HD13      ILE  90   9.391 -17.703 -16.567
  753    H    VAL  91           H        VAL  91  10.295 -19.656 -21.263
  754    HA   VAL  91           HA       VAL  91   9.652 -17.529 -23.035
  755    HB   VAL  91           HB       VAL  91  11.868 -19.596 -23.313
  756   HG11  VAL  91          HG11      VAL  91  11.605 -16.784 -24.468
  757   HG12  VAL  91          HG12      VAL  91  13.045 -17.819 -24.580
  758   HG13  VAL  91          HG13      VAL  91  11.551 -18.301 -25.390
  759   HG21  VAL  91          HG21      VAL  91  11.996 -18.459 -21.112
  760   HG22  VAL  91          HG22      VAL  91  13.283 -17.895 -22.176
  761   HG23  VAL  91          HG23      VAL  91  11.850 -16.881 -21.910
  762    H    ALA  92           H        ALA  92   9.787 -21.122 -23.614
  763    HA   ALA  92           HA       ALA  92   8.950 -20.976 -26.320
  764    HB1  ALA  92           HB1      ALA  92   9.966 -22.978 -25.257
  765    HB2  ALA  92           HB2      ALA  92   8.486 -23.212 -24.294
  766    HB3  ALA  92           HB3      ALA  92   8.437 -23.351 -26.067
  767    H    LYS  93           H        LYS  93   7.058 -21.097 -23.266
  768    HA   LYS  93           HA       LYS  93   4.512 -21.410 -24.474
  769    HB2  LYS  93           HB2      LYS  93   5.053 -21.668 -22.042
  770    HB3  LYS  93           HB3      LYS  93   5.161 -19.907 -21.902
  771    HG2  LYS  93           HG2      LYS  93   2.796 -19.702 -22.619
  772    HG3  LYS  93           HG3      LYS  93   2.696 -21.466 -22.799
  773    HD2  LYS  93           HD2      LYS  93   3.237 -21.723 -20.378
  774    HD3  LYS  93           HD3      LYS  93   3.259 -19.967 -20.191
  775    HE2  LYS  93           HE2      LYS  93   0.859 -21.620 -21.116
  776    HE3  LYS  93           HE3      LYS  93   1.127 -21.081 -19.459
  777    HZ1  LYS  93           HZ1      LYS  93  -0.365 -19.599 -20.598
  778    HZ2  LYS  93           HZ2      LYS  93   0.999 -18.786 -20.244
  779    HZ3  LYS  93           HZ3      LYS  93   0.709 -19.285 -21.778
  780    H    ILE  94           H        ILE  94   6.196 -18.304 -23.542
  781    HA   ILE  94           HA       ILE  94   4.050 -16.789 -24.735
  782    HB   ILE  94           HB       ILE  94   5.341 -14.814 -24.315
  783   HG12  ILE  94          HG12      ILE  94   7.670 -16.615 -23.557
  784   HG13  ILE  94          HG13      ILE  94   7.592 -15.549 -24.957
  785   HG21  ILE  94          HG21      ILE  94   4.079 -15.992 -22.491
  786   HG22  ILE  94          HG22      ILE  94   5.610 -16.704 -21.940
  787   HG23  ILE  94          HG23      ILE  94   5.372 -14.947 -21.909
  788   HD11  ILE  94          HD11      ILE  94   7.683 -14.699 -22.040
  789   HD12  ILE  94          HD12      ILE  94   8.934 -14.494 -23.274
  790   HD13  ILE  94          HD13      ILE  94   7.413 -13.587 -23.407
  791    H    LYS  95           H        LYS  95   7.136 -17.985 -26.000
  792    HA   LYS  95           HA       LYS  95   7.114 -16.453 -28.409
  793    HB2  LYS  95           HB2      LYS  95   9.096 -17.632 -27.482
  794    HB3  LYS  95           HB3      LYS  95   8.320 -19.186 -27.791
  795    HG2  LYS  95           HG2      LYS  95  10.011 -18.734 -29.456
  796    HG3  LYS  95           HG3      LYS  95   8.428 -18.770 -30.225
  797    HD2  LYS  95           HD2      LYS  95   8.384 -16.293 -30.298
  798    HD3  LYS  95           HD3      LYS  95   9.942 -16.237 -29.440
  799    HE2  LYS  95           HE2      LYS  95  11.001 -17.487 -31.310
  800    HE3  LYS  95           HE3      LYS  95   9.450 -17.543 -32.157
  801    HZ1  LYS  95           HZ1      LYS  95  10.840 -15.751 -32.974
  802    HZ2  LYS  95           HZ2      LYS  95   9.507 -15.119 -32.286
  803    HZ3  LYS  95           HZ3      LYS  95  10.942 -15.068 -31.500
  804    H    GLY  96           H        GLY  96   5.455 -19.468 -27.477
  805    HA2  GLY  96           HA2      GLY  96   3.630 -20.442 -28.542
  806    HA3  GLY  96           HA3      GLY  96   3.847 -19.390 -29.954
  807    H    THR  97           H        THR  97   6.208 -21.462 -28.196
  808    HA   THR  97           HA       THR  97   6.375 -23.329 -30.501
  809    HB   THR  97           HB       THR  97   8.883 -23.401 -29.919
  810    HG1  THR  97           HG1      THR  97   9.704 -21.635 -28.895
  811   HG21  THR  97          HG21      THR  97   9.417 -21.491 -31.361
  812   HG22  THR  97          HG22      THR  97   8.024 -22.381 -31.996
  813   HG23  THR  97          HG23      THR  97   7.777 -20.841 -31.152
  814    H    PHE  98           H        PHE  98   5.458 -23.043 -27.355
  815    HA   PHE  98           HA       PHE  98   6.785 -25.161 -25.983
  816    HD1  PHE  98           HD2      PHE  98   6.378 -25.366 -23.162
  817    HD2  PHE  98           HD1      PHE  98   2.474 -25.370 -25.006
  818    HE1  PHE  98           HE2      PHE  98   5.576 -27.006 -21.480
  819    HE2  PHE  98           HE1      PHE  98   1.681 -27.006 -23.320
  820    HZ   PHE  98           HZ       PHE  98   3.231 -27.829 -21.554
  821    HB2  PHE  98           HB2      PHE  98   5.578 -23.515 -24.750
  822    HB3  PHE  98           HB3      PHE  98   4.107 -23.767 -25.682
  823    H    LYS  99           H        LYS  99   3.838 -25.082 -27.985
  824    HA   LYS  99           HA       LYS  99   4.137 -27.884 -28.658
  825    HB2  LYS  99           HB2      LYS  99   2.798 -27.800 -26.427
  826    HB3  LYS  99           HB3      LYS  99   1.462 -27.183 -27.375
  827    HG2  LYS  99           HG2      LYS  99   2.938 -29.836 -27.800
  828    HG3  LYS  99           HG3      LYS  99   1.427 -29.622 -26.942
  829    HD2  LYS  99           HD2      LYS  99   0.728 -30.482 -28.927
  830    HD3  LYS  99           HD3      LYS  99   0.425 -28.764 -29.158
  831    HE2  LYS  99           HE2      LYS  99   2.422 -28.584 -30.612
  832    HE3  LYS  99           HE3      LYS  99   2.917 -30.224 -30.176
  833    HZ1  LYS  99           HZ1      LYS  99   1.834 -30.153 -32.331
  834    HZ2  LYS  99           HZ2      LYS  99   0.941 -31.048 -31.310
  835    HZ3  LYS  99           HZ3      LYS  99   0.467 -29.532 -31.695
  836    H    GLU 100           H        GLU 100   4.660 -26.323 -30.415
  837    HA   GLU 100           HA       GLU 100   2.356 -25.883 -32.184
  838    HB2  GLU 100           HB2      GLU 100   4.294 -23.745 -31.222
  839    HB3  GLU 100           HB3      GLU 100   3.373 -23.612 -32.715
  840    HG2  GLU 100           HG2      GLU 100   2.129 -22.327 -31.294
  841    HG3  GLU 100           HG3      GLU 100   1.252 -23.847 -31.324
  842    H    ARG 101           H        ARG 101   3.263 -25.436 -34.432
  843    HA   ARG 101           HA       ARG 101   5.459 -27.199 -35.031
  844    HE   ARG 101           HE       ARG 101   1.356 -25.891 -37.808
  845    HB2  ARG 101           HB2      ARG 101   3.954 -25.113 -36.689
  846    HB3  ARG 101           HB3      ARG 101   5.267 -26.066 -37.360
  847    HG2  ARG 101           HG2      ARG 101   4.064 -28.172 -36.740
  848    HG3  ARG 101           HG3      ARG 101   2.703 -27.214 -36.146
  849    HD2  ARG 101           HD2      ARG 101   3.767 -27.227 -38.998
  850    HD3  ARG 101           HD3      ARG 101   2.347 -28.108 -38.437
  851   HH11  ARG 101          HH11      ARG 101   3.665 -26.091 -40.547
  852   HH12  ARG 101          HH12      ARG 101   3.057 -24.603 -41.247
  853   HH21  ARG 101          HH21      ARG 101   0.613 -23.956 -38.897
  854   HH22  ARG 101          HH22      ARG 101   1.440 -23.464 -40.363
  855    HA   PRO 102           HA       PRO 102   8.804 -24.191 -34.699
  856    HB2  PRO 102           HB2      PRO 102  10.734 -25.352 -36.240
  857    HB3  PRO 102           HB3      PRO 102  10.213 -26.051 -34.678
  858    HG2  PRO 102           HG2      PRO 102   9.283 -26.827 -37.462
  859    HG3  PRO 102           HG3      PRO 102   9.859 -27.903 -36.149
  860    HD2  PRO 102           HD2      PRO 102   7.202 -27.430 -36.610
  861    HD3  PRO 102           HD3      PRO 102   7.843 -27.682 -34.960
  862    H    LYS 103           H        LYS 103   6.819 -24.669 -37.339
  863    HA   LYS 103           HA       LYS 103   7.903 -22.436 -38.937
  864    HB2  LYS 103           HB2      LYS 103   7.003 -25.155 -40.016
  865    HB3  LYS 103           HB3      LYS 103   7.315 -23.723 -41.003
  866    HG2  LYS 103           HG2      LYS 103   9.686 -23.705 -40.262
  867    HG3  LYS 103           HG3      LYS 103   9.389 -25.145 -39.283
  868    HD2  LYS 103           HD2      LYS 103  10.454 -25.834 -41.304
  869    HD3  LYS 103           HD3      LYS 103   8.785 -26.420 -41.329
  870    HE2  LYS 103           HE2      LYS 103   8.146 -24.541 -42.827
  871    HE3  LYS 103           HE3      LYS 103   9.798 -23.912 -42.753
  872    HZ1  LYS 103           HZ1      LYS 103   9.024 -26.532 -43.903
  873    HZ2  LYS 103           HZ2      LYS 103   9.427 -25.205 -44.755
  874    HZ3  LYS 103           HZ3      LYS 103  10.549 -25.947 -43.840
  875    H    LYS 104           H        LYS 104   5.905 -22.304 -40.767
  876    HA   LYS 104           HA       LYS 104   3.310 -22.326 -39.421
  877    HB2  LYS 104           HB2      LYS 104   4.306 -20.139 -38.786
  878    HB3  LYS 104           HB3      LYS 104   4.563 -19.758 -40.498
  879    HG2  LYS 104           HG2      LYS 104   2.116 -19.875 -40.892
  880    HG3  LYS 104           HG3      LYS 104   1.857 -20.300 -39.187
  881    HD2  LYS 104           HD2      LYS 104   2.864 -18.136 -38.502
  882    HD3  LYS 104           HD3      LYS 104   3.095 -17.688 -40.195
  883    HE2  LYS 104           HE2      LYS 104   0.400 -18.287 -38.879
  884    HE3  LYS 104           HE3      LYS 104   1.074 -16.670 -39.092
  885    HZ1  LYS 104           HZ1      LYS 104   1.013 -17.019 -41.491
  886    HZ2  LYS 104           HZ2      LYS 104   0.356 -18.507 -41.301
  887    HZ3  LYS 104           HZ3      LYS 104  -0.471 -17.182 -40.847
  Start of MODEL   10
    1    HA   MET   1           HA       MET   1   2.926 -12.968   2.649
    2    H1   MET   1           H1       MET   1   3.146 -11.526   4.572
    3    H2   MET   1           H2       MET   1   3.314 -13.099   4.997
    4    H3   MET   1           H3       MET   1   4.635 -12.148   4.896
    5    HB2  MET   1           HB2      MET   1   5.453 -11.246   2.671
    6    HB3  MET   1           HB3      MET   1   4.782 -12.008   1.230
    7    HG2  MET   1           HG2      MET   1   2.657 -10.773   1.548
    8    HG3  MET   1           HG3      MET   1   3.367  -9.931   2.933
    9    HE1  MET   1           HE1      MET   1   2.697  -7.612   1.842
   10    HE2  MET   1           HE2      MET   1   3.140  -7.134   0.188
   11    HE3  MET   1           HE3      MET   1   1.997  -8.469   0.449
   12    H    GLU   2           H        GLU   2   3.686 -14.731   1.418
   13    HA   GLU   2           HA       GLU   2   6.339 -15.799   1.881
   14    HB2  GLU   2           HB2      GLU   2   4.921 -16.883   3.664
   15    HB3  GLU   2           HB3      GLU   2   3.876 -17.547   2.411
   16    HG2  GLU   2           HG2      GLU   2   5.568 -18.998   1.597
   17    HG3  GLU   2           HG3      GLU   2   6.866 -18.046   2.311
   18    H    MET   3           H        MET   3   7.026 -16.845  -0.008
   19    HA   MET   3           HA       MET   3   5.125 -17.077  -2.285
   20    HB2  MET   3           HB2      MET   3   7.832 -15.655  -2.184
   21    HB3  MET   3           HB3      MET   3   7.008 -16.113  -3.662
   22    HG2  MET   3           HG2      MET   3   6.551 -13.832  -3.373
   23    HG3  MET   3           HG3      MET   3   5.070 -14.694  -3.039
   24    HE1  MET   3           HE1      MET   3   8.064 -12.551  -1.337
   25    HE2  MET   3           HE2      MET   3   7.573 -12.678   0.361
   26    HE3  MET   3           HE3      MET   3   8.133 -14.125  -0.501
   27    H    LEU   4           H        LEU   4   5.596 -18.876  -3.606
   28    HA   LEU   4           HA       LEU   4   7.046 -20.936  -2.186
   29    HG   LEU   4           HG       LEU   4   3.951 -20.613  -3.214
   30    HB2  LEU   4           HB2      LEU   4   5.666 -21.033  -4.897
   31    HB3  LEU   4           HB3      LEU   4   6.267 -22.420  -4.004
   32   HD11  LEU   4          HD11      LEU   4   4.075 -23.588  -3.883
   33   HD12  LEU   4          HD12      LEU   4   2.617 -22.644  -3.497
   34   HD13  LEU   4          HD13      LEU   4   3.520 -22.308  -4.981
   35   HD21  LEU   4          HD21      LEU   4   5.190 -22.921  -1.645
   36   HD22  LEU   4          HD22      LEU   4   5.074 -21.219  -1.135
   37   HD23  LEU   4          HD23      LEU   4   3.609 -22.184  -1.296
   38    HA   PRO   5           HA       PRO   5  10.903 -20.948  -4.500
   39    HB2  PRO   5           HB2      PRO   5  10.561 -23.940  -4.536
   40    HB3  PRO   5           HB3      PRO   5  11.997 -22.970  -4.091
   41    HG2  PRO   5           HG2      PRO   5  10.454 -24.093  -2.167
   42    HG3  PRO   5           HG3      PRO   5  11.091 -22.428  -1.974
   43    HD2  PRO   5           HD2      PRO   5   8.321 -23.285  -2.843
   44    HD3  PRO   5           HD3      PRO   5   8.809 -21.999  -1.695
   45    H    ASN   6           H        ASN   6  11.345 -20.703  -6.557
   46    HA   ASN   6           HA       ASN   6  10.635 -22.542  -8.638
   47    HB2  ASN   6           HB2      ASN   6   8.560 -21.092  -8.649
   48    HB3  ASN   6           HB3      ASN   6   9.599 -19.665  -8.791
   49   HD21  ASN   6          HD22      ASN   6   9.752 -18.930 -10.900
   50   HD22  ASN   6          HD21      ASN   6   9.612 -19.971 -12.312
   51    H    GLN   7           H        GLN   7  12.207 -22.065 -10.450
   52    HA   GLN   7           HA       GLN   7  14.567 -20.840  -9.399
   53    HB2  GLN   7           HB2      GLN   7  14.384 -22.770 -11.073
   54    HB3  GLN   7           HB3      GLN   7  14.118 -21.539 -12.323
   55    HG2  GLN   7           HG2      GLN   7  16.305 -20.509 -11.746
   56    HG3  GLN   7           HG3      GLN   7  16.527 -21.671 -10.442
   57   HE21  GLN   7          HE22      GLN   7  18.570 -21.531 -12.023
   58   HE22  GLN   7          HE21      GLN   7  18.660 -22.863 -13.171
   59    H    THR   8           H        THR   8  11.872 -19.418 -11.001
   60    HA   THR   8           HA       THR   8  13.421 -16.973 -11.667
   61    HB   THR   8           HB       THR   8  10.973 -18.043 -13.109
   62    HG1  THR   8           HG1      THR   8  12.314 -18.983 -14.561
   63   HG21  THR   8          HG21      THR   8  11.797 -16.585 -14.964
   64   HG22  THR   8          HG22      THR   8  11.390 -15.658 -13.513
   65   HG23  THR   8          HG23      THR   8  13.079 -15.983 -13.889
   66    H    ILE   9           H        ILE   9  12.464 -15.018 -11.195
   67    HA   ILE   9           HA       ILE   9   9.893 -15.051  -9.708
   68    HB   ILE   9           HB       ILE   9  10.671 -13.582  -8.075
   69   HG12  ILE   9          HG12      ILE   9  13.138 -13.131  -9.760
   70   HG13  ILE   9          HG13      ILE   9  11.860 -11.972  -9.427
   71   HG21  ILE   9          HG21      ILE   9  11.501 -15.946  -7.801
   72   HG22  ILE   9          HG22      ILE   9  13.069 -15.435  -8.462
   73   HG23  ILE   9          HG23      ILE   9  12.491 -14.750  -6.950
   74   HD11  ILE   9          HD11      ILE   9  13.864 -12.992  -7.378
   75   HD12  ILE   9          HD12      ILE   9  13.774 -11.384  -8.104
   76   HD13  ILE   9          HD13      ILE   9  12.483 -11.941  -7.023
   77    H    TYR  10           H        TYR  10   8.840 -12.931  -9.756
   78    HA   TYR  10           HA       TYR  10   9.235 -11.440 -12.306
   79    HD1  TYR  10           HD1      TYR  10   7.830 -10.229 -13.749
   80    HD2  TYR  10           HD2      TYR  10   4.567 -11.919 -11.479
   81    HE1  TYR  10           HE1      TYR  10   6.270  -8.678 -14.851
   82    HE2  TYR  10           HE2      TYR  10   2.992 -10.379 -12.600
   83    HH   TYR  10           HH       TYR  10   4.062  -7.938 -15.012
   84    HB2  TYR  10           HB2      TYR  10   7.391 -13.014 -12.556
   85    HB3  TYR  10           HB3      TYR  10   6.751 -12.588 -10.980
   86    H    ILE  11           H        ILE  11   9.133  -9.244 -12.011
   87    HA   ILE  11           HA       ILE  11   8.828  -8.230  -9.217
   88    HB   ILE  11           HB       ILE  11  10.858  -7.604 -11.404
   89   HG12  ILE  11          HG12      ILE  11  11.264  -8.638  -8.559
   90   HG13  ILE  11          HG13      ILE  11  11.255  -9.662  -9.994
   91   HG21  ILE  11          HG21      ILE  11  10.198  -5.483 -10.299
   92   HG22  ILE  11          HG22      ILE  11  10.550  -6.197  -8.712
   93   HG23  ILE  11          HG23      ILE  11  11.840  -5.923  -9.913
   94   HD11  ILE  11          HD11      ILE  11  13.223  -8.410 -10.887
   95   HD12  ILE  11          HD12      ILE  11  13.317  -7.536  -9.336
   96   HD13  ILE  11          HD13      ILE  11  13.525  -9.291  -9.377
   97    H    ASN  12           H        ASN  12   7.809  -6.248  -9.019
   98    HA   ASN  12           HA       ASN  12   6.801  -4.769 -11.345
   99    HB2  ASN  12           HB2      ASN  12   5.171  -6.678  -9.805
  100    HB3  ASN  12           HB3      ASN  12   4.585  -5.048  -9.542
  101   HD21  ASN  12          HD22      ASN  12   5.883  -6.945 -12.349
  102   HD22  ASN  12          HD21      ASN  12   4.611  -6.475 -13.452
  103    H    ASN  13           H        ASN  13   5.590  -2.799 -10.451
  104    HA   ASN  13           HA       ASN  13   5.922  -0.784  -9.561
  105    HB2  ASN  13           HB2      ASN  13   4.749  -1.966  -7.647
  106    HB3  ASN  13           HB3      ASN  13   6.334  -2.141  -6.884
  107   HD21  ASN  13          HD22      ASN  13   6.549  -0.571  -5.277
  108   HD22  ASN  13          HD21      ASN  13   5.867   1.039  -5.377
  109    H    LEU  14           H        LEU  14   8.210  -2.098 -10.675
  110    HA   LEU  14           HA       LEU  14  10.621  -1.266  -9.233
  111    HG   LEU  14           HG       LEU  14  12.375  -2.882 -10.196
  112    HB2  LEU  14           HB2      LEU  14  10.103  -3.092 -11.154
  113    HB3  LEU  14           HB3      LEU  14  10.400  -1.728 -12.210
  114   HD11  LEU  14          HD11      LEU  14  11.672  -4.348 -12.153
  115   HD12  LEU  14          HD12      LEU  14  12.452  -3.148 -13.205
  116   HD13  LEU  14          HD13      LEU  14  13.378  -4.022 -11.952
  117   HD21  LEU  14          HD21      LEU  14  12.992  -0.579 -10.547
  118   HD22  LEU  14          HD22      LEU  14  14.079  -1.586 -11.498
  119   HD23  LEU  14          HD23      LEU  14  12.752  -0.726 -12.306
  120    H    ASN  15           H        ASN  15  11.714   0.817  -9.801
  121    HA   ASN  15           HA       ASN  15   9.867   2.906 -10.575
  122    HB2  ASN  15           HB2      ASN  15  11.759   3.283  -9.019
  123    HB3  ASN  15           HB3      ASN  15  12.894   3.099 -10.361
  124   HD21  ASN  15          HD22      ASN  15  11.850   5.491  -8.539
  125   HD22  ASN  15          HD21      ASN  15  11.540   6.740  -9.714
  126    H    GLU  16           H        GLU  16   9.149   3.201 -12.555
  127    HA   GLU  16           HA       GLU  16  10.070   1.785 -14.762
  128    HB2  GLU  16           HB2      GLU  16   8.407   3.030 -16.034
  129    HB3  GLU  16           HB3      GLU  16   7.772   2.543 -14.465
  130    HG2  GLU  16           HG2      GLU  16   8.175   4.845 -13.587
  131    HG3  GLU  16           HG3      GLU  16   8.816   5.329 -15.157
  132    H    LYS  17           H        LYS  17  11.539   4.724 -13.590
  133    HA   LYS  17           HA       LYS  17  12.405   5.646 -16.168
  134    HB2  LYS  17           HB2      LYS  17  13.758   7.163 -15.110
  135    HB3  LYS  17           HB3      LYS  17  12.347   6.995 -14.071
  136    HG2  LYS  17           HG2      LYS  17  13.780   5.385 -12.636
  137    HG3  LYS  17           HG3      LYS  17  15.159   5.886 -13.634
  138    HD2  LYS  17           HD2      LYS  17  14.731   8.241 -13.070
  139    HD3  LYS  17           HD3      LYS  17  13.350   7.756 -12.062
  140    HE2  LYS  17           HE2      LYS  17  14.856   6.437 -10.599
  141    HE3  LYS  17           HE3      LYS  17  16.239   6.857 -11.618
  142    HZ1  LYS  17           HZ1      LYS  17  14.634   8.802 -10.056
  143    HZ2  LYS  17           HZ2      LYS  17  16.124   8.268  -9.663
  144    HZ3  LYS  17           HZ3      LYS  17  15.918   9.178 -10.996
  145    H    ILE  18           H        ILE  18  13.575   3.180 -13.955
  146    HA   ILE  18           HA       ILE  18  16.299   3.141 -14.613
  147    HB   ILE  18           HB       ILE  18  14.473   0.926 -13.604
  148   HG12  ILE  18          HG12      ILE  18  14.381   2.848 -12.110
  149   HG13  ILE  18          HG13      ILE  18  15.241   1.525 -11.355
  150   HG21  ILE  18          HG21      ILE  18  16.578  -0.028 -14.395
  151   HG22  ILE  18          HG22      ILE  18  17.500   1.097 -13.381
  152   HG23  ILE  18          HG23      ILE  18  16.459  -0.128 -12.635
  153   HD11  ILE  18          HD11      ILE  18  17.399   2.697 -11.785
  154   HD12  ILE  18          HD12      ILE  18  16.516   4.016 -12.588
  155   HD13  ILE  18          HD13      ILE  18  16.268   3.702 -10.868
  156    H    LYS  19           H        LYS  19  17.236   2.817 -16.509
  157    HA   LYS  19           HA       LYS  19  15.903   1.601 -18.758
  158    HB2  LYS  19           HB2      LYS  19  17.672   3.435 -18.730
  159    HB3  LYS  19           HB3      LYS  19  18.874   2.199 -18.358
  160    HG2  LYS  19           HG2      LYS  19  18.460   1.111 -20.528
  161    HG3  LYS  19           HG3      LYS  19  17.121   2.231 -20.858
  162    HD2  LYS  19           HD2      LYS  19  18.712   4.136 -20.808
  163    HD3  LYS  19           HD3      LYS  19  20.048   3.013 -20.475
  164    HE2  LYS  19           HE2      LYS  19  19.624   1.865 -22.634
  165    HE3  LYS  19           HE3      LYS  19  18.272   2.960 -22.960
  166    HZ1  LYS  19           HZ1      LYS  19  19.858   4.802 -22.987
  167    HZ2  LYS  19           HZ2      LYS  19  21.107   3.790 -22.690
  168    HZ3  LYS  19           HZ3      LYS  19  20.281   3.681 -24.089
  169    H    LYS  20           H        LYS  20  16.833  -0.325 -19.938
  170    HA   LYS  20           HA       LYS  20  16.708  -2.641 -18.385
  171    HB2  LYS  20           HB2      LYS  20  16.348  -2.388 -20.863
  172    HB3  LYS  20           HB3      LYS  20  18.095  -2.347 -21.099
  173    HG2  LYS  20           HG2      LYS  20  16.818  -4.664 -19.610
  174    HG3  LYS  20           HG3      LYS  20  16.660  -4.552 -21.366
  175    HD2  LYS  20           HD2      LYS  20  19.091  -4.585 -21.661
  176    HD3  LYS  20           HD3      LYS  20  19.332  -4.619 -19.915
  177    HE2  LYS  20           HE2      LYS  20  19.621  -6.844 -20.797
  178    HE3  LYS  20           HE3      LYS  20  18.207  -6.798 -19.745
  179    HZ1  LYS  20           HZ1      LYS  20  16.791  -6.820 -21.685
  180    HZ2  LYS  20           HZ2      LYS  20  18.078  -6.690 -22.710
  181    HZ3  LYS  20           HZ3      LYS  20  17.864  -8.040 -21.829
  182    H    GLU  21           H        GLU  21  19.638  -0.966 -19.605
  183    HA   GLU  21           HA       GLU  21  21.530  -2.803 -18.557
  184    HB2  GLU  21           HB2      GLU  21  22.076  -1.207 -20.269
  185    HB3  GLU  21           HB3      GLU  21  21.649   0.163 -19.236
  186    HG2  GLU  21           HG2      GLU  21  23.532  -0.262 -17.758
  187    HG3  GLU  21           HG3      GLU  21  23.916  -1.771 -18.602
  188    H    GLU  22           H        GLU  22  19.970   0.086 -17.097
  189    HA   GLU  22           HA       GLU  22  21.613   0.089 -14.747
  190    HB2  GLU  22           HB2      GLU  22  18.858   1.267 -15.261
  191    HB3  GLU  22           HB3      GLU  22  19.867   1.619 -13.850
  192    HG2  GLU  22           HG2      GLU  22  21.614   2.561 -15.310
  193    HG3  GLU  22           HG3      GLU  22  20.647   2.212 -16.741
  194    H    LEU  23           H        LEU  23  18.425  -1.292 -15.552
  195    HA   LEU  23           HA       LEU  23  17.801  -2.492 -13.049
  196    HG   LEU  23           HG       LEU  23  15.183  -4.379 -15.283
  197    HB2  LEU  23           HB2      LEU  23  16.091  -2.318 -14.632
  198    HB3  LEU  23           HB3      LEU  23  17.052  -2.973 -15.947
  199   HD11  LEU  23          HD11      LEU  23  17.690  -5.927 -14.633
  200   HD12  LEU  23          HD12      LEU  23  16.182  -6.501 -15.326
  201   HD13  LEU  23          HD13      LEU  23  17.241  -5.429 -16.268
  202   HD21  LEU  23          HD21      LEU  23  15.064  -5.482 -13.142
  203   HD22  LEU  23          HD22      LEU  23  16.647  -4.833 -12.659
  204   HD23  LEU  23          HD23      LEU  23  15.289  -3.734 -12.863
  205    H    LYS  24           H        LYS  24  19.627  -3.776 -15.887
  206    HA   LYS  24           HA       LYS  24  20.186  -6.294 -14.754
  207    HB2  LYS  24           HB2      LYS  24  20.465  -5.588 -17.161
  208    HB3  LYS  24           HB3      LYS  24  21.942  -4.731 -16.701
  209    HG2  LYS  24           HG2      LYS  24  22.924  -6.902 -15.916
  210    HG3  LYS  24           HG3      LYS  24  21.413  -7.711 -16.341
  211    HD2  LYS  24           HD2      LYS  24  22.981  -8.137 -18.110
  212    HD3  LYS  24           HD3      LYS  24  21.719  -7.075 -18.714
  213    HE2  LYS  24           HE2      LYS  24  23.772  -6.269 -19.602
  214    HE3  LYS  24           HE3      LYS  24  23.270  -5.105 -18.379
  215    HZ1  LYS  24           HZ1      LYS  24  24.891  -6.136 -16.860
  216    HZ2  LYS  24           HZ2      LYS  24  25.322  -7.219 -18.008
  217    HZ3  LYS  24           HZ3      LYS  24  25.628  -5.639 -18.225
  218    H    LYS  25           H        LYS  25  22.170  -3.274 -14.645
  219    HA   LYS  25           HA       LYS  25  24.246  -4.383 -13.032
  220    HB2  LYS  25           HB2      LYS  25  23.230  -1.514 -13.295
  221    HB3  LYS  25           HB3      LYS  25  24.594  -1.987 -12.284
  222    HG2  LYS  25           HG2      LYS  25  25.630  -3.052 -14.398
  223    HG3  LYS  25           HG3      LYS  25  24.371  -2.209 -15.308
  224    HD2  LYS  25           HD2      LYS  25  26.346  -0.861 -15.373
  225    HD3  LYS  25           HD3      LYS  25  25.183  -0.036 -14.321
  226    HE2  LYS  25           HE2      LYS  25  26.367  -0.954 -12.316
  227    HE3  LYS  25           HE3      LYS  25  27.482  -1.823 -13.367
  228    HZ1  LYS  25           HZ1      LYS  25  28.270   0.321 -14.197
  229    HZ2  LYS  25           HZ2      LYS  25  27.230   1.129 -13.227
  230    HZ3  LYS  25           HZ3      LYS  25  28.436   0.247 -12.579
  231    H    SER  26           H        SER  26  21.191  -2.721 -12.044
  232    HA   SER  26           HA       SER  26  21.830  -2.699  -9.289
  233    HG   SER  26           HG       SER  26  20.226  -1.112 -11.482
  234    HB2  SER  26           HB2      SER  26  19.073  -2.774 -10.574
  235    HB3  SER  26           HB3      SER  26  19.483  -2.176  -8.950
  236    H    LEU  27           H        LEU  27  20.076  -5.106 -11.244
  237    HA   LEU  27           HA       LEU  27  19.397  -6.887  -9.109
  238    HG   LEU  27           HG       LEU  27  17.619  -6.249 -11.325
  239    HB2  LEU  27           HB2      LEU  27  19.815  -7.188 -12.099
  240    HB3  LEU  27           HB3      LEU  27  19.523  -8.597 -11.101
  241   HD11  LEU  27          HD11      LEU  27  17.864  -7.662 -13.372
  242   HD12  LEU  27          HD12      LEU  27  17.428  -9.088 -12.426
  243   HD13  LEU  27          HD13      LEU  27  16.245  -7.779 -12.664
  244   HD21  LEU  27          HD21      LEU  27  16.000  -7.885 -10.272
  245   HD22  LEU  27          HD22      LEU  27  17.396  -8.922  -9.894
  246   HD23  LEU  27          HD23      LEU  27  17.254  -7.285  -9.198
  247    H    TYR  28           H        TYR  28  22.241  -6.882 -11.363
  248    HA   TYR  28           HA       TYR  28  23.518  -9.091 -10.121
  249    HD1  TYR  28           HD1      TYR  28  25.186 -10.407 -11.936
  250    HD2  TYR  28           HD2      TYR  28  26.977  -6.674 -10.711
  251    HE1  TYR  28           HE1      TYR  28  27.383 -11.535 -11.721
  252    HE2  TYR  28           HE2      TYR  28  29.172  -7.789 -10.495
  253    HH   TYR  28           HH       TYR  28  30.355  -9.788 -10.692
  254    HB2  TYR  28           HB2      TYR  28  24.081  -8.161 -12.349
  255    HB3  TYR  28           HB3      TYR  28  24.728  -6.712 -11.591
  256    H    ALA  29           H        ALA  29  23.630  -5.593  -9.375
  257    HA   ALA  29           HA       ALA  29  25.743  -5.704  -7.506
  258    HB1  ALA  29           HB1      ALA  29  25.042  -3.629  -8.581
  259    HB2  ALA  29           HB2      ALA  29  23.465  -3.700  -7.760
  260    HB3  ALA  29           HB3      ALA  29  24.951  -3.470  -6.819
  261    H    ILE  30           H        ILE  30  22.188  -6.147  -7.063
  262    HA   ILE  30           HA       ILE  30  22.710  -6.507  -4.131
  263    HB   ILE  30           HB       ILE  30  20.142  -5.529  -5.394
  264   HG12  ILE  30          HG12      ILE  30  22.432  -3.892  -4.189
  265   HG13  ILE  30          HG13      ILE  30  21.928  -3.875  -5.878
  266   HG21  ILE  30          HG21      ILE  30  21.157  -5.444  -2.526
  267   HG22  ILE  30          HG22      ILE  30  19.587  -4.840  -3.098
  268   HG23  ILE  30          HG23      ILE  30  19.925  -6.558  -3.163
  269   HD11  ILE  30          HD11      ILE  30  20.348  -2.771  -3.541
  270   HD12  ILE  30          HD12      ILE  30  21.102  -1.893  -4.876
  271   HD13  ILE  30          HD13      ILE  30  19.715  -2.945  -5.200
  272    H    PHE  31           H        PHE  31  20.452  -7.709  -6.755
  273    HA   PHE  31           HA       PHE  31  19.246  -9.581  -4.928
  274    HD1  PHE  31           HD1      PHE  31  18.154  -6.933  -6.730
  275    HD2  PHE  31           HD2      PHE  31  16.319 -10.834  -6.577
  276    HE1  PHE  31           HE1      PHE  31  15.935  -5.891  -6.403
  277    HE2  PHE  31           HE2      PHE  31  14.110  -9.784  -6.248
  278    HZ   PHE  31           HZ       PHE  31  13.902  -7.309  -6.178
  279    HB2  PHE  31           HB2      PHE  31  19.141  -9.151  -7.903
  280    HB3  PHE  31           HB3      PHE  31  18.556 -10.659  -7.236
  281    H    SER  32           H        SER  32  22.005  -9.909  -7.267
  282    HA   SER  32           HA       SER  32  22.320 -12.689  -6.883
  283    HG   SER  32           HG       SER  32  24.145 -11.390  -9.520
  284    HB2  SER  32           HB2      SER  32  24.380 -10.532  -7.435
  285    HB3  SER  32           HB3      SER  32  24.741 -12.269  -7.444
  286    H    GLN  33           H        GLN  33  23.225 -10.012  -4.680
  287    HA   GLN  33           HA       GLN  33  24.964 -11.598  -3.022
  288    HB2  GLN  33           HB2      GLN  33  23.346  -9.150  -2.209
  289    HB3  GLN  33           HB3      GLN  33  24.760  -9.814  -1.402
  290    HG2  GLN  33           HG2      GLN  33  26.127  -9.329  -3.441
  291    HG3  GLN  33           HG3      GLN  33  24.733  -8.522  -4.163
  292   HE21  GLN  33          HE22      GLN  33  27.513  -7.561  -3.118
  293   HE22  GLN  33          HE21      GLN  33  27.113  -6.189  -2.117
  294    H    PHE  34           H        PHE  34  21.555 -11.658  -3.499
  295    HA   PHE  34           HA       PHE  34  21.111 -13.032  -0.901
  296    HD1  PHE  34           HD1      PHE  34  20.350 -11.731   0.974
  297    HD2  PHE  34           HD2      PHE  34  19.662  -9.037  -2.343
  298    HE1  PHE  34           HE1      PHE  34  20.975  -9.805   2.401
  299    HE2  PHE  34           HE2      PHE  34  20.265  -7.128  -0.890
  300    HZ   PHE  34           HZ       PHE  34  20.931  -7.496   1.471
  301    HB2  PHE  34           HB2      PHE  34  19.208 -11.385  -2.611
  302    HB3  PHE  34           HB3      PHE  34  18.768 -12.247  -1.142
  303    H    GLY  35           H        GLY  35  21.688 -13.906  -4.059
  304    HA2  GLY  35           HA2      GLY  35  20.691 -16.500  -3.551
  305    HA3  GLY  35           HA3      GLY  35  19.491 -15.674  -4.545
  306    H    GLN  36           H        GLN  36  22.739 -14.756  -5.283
  307    HA   GLN  36           HA       GLN  36  23.637 -14.600  -7.287
  308    HB2  GLN  36           HB2      GLN  36  24.916 -16.333  -6.189
  309    HB3  GLN  36           HB3      GLN  36  23.900 -17.586  -6.910
  310    HG2  GLN  36           HG2      GLN  36  26.077 -17.247  -8.114
  311    HG3  GLN  36           HG3      GLN  36  24.677 -17.025  -9.149
  312   HE21  GLN  36          HE22      GLN  36  24.617 -15.123 -10.389
  313   HE22  GLN  36          HE21      GLN  36  25.567 -13.697 -10.042
  314    H    ILE  37           H        ILE  37  22.577 -13.843  -8.924
  315    HA   ILE  37           HA       ILE  37  20.416 -15.044 -10.308
  316    HB   ILE  37           HB       ILE  37  22.415 -12.845 -10.914
  317   HG12  ILE  37          HG12      ILE  37  19.465 -12.885 -10.111
  318   HG13  ILE  37          HG13      ILE  37  20.798 -12.571  -9.006
  319   HG21  ILE  37          HG21      ILE  37  21.670 -13.644 -13.104
  320   HG22  ILE  37          HG22      ILE  37  19.968 -13.515 -12.585
  321   HG23  ILE  37          HG23      ILE  37  21.013 -12.082 -12.733
  322   HD11  ILE  37          HD11      ILE  37  19.793 -10.513  -9.550
  323   HD12  ILE  37          HD12      ILE  37  21.398 -10.546 -10.312
  324   HD13  ILE  37          HD13      ILE  37  19.924 -10.805 -11.285
  325    H    LEU  38           H        LEU  38  20.326 -15.902 -12.340
  326    HA   LEU  38           HA       LEU  38  22.726 -17.238 -13.471
  327    HG   LEU  38           HG       LEU  38  20.736 -20.423 -13.917
  328    HB2  LEU  38           HB2      LEU  38  21.196 -18.793 -12.349
  329    HB3  LEU  38           HB3      LEU  38  19.836 -18.205 -13.287
  330   HD11  LEU  38          HD11      LEU  38  20.481 -20.241 -16.260
  331   HD12  LEU  38          HD12      LEU  38  19.419 -19.029 -15.532
  332   HD13  LEU  38          HD13      LEU  38  20.954 -18.543 -16.284
  333   HD21  LEU  38          HD21      LEU  38  23.141 -19.954 -13.596
  334   HD22  LEU  38          HD22      LEU  38  22.787 -20.676 -15.174
  335   HD23  LEU  38          HD23      LEU  38  23.134 -18.940 -15.058
  336    H    ASP  39           H        ASP  39  19.509 -15.599 -14.091
  337    HA   ASP  39           HA       ASP  39  20.675 -14.353 -16.444
  338    HB2  ASP  39           HB2      ASP  39  19.928 -16.531 -17.396
  339    HB3  ASP  39           HB3      ASP  39  18.296 -16.219 -16.812
  340    H    ILE  40           H        ILE  40  19.057 -12.740 -17.428
  341    HA   ILE  40           HA       ILE  40  17.096 -11.701 -15.451
  342    HB   ILE  40           HB       ILE  40  19.482 -10.216 -16.649
  343   HG12  ILE  40          HG12      ILE  40  18.685 -10.647 -13.737
  344   HG13  ILE  40          HG13      ILE  40  19.924 -11.558 -14.592
  345   HG21  ILE  40          HG21      ILE  40  17.533  -8.737 -16.790
  346   HG22  ILE  40          HG22      ILE  40  17.119  -9.077 -15.095
  347   HG23  ILE  40          HG23      ILE  40  18.596  -8.176 -15.529
  348   HD11  ILE  40          HD11      ILE  40  20.982  -9.899 -13.185
  349   HD12  ILE  40          HD12      ILE  40  21.282  -9.534 -14.885
  350   HD13  ILE  40          HD13      ILE  40  20.081  -8.597 -13.954
  351    H    VAL  41           H        VAL  41  15.350 -10.660 -16.485
  352    HA   VAL  41           HA       VAL  41  15.514 -10.221 -19.410
  353    HB   VAL  41           HB       VAL  41  13.214 -11.689 -18.068
  354   HG11  VAL  41          HG11      VAL  41  13.802 -11.054 -20.998
  355   HG12  VAL  41          HG12      VAL  41  12.452 -12.042 -20.406
  356   HG13  VAL  41          HG13      VAL  41  12.518 -10.326 -20.005
  357   HG21  VAL  41          HG21      VAL  41  13.910 -13.659 -19.409
  358   HG22  VAL  41          HG22      VAL  41  15.388 -12.801 -19.885
  359   HG23  VAL  41          HG23      VAL  41  15.101 -13.236 -18.185
  360    H    ALA  42           H        ALA  42  15.357  -8.093 -19.475
  361    HA   ALA  42           HA       ALA  42  12.866  -6.804 -18.744
  362    HB1  ALA  42           HB1      ALA  42  14.068  -4.824 -17.797
  363    HB2  ALA  42           HB2      ALA  42  14.271  -6.263 -16.787
  364    HB3  ALA  42           HB3      ALA  42  15.587  -5.733 -17.863
  365    H    LEU  43           H        LEU  43  13.066  -4.481 -19.909
  366    HA   LEU  43           HA       LEU  43  14.577  -4.712 -22.434
  367    HG   LEU  43           HG       LEU  43  13.358  -4.588 -24.702
  368    HB2  LEU  43           HB2      LEU  43  11.959  -5.742 -22.259
  369    HB3  LEU  43           HB3      LEU  43  11.714  -4.101 -22.843
  370   HD11  LEU  43          HD11      LEU  43  13.057  -7.446 -23.651
  371   HD12  LEU  43          HD12      LEU  43  13.780  -6.999 -25.214
  372   HD13  LEU  43          HD13      LEU  43  14.562  -6.513 -23.707
  373   HD21  LEU  43          HD21      LEU  43  10.913  -4.671 -25.027
  374   HD22  LEU  43          HD22      LEU  43  11.710  -5.920 -25.994
  375   HD23  LEU  43          HD23      LEU  43  10.880  -6.361 -24.483
  376    H    LYS  44           H        LYS  44  14.358  -2.703 -23.737
  377    HA   LYS  44           HA       LYS  44  14.694  -0.470 -21.934
  378    HB2  LYS  44           HB2      LYS  44  14.719  -0.607 -24.989
  379    HB3  LYS  44           HB3      LYS  44  15.227   0.790 -24.034
  380    HG2  LYS  44           HG2      LYS  44  17.044  -0.517 -23.004
  381    HG3  LYS  44           HG3      LYS  44  16.539  -1.965 -23.896
  382    HD2  LYS  44           HD2      LYS  44  16.956  -0.777 -26.046
  383    HD3  LYS  44           HD3      LYS  44  17.540   0.635 -25.137
  384    HE2  LYS  44           HE2      LYS  44  19.329  -0.753 -24.122
  385    HE3  LYS  44           HE3      LYS  44  18.720  -2.179 -24.971
  386    HZ1  LYS  44           HZ1      LYS  44  19.269  -1.096 -27.068
  387    HZ2  LYS  44           HZ2      LYS  44  19.828   0.231 -26.296
  388    HZ3  LYS  44           HZ3      LYS  44  20.593  -1.197 -26.128
  389    H    THR  45           H        THR  45  11.909  -1.600 -23.745
  390    HA   THR  45           HA       THR  45  10.539   0.937 -23.865
  391    HB   THR  45           HB       THR  45   8.558  -0.708 -24.138
  392    HG1  THR  45           HG1      THR  45   9.670  -2.486 -23.097
  393   HG21  THR  45          HG21      THR  45   9.231  -1.391 -26.397
  394   HG22  THR  45          HG22      THR  45   9.724   0.281 -26.083
  395   HG23  THR  45          HG23      THR  45  10.929  -1.025 -26.033
  396    H    LEU  46           H        LEU  46   9.159   1.850 -22.294
  397    HA   LEU  46           HA       LEU  46   9.737   1.406 -19.637
  398    HG   LEU  46           HG       LEU  46   6.057   2.023 -20.039
  399    HB2  LEU  46           HB2      LEU  46   8.135   2.940 -19.034
  400    HB3  LEU  46           HB3      LEU  46   8.701   3.463 -20.606
  401   HD11  LEU  46          HD11      LEU  46   5.020   4.204 -20.476
  402   HD12  LEU  46          HD12      LEU  46   6.145   4.302 -19.115
  403   HD13  LEU  46          HD13      LEU  46   6.623   4.940 -20.703
  404   HD21  LEU  46          HD21      LEU  46   7.082   3.286 -22.626
  405   HD22  LEU  46          HD22      LEU  46   6.745   1.559 -22.362
  406   HD23  LEU  46          HD23      LEU  46   5.424   2.717 -22.347
  407    H    LYS  47           H        LYS  47   7.243  -0.262 -21.480
  408    HA   LYS  47           HA       LYS  47   5.777  -1.451 -19.395
  409    HB2  LYS  47           HB2      LYS  47   5.079  -3.091 -21.042
  410    HB3  LYS  47           HB3      LYS  47   5.137  -1.492 -21.787
  411    HG2  LYS  47           HG2      LYS  47   7.386  -2.070 -22.754
  412    HG3  LYS  47           HG3      LYS  47   7.240  -3.696 -22.071
  413    HD2  LYS  47           HD2      LYS  47   5.196  -4.077 -23.428
  414    HD3  LYS  47           HD3      LYS  47   5.373  -2.452 -24.130
  415    HE2  LYS  47           HE2      LYS  47   7.631  -3.088 -24.993
  416    HE3  LYS  47           HE3      LYS  47   7.435  -4.702 -24.307
  417    HZ1  LYS  47           HZ1      LYS  47   6.879  -4.669 -26.654
  418    HZ2  LYS  47           HZ2      LYS  47   5.546  -5.039 -25.796
  419    HZ3  LYS  47           HZ3      LYS  47   5.723  -3.544 -26.433
  420    H    MET  48           H        MET  48   9.098  -2.036 -20.195
  421    HA   MET  48           HA       MET  48   9.148  -4.364 -18.346
  422    HB2  MET  48           HB2      MET  48  10.439  -3.981 -21.045
  423    HB3  MET  48           HB3      MET  48  11.122  -5.097 -19.864
  424    HG2  MET  48           HG2      MET  48   8.234  -5.509 -20.276
  425    HG3  MET  48           HG3      MET  48   9.205  -5.727 -21.725
  426    HE1  MET  48           HE1      MET  48   9.971  -8.183 -17.838
  427    HE2  MET  48           HE2      MET  48  10.458  -6.488 -18.004
  428    HE3  MET  48           HE3      MET  48   8.732  -6.919 -17.946
  429    H    ARG  49           H        ARG  49   9.574  -1.327 -18.137
  430    HA   ARG  49           HA       ARG  49  12.248  -1.472 -16.781
  431    HE   ARG  49           HE       ARG  49  12.991   1.818 -20.870
  432    HB2  ARG  49           HB2      ARG  49  10.554   0.963 -17.497
  433    HB3  ARG  49           HB3      ARG  49  12.029   0.971 -16.535
  434    HG2  ARG  49           HG2      ARG  49  13.296   0.081 -18.525
  435    HG3  ARG  49           HG3      ARG  49  11.815   0.265 -19.482
  436    HD2  ARG  49           HD2      ARG  49  11.750   2.700 -18.772
  437    HD3  ARG  49           HD3      ARG  49  13.320   2.467 -17.991
  438   HH11  ARG  49          HH21      ARG  49  14.432   4.106 -18.491
  439   HH12  ARG  49          HH22      ARG  49  15.269   4.972 -19.719
  440   HH21  ARG  49          HH12      ARG  49  14.088   2.924 -22.384
  441   HH22  ARG  49          HH11      ARG  49  15.101   4.281 -22.003
  442    H    GLY  50           H        GLY  50   8.742  -0.658 -16.437
  443    HA2  GLY  50           HA2      GLY  50   8.887  -0.257 -13.586
  444    HA3  GLY  50           HA3      GLY  50   7.430  -0.462 -14.568
  445    H    GLN  51           H        GLN  51   9.147  -3.114 -15.411
  446    HA   GLN  51           HA       GLN  51   8.732  -4.837 -13.128
  447    HB2  GLN  51           HB2      GLN  51   7.188  -6.346 -14.385
  448    HB3  GLN  51           HB3      GLN  51   6.463  -4.795 -13.932
  449    HG2  GLN  51           HG2      GLN  51   6.677  -3.975 -16.213
  450    HG3  GLN  51           HG3      GLN  51   7.524  -5.445 -16.702
  451   HE21  GLN  51          HE22      GLN  51   5.484  -4.904 -18.220
  452   HE22  GLN  51          HE21      GLN  51   4.069  -5.895 -17.867
  453    H    ALA  52           H        ALA  52   9.491  -7.094 -13.755
  454    HA   ALA  52           HA       ALA  52  11.258  -7.424 -16.016
  455    HB1  ALA  52           HB1      ALA  52  13.355  -7.459 -14.693
  456    HB2  ALA  52           HB2      ALA  52  12.636  -5.843 -14.673
  457    HB3  ALA  52           HB3      ALA  52  12.474  -6.905 -13.255
  458    H    PHE  53           H        PHE  53  12.583  -9.508 -15.595
  459    HA   PHE  53           HA       PHE  53  11.479 -11.255 -13.478
  460    HD1  PHE  53           HD1      PHE  53  10.526 -10.579 -17.476
  461    HD2  PHE  53           HD2      PHE  53   9.077 -13.238 -14.403
  462    HE1  PHE  53           HE1      PHE  53   8.198 -10.231 -18.270
  463    HE2  PHE  53           HE2      PHE  53   6.756 -12.914 -15.223
  464    HZ   PHE  53           HZ       PHE  53   6.310 -11.403 -17.148
  465    HB2  PHE  53           HB2      PHE  53  12.014 -12.210 -16.313
  466    HB3  PHE  53           HB3      PHE  53  11.433 -13.167 -14.974
  467    H    VAL  54           H        VAL  54  13.074 -12.919 -12.877
  468    HA   VAL  54           HA       VAL  54  15.700 -12.839 -14.109
  469    HB   VAL  54           HB       VAL  54  16.094 -10.935 -12.889
  470   HG11  VAL  54          HG11      VAL  54  14.111 -10.898 -11.363
  471   HG12  VAL  54          HG12      VAL  54  14.942 -12.090 -10.338
  472   HG13  VAL  54          HG13      VAL  54  15.618 -10.476 -10.558
  473   HG21  VAL  54          HG21      VAL  54  17.905 -12.502 -12.551
  474   HG22  VAL  54          HG22      VAL  54  17.701 -11.471 -11.133
  475   HG23  VAL  54          HG23      VAL  54  17.134 -13.150 -11.094
  476    H    ILE  55           H        ILE  55  16.902 -14.593 -13.629
  477    HA   ILE  55           HA       ILE  55  15.453 -16.908 -12.466
  478    HB   ILE  55           HB       ILE  55  17.461 -16.839 -14.764
  479   HG12  ILE  55          HG12      ILE  55  15.676 -17.558 -16.305
  480   HG13  ILE  55          HG13      ILE  55  14.461 -17.262 -15.088
  481   HG21  ILE  55          HG21      ILE  55  16.744 -19.190 -15.133
  482   HG22  ILE  55          HG22      ILE  55  17.420 -18.971 -13.527
  483   HG23  ILE  55          HG23      ILE  55  15.656 -19.070 -13.737
  484   HD11  ILE  55          HD11      ILE  55  14.696 -15.548 -16.936
  485   HD12  ILE  55          HD12      ILE  55  14.741 -14.866 -15.318
  486   HD13  ILE  55          HD13      ILE  55  16.254 -15.078 -16.235
  487    H    PHE  56           H        PHE  56  16.776 -18.186 -11.074
  488    HA   PHE  56           HA       PHE  56  19.445 -17.022 -10.372
  489    HD1  PHE  56           HD2      PHE  56  15.706 -16.344  -9.353
  490    HD2  PHE  56           HD1      PHE  56  19.607 -15.501  -7.739
  491    HE1  PHE  56           HE2      PHE  56  15.079 -13.967  -9.072
  492    HE2  PHE  56           HE1      PHE  56  18.945 -13.127  -7.372
  493    HZ   PHE  56           HZ       PHE  56  16.690 -12.352  -8.098
  494    HB2  PHE  56           HB2      PHE  56  17.260 -18.172  -8.619
  495    HB3  PHE  56           HB3      PHE  56  18.864 -17.764  -8.039
  496    H    LYS  57           H        LYS  57  20.724 -18.478  -8.980
  497    HA   LYS  57           HA       LYS  57  21.649 -20.732 -10.272
  498    HB2  LYS  57           HB2      LYS  57  22.895 -19.502  -8.624
  499    HB3  LYS  57           HB3      LYS  57  21.699 -19.822  -7.357
  500    HG2  LYS  57           HG2      LYS  57  22.245 -22.150  -7.299
  501    HG3  LYS  57           HG3      LYS  57  23.339 -21.998  -8.688
  502    HD2  LYS  57           HD2      LYS  57  23.727 -20.656  -5.971
  503    HD3  LYS  57           HD3      LYS  57  24.486 -22.175  -6.471
  504    HE2  LYS  57           HE2      LYS  57  25.561 -20.980  -8.394
  505    HE3  LYS  57           HE3      LYS  57  24.878 -19.459  -7.805
  506    HZ1  LYS  57           HZ1      LYS  57  26.173 -19.765  -5.756
  507    HZ2  LYS  57           HZ2      LYS  57  26.791 -21.170  -6.313
  508    HZ3  LYS  57           HZ3      LYS  57  27.164 -19.772  -7.053
  509    H    GLU  58           H        GLU  58  19.173 -20.689  -7.610
  510    HA   GLU  58           HA       GLU  58  18.276 -23.372  -8.328
  511    HB2  GLU  58           HB2      GLU  58  20.313 -23.786  -6.950
  512    HB3  GLU  58           HB3      GLU  58  19.681 -22.744  -5.682
  513    HG2  GLU  58           HG2      GLU  58  19.459 -25.099  -5.108
  514    HG3  GLU  58           HG3      GLU  58  17.883 -24.334  -5.209
  515    H    ILE  59           H        ILE  59  16.301 -23.906  -7.086
  516    HA   ILE  59           HA       ILE  59  14.579 -21.670  -6.923
  517    HB   ILE  59           HB       ILE  59  12.872 -23.190  -6.232
  518   HG12  ILE  59          HG12      ILE  59  15.056 -25.231  -5.620
  519   HG13  ILE  59          HG13      ILE  59  13.977 -24.460  -4.457
  520   HG21  ILE  59          HG21      ILE  59  13.848 -23.267  -8.592
  521   HG22  ILE  59          HG22      ILE  59  14.615 -24.791  -8.126
  522   HG23  ILE  59          HG23      ILE  59  12.845 -24.632  -8.092
  523   HD11  ILE  59          HD11      ILE  59  12.024 -25.559  -5.591
  524   HD12  ILE  59          HD12      ILE  59  13.182 -26.466  -6.594
  525   HD13  ILE  59          HD13      ILE  59  13.178 -26.678  -4.838
  526    H    GLY  60           H        GLY  60  16.419 -23.254  -4.300
  527    HA2  GLY  60           HA2      GLY  60  14.983 -21.945  -2.158
  528    HA3  GLY  60           HA3      GLY  60  16.583 -22.708  -2.064
  529    H    SER  61           H        SER  61  17.942 -21.205  -4.058
  530    HA   SER  61           HA       SER  61  18.668 -18.852  -2.611
  531    HG   SER  61           HG       SER  61  21.104 -20.659  -4.576
  532    HB2  SER  61           HB2      SER  61  19.320 -19.459  -5.516
  533    HB3  SER  61           HB3      SER  61  20.282 -18.579  -4.309
  534    H    ALA  62           H        ALA  62  16.705 -19.457  -5.562
  535    HA   ALA  62           HA       ALA  62  16.007 -16.792  -6.180
  536    HB1  ALA  62           HB1      ALA  62  15.466 -18.841  -7.577
  537    HB2  ALA  62           HB2      ALA  62  14.235 -19.270  -6.381
  538    HB3  ALA  62           HB3      ALA  62  14.077 -17.771  -7.308
  539    H    SER  63           H        SER  63  14.404 -19.158  -3.953
  540    HA   SER  63           HA       SER  63  12.305 -17.485  -3.116
  541    HG   SER  63           HG       SER  63  13.063 -20.481  -3.378
  542    HB2  SER  63           HB2      SER  63  13.748 -19.563  -1.413
  543    HB3  SER  63           HB3      SER  63  12.113 -18.937  -1.174
  544    H    ASN  64           H        ASN  64  15.603 -17.826  -1.781
  545    HA   ASN  64           HA       ASN  64  15.174 -16.064   0.415
  546    HB2  ASN  64           HB2      ASN  64  17.091 -17.651   0.251
  547    HB3  ASN  64           HB3      ASN  64  17.809 -16.629  -1.000
  548   HD21  ASN  64          HD22      ASN  64  18.898 -14.725  -0.354
  549   HD22  ASN  64          HD21      ASN  64  19.011 -14.199   1.322
  550    H    ALA  65           H        ALA  65  16.521 -15.411  -2.856
  551    HA   ALA  65           HA       ALA  65  16.936 -12.644  -2.560
  552    HB1  ALA  65           HB1      ALA  65  17.705 -14.019  -4.510
  553    HB2  ALA  65           HB2      ALA  65  16.021 -14.137  -5.076
  554    HB3  ALA  65           HB3      ALA  65  16.827 -12.561  -5.003
  555    H    LEU  66           H        LEU  66  14.070 -14.396  -3.782
  556    HA   LEU  66           HA       LEU  66  12.391 -12.254  -4.339
  557    HG   LEU  66           HG       LEU  66  10.478 -13.414  -5.635
  558    HB2  LEU  66           HB2      LEU  66  12.198 -14.820  -4.741
  559    HB3  LEU  66           HB3      LEU  66  11.440 -14.906  -3.168
  560   HD11  LEU  66          HD11      LEU  66   8.657 -15.101  -5.566
  561   HD12  LEU  66          HD12      LEU  66  10.247 -15.848  -5.759
  562   HD13  LEU  66          HD13      LEU  66   9.446 -15.887  -4.181
  563   HD21  LEU  66          HD21      LEU  66   9.712 -12.150  -3.666
  564   HD22  LEU  66          HD22      LEU  66   8.365 -13.011  -4.393
  565   HD23  LEU  66          HD23      LEU  66   9.134 -13.656  -2.919
  566    H    ARG  67           H        ARG  67  12.484 -14.187  -1.273
  567    HA   ARG  67           HA       ARG  67  10.491 -12.528  -0.087
  568    HE   ARG  67           HE       ARG  67   8.624 -14.356   3.920
  569    HB2  ARG  67           HB2      ARG  67  11.112 -14.980   0.408
  570    HB3  ARG  67           HB3      ARG  67  12.426 -14.355   1.417
  571    HG2  ARG  67           HG2      ARG  67  10.752 -13.164   2.832
  572    HG3  ARG  67           HG3      ARG  67   9.461 -13.693   1.736
  573    HD2  ARG  67           HD2      ARG  67  10.218 -16.095   2.245
  574    HD3  ARG  67           HD3      ARG  67  11.157 -15.407   3.584
  575   HH11  ARG  67          HH21      ARG  67   9.909 -17.701   3.774
  576   HH12  ARG  67          HH22      ARG  67   8.438 -18.365   4.456
  577   HH21  ARG  67          HH11      ARG  67   6.735 -15.373   4.788
  578   HH22  ARG  67          HH12      ARG  67   6.780 -17.099   5.113
  579    H    THR  68           H        THR  68  14.091 -12.450   0.128
  580    HA   THR  68           HA       THR  68  14.153 -10.525   2.250
  581    HB   THR  68           HB       THR  68  16.218 -11.008   0.057
  582    HG1  THR  68           HG1      THR  68  15.938 -12.897   1.007
  583   HG21  THR  68          HG21      THR  68  16.462  -9.829   2.864
  584   HG22  THR  68          HG22      THR  68  17.833 -10.287   1.831
  585   HG23  THR  68          HG23      THR  68  16.751  -8.987   1.324
  586    H    MET  69           H        MET  69  14.014 -10.210  -1.332
  587    HA   MET  69           HA       MET  69  14.279  -7.308  -1.130
  588    HB2  MET  69           HB2      MET  69  13.900  -9.148  -3.517
  589    HB3  MET  69           HB3      MET  69  14.214  -7.416  -3.598
  590    HG2  MET  69           HG2      MET  69  16.070  -9.535  -2.424
  591    HG3  MET  69           HG3      MET  69  16.288  -8.691  -3.939
  592    HE1  MET  69           HE1      MET  69  17.212  -5.051  -2.794
  593    HE2  MET  69           HE2      MET  69  17.125  -6.165  -4.168
  594    HE3  MET  69           HE3      MET  69  15.636  -5.676  -3.327
  595    H    GLN  70           H        GLN  70  11.597  -9.454  -0.999
  596    HA   GLN  70           HA       GLN  70   9.570  -7.958  -2.210
  597    HB2  GLN  70           HB2      GLN  70   9.353 -10.257  -1.197
  598    HB3  GLN  70           HB3      GLN  70   9.473  -9.536   0.407
  599    HG2  GLN  70           HG2      GLN  70   7.183  -9.976   0.038
  600    HG3  GLN  70           HG3      GLN  70   7.346  -8.232  -0.112
  601   HE21  GLN  70          HE22      GLN  70   6.207 -11.109  -1.670
  602   HE22  GLN  70          HE21      GLN  70   5.997 -10.451  -3.278
  603    H    GLY  71           H        GLY  71   8.777  -5.940  -1.851
  604    HA2  GLY  71           HA2      GLY  71   8.176  -4.024  -0.808
  605    HA3  GLY  71           HA3      GLY  71   8.494  -4.779   0.757
  606    H    PHE  72           H        PHE  72  11.363  -5.063  -1.087
  607    HA   PHE  72           HA       PHE  72  12.663  -3.213   0.692
  608    HD1  PHE  72           HD1      PHE  72  15.127  -4.421   1.685
  609    HD2  PHE  72           HD2      PHE  72  15.454  -3.065  -2.395
  610    HE1  PHE  72           HE1      PHE  72  17.334  -3.406   2.195
  611    HE2  PHE  72           HE2      PHE  72  17.658  -2.039  -1.878
  612    HZ   PHE  72           HZ       PHE  72  18.601  -2.213   0.417
  613    HB2  PHE  72           HB2      PHE  72  13.669  -5.323  -0.127
  614    HB3  PHE  72           HB3      PHE  72  13.736  -4.659  -1.760
  615    HA   PRO  73           HA       PRO  73  12.409   0.313  -2.170
  616    HB2  PRO  73           HB2      PRO  73  13.928   2.143  -0.880
  617    HB3  PRO  73           HB3      PRO  73  12.341   1.603  -0.262
  618    HG2  PRO  73           HG2      PRO  73  15.085   0.606   0.581
  619    HG3  PRO  73           HG3      PRO  73  13.729   1.132   1.628
  620    HD2  PRO  73           HD2      PRO  73  14.205  -1.498   1.009
  621    HD3  PRO  73           HD3      PRO  73  12.554  -0.864   1.270
  622    H    PHE  74           H        PHE  74  13.494  -1.191  -3.661
  623    HA   PHE  74           HA       PHE  74  16.333  -1.385  -4.010
  624    HD1  PHE  74           HD1      PHE  74  17.287  -3.350  -5.226
  625    HD2  PHE  74           HD2      PHE  74  14.544  -1.881  -8.216
  626    HE1  PHE  74           HE1      PHE  74  18.610  -4.469  -7.004
  627    HE2  PHE  74           HE2      PHE  74  15.854  -3.021  -9.979
  628    HZ   PHE  74           HZ       PHE  74  17.843  -4.375  -9.370
  629    HB2  PHE  74           HB2      PHE  74  14.599  -2.877  -4.936
  630    HB3  PHE  74           HB3      PHE  74  14.020  -1.578  -5.973
  631    H    TYR  75           H        TYR  75  13.912   0.931  -4.988
  632    HA   TYR  75           HA       TYR  75  15.847   3.030  -5.443
  633    HD1  TYR  75           HD1      TYR  75  16.897   4.363  -7.583
  634    HD2  TYR  75           HD2      TYR  75  15.489   0.406  -8.575
  635    HE1  TYR  75           HE1      TYR  75  19.072   3.864  -8.651
  636    HE2  TYR  75           HE2      TYR  75  17.666  -0.110  -9.634
  637    HH   TYR  75           HH       TYR  75  19.830   0.644 -10.051
  638    HB2  TYR  75           HB2      TYR  75  13.951   2.060  -7.624
  639    HB3  TYR  75           HB3      TYR  75  14.462   3.739  -7.548
  640    H    ASP  76           H        ASP  76  13.777   4.901  -6.192
  641    HA   ASP  76           HA       ASP  76  12.654   5.440  -3.654
  642    HB2  ASP  76           HB2      ASP  76  13.373   7.087  -5.397
  643    HB3  ASP  76           HB3      ASP  76  11.959   6.648  -6.356
  644    H    LYS  77           H        LYS  77  11.691   2.823  -4.838
  645    HA   LYS  77           HA       LYS  77   8.876   3.153  -4.216
  646    HB2  LYS  77           HB2      LYS  77   9.900   2.104  -6.876
  647    HB3  LYS  77           HB3      LYS  77   8.479   1.369  -6.139
  648    HG2  LYS  77           HG2      LYS  77   7.282   3.474  -6.103
  649    HG3  LYS  77           HG3      LYS  77   8.685   4.338  -6.768
  650    HD2  LYS  77           HD2      LYS  77   8.582   3.148  -8.831
  651    HD3  LYS  77           HD3      LYS  77   7.414   1.982  -8.227
  652    HE2  LYS  77           HE2      LYS  77   6.840   4.957  -8.587
  653    HE3  LYS  77           HE3      LYS  77   6.483   3.712  -9.787
  654    HZ1  LYS  77           HZ1      LYS  77   5.074   2.617  -8.078
  655    HZ2  LYS  77           HZ2      LYS  77   5.273   3.919  -7.099
  656    HZ3  LYS  77           HZ3      LYS  77   4.527   4.094  -8.534
  657    HA   PRO  78           HA       PRO  78  10.194  -0.718  -2.239
  658    HB2  PRO  78           HB2      PRO  78   7.782  -1.628  -1.324
  659    HB3  PRO  78           HB3      PRO  78   8.669  -0.278  -0.552
  660    HG2  PRO  78           HG2      PRO  78   6.369  -0.121  -2.517
  661    HG3  PRO  78           HG3      PRO  78   6.601   0.801  -1.000
  662    HD2  PRO  78           HD2      PRO  78   7.236   1.808  -3.475
  663    HD3  PRO  78           HD3      PRO  78   8.152   2.247  -2.004
  664    H    MET  79           H        MET  79  10.598  -2.574  -3.342
  665    HA   MET  79           HA       MET  79   9.432  -3.195  -5.870
  666    HB2  MET  79           HB2      MET  79  10.987  -4.890  -3.866
  667    HB3  MET  79           HB3      MET  79  10.620  -5.408  -5.516
  668    HG2  MET  79           HG2      MET  79  12.141  -2.859  -4.868
  669    HG3  MET  79           HG3      MET  79  12.919  -4.412  -5.124
  670    HE1  MET  79           HE1      MET  79  14.100  -4.786  -7.100
  671    HE2  MET  79           HE2      MET  79  12.694  -5.799  -7.497
  672    HE3  MET  79           HE3      MET  79  13.416  -4.741  -8.735
  673    H    GLN  80           H        GLN  80   7.923  -4.775  -6.480
  674    HA   GLN  80           HA       GLN  80   6.488  -6.254  -4.319
  675    HB2  GLN  80           HB2      GLN  80   5.345  -5.001  -6.863
  676    HB3  GLN  80           HB3      GLN  80   4.495  -6.164  -5.833
  677    HG2  GLN  80           HG2      GLN  80   4.603  -4.600  -3.923
  678    HG3  GLN  80           HG3      GLN  80   5.530  -3.454  -4.887
  679   HE21  GLN  80          HE22      GLN  80   3.914  -1.799  -4.538
  680   HE22  GLN  80          HE21      GLN  80   2.396  -1.842  -5.394
  681    H    ILE  81           H        ILE  81   6.696  -8.435  -4.663
  682    HA   ILE  81           HA       ILE  81   7.758  -9.333  -7.295
  683    HB   ILE  81           HB       ILE  81   8.861 -10.228  -4.615
  684   HG12  ILE  81          HG12      ILE  81   9.853  -7.905  -6.302
  685   HG13  ILE  81          HG13      ILE  81   9.369  -7.899  -4.597
  686   HG21  ILE  81          HG21      ILE  81  10.085 -10.327  -7.410
  687   HG22  ILE  81          HG22      ILE  81  10.727 -11.070  -5.928
  688   HG23  ILE  81          HG23      ILE  81   9.254 -11.685  -6.639
  689   HD11  ILE  81          HD11      ILE  81  11.345  -9.351  -4.084
  690   HD12  ILE  81          HD12      ILE  81  11.888  -9.102  -5.763
  691   HD13  ILE  81          HD13      ILE  81  11.731  -7.720  -4.677
  692    H    ALA  82           H        ALA  82   7.343 -11.506  -7.794
  693    HA   ALA  82           HA       ALA  82   5.878 -13.220  -5.915
  694    HB1  ALA  82           HB1      ALA  82   4.061 -12.104  -7.207
  695    HB2  ALA  82           HB2      ALA  82   4.849 -12.584  -8.729
  696    HB3  ALA  82           HB3      ALA  82   4.189 -13.819  -7.638
  697    H    TYR  83           H        TYR  83   5.814 -15.498  -6.964
  698    HA   TYR  83           HA       TYR  83   8.401 -16.018  -8.316
  699    HD1  TYR  83           HD1      TYR  83   5.585 -16.813  -5.385
  700    HD2  TYR  83           HD2      TYR  83   6.208 -19.807  -8.432
  701    HE1  TYR  83           HE1      TYR  83   3.413 -17.844  -4.804
  702    HE2  TYR  83           HE2      TYR  83   4.076 -20.880  -7.816
  703    HH   TYR  83           HH       TYR  83   1.916 -19.563  -5.248
  704    HB2  TYR  83           HB2      TYR  83   7.973 -18.341  -7.856
  705    HB3  TYR  83           HB3      TYR  83   7.916 -17.400  -6.385
  706    H    SER  84           H        SER  84   8.448 -16.860 -10.445
  707    HA   SER  84           HA       SER  84   6.255 -16.115 -12.112
  708    HG   SER  84           HG       SER  84   9.304 -15.446 -13.468
  709    HB2  SER  84           HB2      SER  84   8.730 -17.722 -12.840
  710    HB3  SER  84           HB3      SER  84   7.666 -16.813 -13.931
  711    H    LYS  85           H        LYS  85   4.505 -17.324 -11.261
  712    HA   LYS  85           HA       LYS  85   4.161 -20.015 -10.921
  713    HB2  LYS  85           HB2      LYS  85   2.474 -18.313 -10.400
  714    HB3  LYS  85           HB3      LYS  85   2.255 -17.950 -12.104
  715    HG2  LYS  85           HG2      LYS  85   0.379 -19.228 -11.316
  716    HG3  LYS  85           HG3      LYS  85   1.262 -20.153 -12.513
  717    HD2  LYS  85           HD2      LYS  85   0.513 -21.592 -10.717
  718    HD3  LYS  85           HD3      LYS  85   2.281 -21.533 -10.708
  719    HE2  LYS  85           HE2      LYS  85   2.263 -19.937  -8.847
  720    HE3  LYS  85           HE3      LYS  85   0.506 -19.792  -8.931
  721    HZ1  LYS  85           HZ1      LYS  85   1.879 -22.333  -8.275
  722    HZ2  LYS  85           HZ2      LYS  85   1.328 -21.269  -7.161
  723    HZ3  LYS  85           HZ3      LYS  85   0.275 -22.022  -8.166
  724    H    SER  86           H        SER  86   3.715 -18.298 -14.054
  725    HA   SER  86           HA       SER  86   4.490 -20.674 -15.578
  726    HG   SER  86           HG       SER  86   0.928 -21.335 -15.478
  727    HB2  SER  86           HB2      SER  86   1.801 -19.275 -15.994
  728    HB3  SER  86           HB3      SER  86   2.467 -20.583 -16.982
  729    H    ASP  87           H        ASP  87   4.978 -20.044 -17.814
  730    HA   ASP  87           HA       ASP  87   4.580 -17.351 -18.744
  731    HB2  ASP  87           HB2      ASP  87   6.633 -16.904 -17.476
  732    HB3  ASP  87           HB3      ASP  87   7.413 -18.325 -18.179
  733    H    SER  88           H        SER  88   5.040 -17.266 -21.052
  734    HA   SER  88           HA       SER  88   5.573 -19.853 -22.402
  735    HG   SER  88           HG       SER  88   1.953 -19.714 -22.199
  736    HB2  SER  88           HB2      SER  88   3.239 -17.993 -23.002
  737    HB3  SER  88           HB3      SER  88   3.594 -19.539 -23.791
  738    H    ASP  89           H        ASP  89   7.083 -17.128 -22.037
  739    HA   ASP  89           HA       ASP  89   7.546 -16.641 -24.924
  740    HB2  ASP  89           HB2      ASP  89   5.744 -15.065 -24.288
  741    HB3  ASP  89           HB3      ASP  89   6.789 -14.398 -23.028
  742    H    ILE  90           H        ILE  90   8.536 -15.751 -21.574
  743    HA   ILE  90           HA       ILE  90  11.206 -15.021 -22.575
  744    HB   ILE  90           HB       ILE  90  11.865 -14.416 -20.507
  745   HG12  ILE  90          HG12      ILE  90   9.721 -16.052 -19.126
  746   HG13  ILE  90          HG13      ILE  90  11.442 -16.423 -19.206
  747   HG21  ILE  90          HG21      ILE  90  10.215 -12.859 -19.698
  748   HG22  ILE  90          HG22      ILE  90   9.991 -13.031 -21.440
  749   HG23  ILE  90          HG23      ILE  90   8.886 -13.856 -20.316
  750   HD11  ILE  90          HD11      ILE  90  10.973 -15.498 -17.054
  751   HD12  ILE  90          HD12      ILE  90  11.917 -14.300 -17.961
  752   HD13  ILE  90          HD13      ILE  90  10.159 -14.093 -17.750
  753    H    VAL  91           H        VAL  91   9.544 -17.753 -21.033
  754    HA   VAL  91           HA       VAL  91  11.763 -19.514 -20.851
  755    HB   VAL  91           HB       VAL  91   8.774 -19.969 -21.189
  756   HG11  VAL  91          HG11      VAL  91  10.937 -22.033 -20.566
  757   HG12  VAL  91          HG12      VAL  91   9.185 -22.296 -20.395
  758   HG13  VAL  91          HG13      VAL  91   9.873 -22.005 -21.994
  759   HG21  VAL  91          HG21      VAL  91   9.543 -18.881 -19.061
  760   HG22  VAL  91          HG22      VAL  91   8.868 -20.490 -18.788
  761   HG23  VAL  91          HG23      VAL  91  10.629 -20.250 -18.772
  762    H    ALA  92           H        ALA  92   9.480 -18.797 -23.562
  763    HA   ALA  92           HA       ALA  92  10.617 -20.684 -25.377
  764    HB1  ALA  92           HB1      ALA  92   9.459 -19.451 -27.097
  765    HB2  ALA  92           HB2      ALA  92   8.395 -19.593 -25.688
  766    HB3  ALA  92           HB3      ALA  92   9.226 -18.053 -26.037
  767    H    LYS  93           H        LYS  93  11.411 -17.243 -24.680
  768    HA   LYS  93           HA       LYS  93  13.345 -16.937 -26.704
  769    HB2  LYS  93           HB2      LYS  93  12.344 -15.367 -24.551
  770    HB3  LYS  93           HB3      LYS  93  14.047 -15.518 -24.210
  771    HG2  LYS  93           HG2      LYS  93  13.678 -13.519 -25.488
  772    HG3  LYS  93           HG3      LYS  93  14.606 -14.651 -26.460
  773    HD2  LYS  93           HD2      LYS  93  12.851 -13.415 -27.747
  774    HD3  LYS  93           HD3      LYS  93  12.710 -15.157 -27.856
  775    HE2  LYS  93           HE2      LYS  93  10.499 -14.221 -27.623
  776    HE3  LYS  93           HE3      LYS  93  10.885 -15.151 -26.182
  777    HZ1  LYS  93           HZ1      LYS  93  11.432 -13.002 -25.089
  778    HZ2  LYS  93           HZ2      LYS  93  10.926 -12.197 -26.425
  779    HZ3  LYS  93           HZ3      LYS  93   9.872 -13.097 -25.546
  780    H    ILE  94           H        ILE  94  13.845 -18.061 -23.280
  781    HA   ILE  94           HA       ILE  94  16.652 -18.444 -23.800
  782    HB   ILE  94           HB       ILE  94  16.803 -19.533 -21.654
  783   HG12  ILE  94          HG12      ILE  94  13.785 -19.301 -21.467
  784   HG13  ILE  94          HG13      ILE  94  14.671 -20.813 -21.674
  785   HG21  ILE  94          HG21      ILE  94  16.735 -17.036 -21.903
  786   HG22  ILE  94          HG22      ILE  94  15.011 -17.069 -21.477
  787   HG23  ILE  94          HG23      ILE  94  16.237 -17.600 -20.311
  788   HD11  ILE  94          HD11      ILE  94  14.740 -18.990 -19.240
  789   HD12  ILE  94          HD12      ILE  94  14.042 -20.610 -19.366
  790   HD13  ILE  94          HD13      ILE  94  15.803 -20.402 -19.473
  791    H    LYS  95           H        LYS  95  13.848 -20.577 -24.222
  792    HA   LYS  95           HA       LYS  95  15.396 -22.956 -24.734
  793    HB2  LYS  95           HB2      LYS  95  12.612 -22.067 -25.574
  794    HB3  LYS  95           HB3      LYS  95  13.315 -23.594 -26.115
  795    HG2  LYS  95           HG2      LYS  95  13.613 -24.374 -23.840
  796    HG3  LYS  95           HG3      LYS  95  13.037 -22.838 -23.177
  797    HD2  LYS  95           HD2      LYS  95  10.828 -23.187 -24.221
  798    HD3  LYS  95           HD3      LYS  95  11.367 -24.719 -24.917
  799    HE2  LYS  95           HE2      LYS  95  11.265 -24.097 -21.925
  800    HE3  LYS  95           HE3      LYS  95   9.984 -24.923 -22.815
  801    HZ1  LYS  95           HZ1      LYS  95  11.559 -26.693 -23.335
  802    HZ2  LYS  95           HZ2      LYS  95  12.745 -25.948 -22.487
  803    HZ3  LYS  95           HZ3      LYS  95  11.418 -26.503 -21.726
  804    H    GLY  96           H        GLY  96  14.287 -20.280 -26.911
  805    HA2  GLY  96           HA2      GLY  96  16.650 -20.496 -28.495
  806    HA3  GLY  96           HA3      GLY  96  15.309 -21.312 -29.315
  807    H    THR  97           H        THR  97  13.187 -19.970 -29.335
  808    HA   THR  97           HA       THR  97  13.569 -17.041 -29.492
  809    HB   THR  97           HB       THR  97  12.565 -17.117 -31.847
  810    HG1  THR  97           HG1      THR  97  13.709 -19.727 -31.866
  811   HG21  THR  97          HG21      THR  97  14.955 -16.505 -31.380
  812   HG22  THR  97          HG22      THR  97  15.394 -18.192 -31.735
  813   HG23  THR  97          HG23      THR  97  14.639 -17.179 -32.982
  814    H    PHE  98           H        PHE  98  11.137 -18.983 -31.142
  815    HA   PHE  98           HA       PHE  98   9.088 -18.370 -29.040
  816    HD1  PHE  98           HD1      PHE  98   6.869 -17.021 -29.323
  817    HD2  PHE  98           HD2      PHE  98   6.748 -20.122 -32.328
  818    HE1  PHE  98           HE1      PHE  98   4.440 -17.326 -28.918
  819    HE2  PHE  98           HE2      PHE  98   4.319 -20.418 -31.918
  820    HZ   PHE  98           HZ       PHE  98   3.160 -19.023 -30.213
  821    HB2  PHE  98           HB2      PHE  98   8.659 -17.304 -31.226
  822    HB3  PHE  98           HB3      PHE  98   8.745 -18.872 -32.020
  823    H    LYS  99           H        LYS  99  11.052 -20.718 -30.440
  824    HA   LYS  99           HA       LYS  99   9.789 -22.914 -29.002
  825    HB2  LYS  99           HB2      LYS  99  10.539 -22.920 -31.974
  826    HB3  LYS  99           HB3      LYS  99  10.372 -24.409 -31.069
  827    HG2  LYS  99           HG2      LYS  99   8.045 -22.466 -31.301
  828    HG3  LYS  99           HG3      LYS  99   8.446 -23.601 -32.569
  829    HD2  LYS  99           HD2      LYS  99   6.710 -24.563 -31.217
  830    HD3  LYS  99           HD3      LYS  99   8.180 -25.508 -31.086
  831    HE2  LYS  99           HE2      LYS  99   7.145 -25.417 -28.935
  832    HE3  LYS  99           HE3      LYS  99   8.645 -24.510 -28.855
  833    HZ1  LYS  99           HZ1      LYS  99   7.306 -22.450 -29.023
  834    HZ2  LYS  99           HZ2      LYS  99   5.926 -23.332 -29.149
  835    HZ3  LYS  99           HZ3      LYS  99   6.787 -23.362 -27.770
  836    H    GLU 100           H        GLU 100  11.658 -24.794 -29.337
  837    HA   GLU 100           HA       GLU 100  14.099 -23.720 -28.326
  838    HB2  GLU 100           HB2      GLU 100  14.859 -25.956 -28.299
  839    HB3  GLU 100           HB3      GLU 100  13.160 -25.979 -27.857
  840    HG2  GLU 100           HG2      GLU 100  14.332 -26.739 -30.573
  841    HG3  GLU 100           HG3      GLU 100  13.809 -27.857 -29.325
  842    H    ARG 101           H        ARG 101  12.948 -23.492 -31.442
  843    HA   ARG 101           HA       ARG 101  15.238 -24.089 -33.042
  844    HE   ARG 101           HE       ARG 101  10.753 -25.628 -35.043
  845    HB2  ARG 101           HB2      ARG 101  12.986 -22.086 -33.537
  846    HB3  ARG 101           HB3      ARG 101  14.090 -22.750 -34.750
  847    HG2  ARG 101           HG2      ARG 101  13.128 -24.956 -34.563
  848    HG3  ARG 101           HG3      ARG 101  12.112 -24.461 -33.194
  849    HD2  ARG 101           HD2      ARG 101  10.986 -22.783 -34.629
  850    HD3  ARG 101           HD3      ARG 101  11.943 -23.331 -36.019
  851   HH11  ARG 101          HH21      ARG 101   9.536 -22.487 -36.261
  852   HH12  ARG 101          HH22      ARG 101   8.037 -23.159 -36.808
  853   HH21  ARG 101          HH11      ARG 101   8.753 -26.478 -35.783
  854   HH22  ARG 101          HH12      ARG 101   7.590 -25.460 -36.539
  855    HA   PRO 102           HA       PRO 102  17.552 -20.324 -32.143
  856    HB2  PRO 102           HB2      PRO 102  19.316 -20.258 -34.229
  857    HB3  PRO 102           HB3      PRO 102  19.406 -21.487 -32.930
  858    HG2  PRO 102           HG2      PRO 102  18.112 -21.762 -35.665
  859    HG3  PRO 102           HG3      PRO 102  19.271 -22.879 -34.873
  860    HD2  PRO 102           HD2      PRO 102  16.569 -23.278 -34.788
  861    HD3  PRO 102           HD3      PRO 102  17.622 -23.694 -33.401
  862    H    LYS 103           H        LYS 103  15.454 -20.739 -34.865
  863    HA   LYS 103           HA       LYS 103  15.016 -17.859 -35.056
  864    HB2  LYS 103           HB2      LYS 103  16.677 -18.382 -36.863
  865    HB3  LYS 103           HB3      LYS 103  15.561 -19.593 -37.515
  866    HG2  LYS 103           HG2      LYS 103  13.882 -17.817 -37.948
  867    HG3  LYS 103           HG3      LYS 103  14.967 -16.609 -37.230
  868    HD2  LYS 103           HD2      LYS 103  16.651 -17.077 -38.994
  869    HD3  LYS 103           HD3      LYS 103  15.566 -18.294 -39.706
  870    HE2  LYS 103           HE2      LYS 103  13.847 -16.537 -40.078
  871    HE3  LYS 103           HE3      LYS 103  14.924 -15.327 -39.369
  872    HZ1  LYS 103           HZ1      LYS 103  16.480 -15.746 -41.185
  873    HZ2  LYS 103           HZ2      LYS 103  15.483 -16.864 -41.841
  874    HZ3  LYS 103           HZ3      LYS 103  15.029 -15.301 -41.777
  875    H    LYS 104           H        LYS 104  12.791 -17.551 -35.307
  876    HA   LYS 104           HA       LYS 104  11.070 -19.535 -34.446
  877    HB2  LYS 104           HB2      LYS 104  10.340 -17.102 -36.132
  878    HB3  LYS 104           HB3      LYS 104   9.221 -18.075 -35.172
  879    HG2  LYS 104           HG2      LYS 104  10.484 -17.452 -33.101
  880    HG3  LYS 104           HG3      LYS 104  11.534 -16.408 -34.077
  881    HD2  LYS 104           HD2      LYS 104   9.535 -15.109 -34.811
  882    HD3  LYS 104           HD3      LYS 104   8.513 -16.117 -33.764
  883    HE2  LYS 104           HE2      LYS 104   9.823 -15.375 -31.782
  884    HE3  LYS 104           HE3      LYS 104  10.853 -14.390 -32.829
  885    HZ1  LYS 104           HZ1      LYS 104   7.942 -13.977 -32.443
  886    HZ2  LYS 104           HZ2      LYS 104   9.124 -13.062 -31.796
  887    HZ3  LYS 104           HZ3      LYS 104   8.901 -13.071 -33.408
  Start of MODEL   11
    1    HA   MET   1           HA       MET   1   0.960 -16.244   4.944
    2    H1   MET   1           H1       MET   1   0.729 -17.762   2.443
    3    H2   MET   1           H2       MET   1  -0.393 -17.688   3.637
    4    H3   MET   1           H3       MET   1  -0.011 -16.345   2.785
    5    HB2  MET   1           HB2      MET   1   1.152 -18.681   5.307
    6    HB3  MET   1           HB3      MET   1   2.477 -18.764   4.144
    7    HG2  MET   1           HG2      MET   1   3.319 -18.719   6.428
    8    HG3  MET   1           HG3      MET   1   3.833 -17.272   5.571
    9    HE1  MET   1           HE1      MET   1   3.521 -16.039   9.274
   10    HE2  MET   1           HE2      MET   1   4.064 -17.635   8.710
   11    HE3  MET   1           HE3      MET   1   4.570 -16.164   7.845
   12    H    GLU   2           H        GLU   2   3.369 -17.588   2.546
   13    HA   GLU   2           HA       GLU   2   4.085 -14.920   1.670
   14    HB2  GLU   2           HB2      GLU   2   6.433 -15.079   2.322
   15    HB3  GLU   2           HB3      GLU   2   5.385 -15.050   3.734
   16    HG2  GLU   2           HG2      GLU   2   5.632 -17.563   3.904
   17    HG3  GLU   2           HG3      GLU   2   6.781 -17.495   2.565
   18    H    MET   3           H        MET   3   5.938 -15.197   0.022
   19    HA   MET   3           HA       MET   3   4.933 -16.804  -2.033
   20    HB2  MET   3           HB2      MET   3   7.631 -15.398  -1.734
   21    HB3  MET   3           HB3      MET   3   7.050 -16.113  -3.226
   22    HG2  MET   3           HG2      MET   3   6.641 -13.772  -3.337
   23    HG3  MET   3           HG3      MET   3   5.113 -14.620  -3.266
   24    HE1  MET   3           HE1      MET   3   7.663 -12.318  -1.171
   25    HE2  MET   3           HE2      MET   3   6.764 -12.171   0.356
   26    HE3  MET   3           HE3      MET   3   7.438 -13.735  -0.121
   27    H    LEU   4           H        LEU   4   5.896 -18.524  -3.263
   28    HA   LEU   4           HA       LEU   4   7.383 -20.474  -1.583
   29    HG   LEU   4           HG       LEU   4   5.806 -22.192  -1.163
   30    HB2  LEU   4           HB2      LEU   4   5.355 -20.754  -3.826
   31    HB3  LEU   4           HB3      LEU   4   6.545 -22.011  -3.551
   32   HD11  LEU   4          HD11      LEU   4   3.509 -20.425  -2.111
   33   HD12  LEU   4          HD12      LEU   4   3.508 -21.386  -0.614
   34   HD13  LEU   4          HD13      LEU   4   4.667 -20.075  -0.807
   35   HD21  LEU   4          HD21      LEU   4   3.717 -22.736  -3.318
   36   HD22  LEU   4          HD22      LEU   4   5.100 -23.776  -2.911
   37   HD23  LEU   4          HD23      LEU   4   3.810 -23.528  -1.727
   38    HA   PRO   5           HA       PRO   5  10.906 -20.385  -4.375
   39    HB2  PRO   5           HB2      PRO   5  10.604 -23.390  -4.374
   40    HB3  PRO   5           HB3      PRO   5  12.084 -22.410  -4.154
   41    HG2  PRO   5           HG2      PRO   5  10.861 -23.524  -2.012
   42    HG3  PRO   5           HG3      PRO   5  11.477 -21.841  -1.921
   43    HD2  PRO   5           HD2      PRO   5   8.640 -22.783  -2.375
   44    HD3  PRO   5           HD3      PRO   5   9.252 -21.455  -1.341
   45    H    ASN   6           H        ASN   6  11.205 -20.241  -6.502
   46    HA   ASN   6           HA       ASN   6  10.219 -22.078  -8.476
   47    HB2  ASN   6           HB2      ASN   6   8.217 -20.537  -8.298
   48    HB3  ASN   6           HB3      ASN   6   9.297 -19.159  -8.552
   49   HD21  ASN   6          HD22      ASN   6   9.406 -18.449 -10.705
   50   HD22  ASN   6          HD21      ASN   6   9.009 -19.443 -12.070
   51    H    GLN   7           H        GLN   7  11.720 -21.761 -10.357
   52    HA   GLN   7           HA       GLN   7  14.190 -20.688  -9.487
   53    HB2  GLN   7           HB2      GLN   7  13.807 -22.595 -11.104
   54    HB3  GLN   7           HB3      GLN   7  13.458 -21.392 -12.360
   55    HG2  GLN   7           HG2      GLN   7  15.715 -20.450 -12.106
   56    HG3  GLN   7           HG3      GLN   7  16.048 -21.515 -10.738
   57   HE21  GLN   7          HE22      GLN   7  17.875 -21.481 -12.595
   58   HE22  GLN   7          HE21      GLN   7  17.840 -22.909 -13.629
   59    H    THR   8           H        THR   8  11.572 -19.001 -10.931
   60    HA   THR   8           HA       THR   8  13.303 -16.701 -11.644
   61    HB   THR   8           HB       THR   8  10.945 -17.851 -13.175
   62    HG1  THR   8           HG1      THR   8  12.401 -18.646 -14.570
   63   HG21  THR   8          HG21      THR   8  11.162 -15.395 -13.522
   64   HG22  THR   8          HG22      THR   8  12.863 -15.614 -13.969
   65   HG23  THR   8          HG23      THR   8  11.576 -16.297 -14.985
   66    H    ILE   9           H        ILE   9  12.407 -14.686 -11.189
   67    HA   ILE   9           HA       ILE   9   9.823 -14.638  -9.718
   68    HB   ILE   9           HB       ILE   9  10.649 -13.419  -7.937
   69   HG12  ILE   9          HG12      ILE   9  13.068 -12.806  -9.624
   70   HG13  ILE   9          HG13      ILE   9  11.855 -11.690  -9.022
   71   HG21  ILE   9          HG21      ILE   9  12.451 -14.735  -6.931
   72   HG22  ILE   9          HG22      ILE   9  11.378 -15.799  -7.850
   73   HG23  ILE   9          HG23      ILE   9  12.964 -15.322  -8.502
   74   HD11  ILE   9          HD11      ILE   9  13.978 -13.065  -7.339
   75   HD12  ILE   9          HD12      ILE   9  13.865 -11.359  -7.789
   76   HD13  ILE   9          HD13      ILE   9  12.663 -12.074  -6.689
   77    H    TYR  10           H        TYR  10   8.933 -12.422  -9.653
   78    HA   TYR  10           HA       TYR  10   9.479 -10.897 -12.153
   79    HD1  TYR  10           HD1      TYR  10   8.287  -9.992 -13.929
   80    HD2  TYR  10           HD2      TYR  10   4.800 -11.187 -11.687
   81    HE1  TYR  10           HE1      TYR  10   6.880  -8.581 -15.383
   82    HE2  TYR  10           HE2      TYR  10   3.382  -9.785 -13.142
   83    HH   TYR  10           HH       TYR  10   3.309  -8.409 -15.021
   84    HB2  TYR  10           HB2      TYR  10   7.701 -12.510 -12.529
   85    HB3  TYR  10           HB3      TYR  10   6.880 -12.029 -11.049
   86    H    ILE  11           H        ILE  11   9.682  -8.835 -11.714
   87    HA   ILE  11           HA       ILE  11   9.090  -7.757  -9.002
   88    HB   ILE  11           HB       ILE  11  11.233  -7.135 -11.098
   89   HG12  ILE  11          HG12      ILE  11  11.671  -8.166  -8.263
   90   HG13  ILE  11          HG13      ILE  11  11.484  -9.262  -9.627
   91   HG21  ILE  11          HG21      ILE  11  10.558  -5.061  -9.959
   92   HG22  ILE  11          HG22      ILE  11  10.788  -5.831  -8.373
   93   HG23  ILE  11          HG23      ILE  11  12.175  -5.536  -9.452
   94   HD11  ILE  11          HD11      ILE  11  13.802  -9.048  -9.194
   95   HD12  ILE  11          HD12      ILE  11  13.458  -8.237 -10.731
   96   HD13  ILE  11          HD13      ILE  11  13.733  -7.272  -9.259
   97    H    ASN  12           H        ASN  12   7.656  -6.000  -9.012
   98    HA   ASN  12           HA       ASN  12   6.734  -5.067 -11.698
   99    HB2  ASN  12           HB2      ASN  12   5.479  -7.044 -10.406
  100    HB3  ASN  12           HB3      ASN  12   4.760  -5.711  -9.505
  101   HD21  ASN  12          HD22      ASN  12   5.459  -6.905 -12.812
  102   HD22  ASN  12          HD21      ASN  12   4.168  -6.057 -13.625
  103    H    ASN  13           H        ASN  13   8.285  -3.569  -9.472
  104    HA   ASN  13           HA       ASN  13   6.608  -1.202  -9.688
  105    HB2  ASN  13           HB2      ASN  13   5.934  -2.313  -7.509
  106    HB3  ASN  13           HB3      ASN  13   7.582  -2.043  -6.933
  107   HD21  ASN  13          HD22      ASN  13   7.205  -0.456  -5.339
  108   HD22  ASN  13          HD21      ASN  13   6.320   1.026  -5.619
  109    H    LEU  14           H        LEU  14   8.861  -1.695 -11.127
  110    HA   LEU  14           HA       LEU  14  11.121  -0.224  -9.872
  111    HG   LEU  14           HG       LEU  14  11.427  -2.915 -10.797
  112    HB2  LEU  14           HB2      LEU  14  10.619  -1.306 -12.674
  113    HB3  LEU  14           HB3      LEU  14  12.013  -0.320 -12.272
  114   HD11  LEU  14          HD11      LEU  14  13.168  -2.556 -13.269
  115   HD12  LEU  14          HD12      LEU  14  12.972  -4.043 -12.309
  116   HD13  LEU  14          HD13      LEU  14  11.603  -3.399 -13.219
  117   HD21  LEU  14          HD21      LEU  14  13.794  -2.860 -10.262
  118   HD22  LEU  14          HD22      LEU  14  14.003  -1.345 -11.175
  119   HD23  LEU  14          HD23      LEU  14  13.013  -1.382  -9.700
  120    H    ASN  15           H        ASN  15  11.532   1.937 -10.281
  121    HA   ASN  15           HA       ASN  15   9.357   3.580 -11.370
  122    HB2  ASN  15           HB2      ASN  15  10.925   4.333  -9.500
  123    HB3  ASN  15           HB3      ASN  15  12.214   4.428 -10.695
  124   HD21  ASN  15          HD22      ASN  15  10.638   6.554  -9.018
  125   HD22  ASN  15          HD21      ASN  15  10.084   7.681 -10.241
  126    H    GLU  16           H        GLU  16   9.142   3.971 -13.543
  127    HA   GLU  16           HA       GLU  16  10.594   2.572 -15.410
  128    HB2  GLU  16           HB2      GLU  16   9.497   3.826 -17.125
  129    HB3  GLU  16           HB3      GLU  16   8.356   3.487 -15.822
  130    HG2  GLU  16           HG2      GLU  16   8.520   5.802 -15.025
  131    HG3  GLU  16           HG3      GLU  16   9.788   6.160 -16.200
  132    H    LYS  17           H        LYS  17  11.482   5.713 -14.094
  133    HA   LYS  17           HA       LYS  17  13.239   6.500 -16.184
  134    HB2  LYS  17           HB2      LYS  17  14.104   8.140 -14.622
  135    HB3  LYS  17           HB3      LYS  17  12.358   8.031 -14.499
  136    HG2  LYS  17           HG2      LYS  17  12.711   7.980 -12.287
  137    HG3  LYS  17           HG3      LYS  17  13.055   6.265 -12.526
  138    HD2  LYS  17           HD2      LYS  17  15.505   6.859 -12.740
  139    HD3  LYS  17           HD3      LYS  17  15.097   8.524 -12.310
  140    HE2  LYS  17           HE2      LYS  17  14.473   6.053 -10.620
  141    HE3  LYS  17           HE3      LYS  17  15.872   7.096 -10.364
  142    HZ1  LYS  17           HZ1      LYS  17  13.115   8.154 -10.254
  143    HZ2  LYS  17           HZ2      LYS  17  13.824   7.484  -8.960
  144    HZ3  LYS  17           HZ3      LYS  17  14.483   8.834  -9.653
  145    H    ILE  18           H        ILE  18  13.642   3.946 -13.861
  146    HA   ILE  18           HA       ILE  18  16.545   3.967 -13.801
  147    HB   ILE  18           HB       ILE  18  14.524   1.738 -13.297
  148   HG12  ILE  18          HG12      ILE  18  14.199   3.498 -11.666
  149   HG13  ILE  18          HG13      ILE  18  14.975   2.130 -10.899
  150   HG21  ILE  18          HG21      ILE  18  16.645   0.707 -13.797
  151   HG22  ILE  18          HG22      ILE  18  17.518   1.821 -12.727
  152   HG23  ILE  18          HG23      ILE  18  16.394   0.620 -12.057
  153   HD11  ILE  18          HD11      ILE  18  15.929   4.232 -10.104
  154   HD12  ILE  18          HD12      ILE  18  17.169   3.345 -11.009
  155   HD13  ILE  18          HD13      ILE  18  16.342   4.731 -11.746
  156    H    LYS  19           H        LYS  19  17.797   3.607 -15.491
  157    HA   LYS  19           HA       LYS  19  16.905   2.617 -18.040
  158    HB2  LYS  19           HB2      LYS  19  18.930   4.105 -17.612
  159    HB3  LYS  19           HB3      LYS  19  19.737   2.709 -16.887
  160    HG2  LYS  19           HG2      LYS  19  19.435   1.497 -19.110
  161    HG3  LYS  19           HG3      LYS  19  18.787   3.007 -19.772
  162    HD2  LYS  19           HD2      LYS  19  20.964   4.127 -19.209
  163    HD3  LYS  19           HD3      LYS  19  21.573   2.571 -18.602
  164    HE2  LYS  19           HE2      LYS  19  21.051   1.590 -20.904
  165    HE3  LYS  19           HE3      LYS  19  20.699   3.231 -21.453
  166    HZ1  LYS  19           HZ1      LYS  19  23.302   2.220 -20.435
  167    HZ2  LYS  19           HZ2      LYS  19  22.959   2.657 -21.972
  168    HZ3  LYS  19           HZ3      LYS  19  23.017   3.802 -20.812
  169    H    LYS  20           H        LYS  20  17.112   0.440 -18.875
  170    HA   LYS  20           HA       LYS  20  16.803  -1.467 -16.737
  171    HB2  LYS  20           HB2      LYS  20  16.577  -1.622 -19.734
  172    HB3  LYS  20           HB3      LYS  20  16.652  -3.103 -18.778
  173    HG2  LYS  20           HG2      LYS  20  14.318  -2.453 -19.083
  174    HG3  LYS  20           HG3      LYS  20  14.768  -2.414 -17.387
  175    HD2  LYS  20           HD2      LYS  20  14.947   0.051 -17.504
  176    HD3  LYS  20           HD3      LYS  20  14.433   0.009 -19.204
  177    HE2  LYS  20           HE2      LYS  20  12.235  -0.834 -18.496
  178    HE3  LYS  20           HE3      LYS  20  12.821  -1.074 -16.849
  179    HZ1  LYS  20           HZ1      LYS  20  11.573   0.962 -16.996
  180    HZ2  LYS  20           HZ2      LYS  20  13.154   1.343 -16.675
  181    HZ3  LYS  20           HZ3      LYS  20  12.543   1.569 -18.166
  182    H    GLU  21           H        GLU  21  19.587  -0.532 -18.604
  183    HA   GLU  21           HA       GLU  21  21.201  -2.801 -17.859
  184    HB2  GLU  21           HB2      GLU  21  21.970  -1.579 -19.615
  185    HB3  GLU  21           HB3      GLU  21  21.656  -0.009 -18.855
  186    HG2  GLU  21           HG2      GLU  21  23.572  -0.314 -17.346
  187    HG3  GLU  21           HG3      GLU  21  23.868  -1.928 -18.018
  188    H    GLU  22           H        GLU  22  20.171   0.189 -16.132
  189    HA   GLU  22           HA       GLU  22  22.056  -0.248 -13.953
  190    HB2  GLU  22           HB2      GLU  22  19.576   1.501 -14.176
  191    HB3  GLU  22           HB3      GLU  22  20.605   1.424 -12.755
  192    HG2  GLU  22           HG2      GLU  22  21.648   2.181 -15.523
  193    HG3  GLU  22           HG3      GLU  22  21.043   3.348 -14.353
  194    H    LEU  23           H        LEU  23  18.671  -1.161 -14.692
  195    HA   LEU  23           HA       LEU  23  18.126  -2.557 -12.241
  196    HG   LEU  23           HG       LEU  23  15.232  -4.110 -14.453
  197    HB2  LEU  23           HB2      LEU  23  16.319  -2.139 -13.719
  198    HB3  LEU  23           HB3      LEU  23  17.147  -2.796 -15.100
  199   HD11  LEU  23          HD11      LEU  23  17.079  -5.182 -15.661
  200   HD12  LEU  23          HD12      LEU  23  17.682  -5.815 -14.120
  201   HD13  LEU  23          HD13      LEU  23  16.084  -6.278 -14.686
  202   HD21  LEU  23          HD21      LEU  23  15.377  -3.755 -11.988
  203   HD22  LEU  23          HD22      LEU  23  15.195  -5.464 -12.416
  204   HD23  LEU  23          HD23      LEU  23  16.780  -4.835 -11.921
  205    H    LYS  24           H        LYS  24  19.653  -3.714 -15.308
  206    HA   LYS  24           HA       LYS  24  20.229  -6.319 -14.395
  207    HB2  LYS  24           HB2      LYS  24  21.534  -4.515 -16.483
  208    HB3  LYS  24           HB3      LYS  24  22.172  -6.124 -16.125
  209    HG2  LYS  24           HG2      LYS  24  20.086  -7.190 -16.728
  210    HG3  LYS  24           HG3      LYS  24  19.256  -5.639 -16.862
  211    HD2  LYS  24           HD2      LYS  24  19.720  -6.490 -19.066
  212    HD3  LYS  24           HD3      LYS  24  20.675  -5.027 -18.796
  213    HE2  LYS  24           HE2      LYS  24  22.678  -6.421 -18.307
  214    HE3  LYS  24           HE3      LYS  24  21.714  -7.890 -18.512
  215    HZ1  LYS  24           HZ1      LYS  24  22.970  -7.367 -20.504
  216    HZ2  LYS  24           HZ2      LYS  24  21.379  -7.266 -20.834
  217    HZ3  LYS  24           HZ3      LYS  24  22.267  -5.905 -20.647
  218    H    LYS  25           H        LYS  25  22.392  -3.429 -14.262
  219    HA   LYS  25           HA       LYS  25  24.472  -4.762 -12.864
  220    HB2  LYS  25           HB2      LYS  25  23.643  -1.830 -12.958
  221    HB3  LYS  25           HB3      LYS  25  25.086  -2.377 -12.119
  222    HG2  LYS  25           HG2      LYS  25  24.574  -2.823 -15.091
  223    HG3  LYS  25           HG3      LYS  25  25.492  -1.478 -14.430
  224    HD2  LYS  25           HD2      LYS  25  26.231  -4.421 -14.139
  225    HD3  LYS  25           HD3      LYS  25  26.922  -3.284 -15.300
  226    HE2  LYS  25           HE2      LYS  25  27.736  -1.864 -13.411
  227    HE3  LYS  25           HE3      LYS  25  27.113  -3.055 -12.262
  228    HZ1  LYS  25           HZ1      LYS  25  29.464  -3.378 -12.681
  229    HZ2  LYS  25           HZ2      LYS  25  28.647  -4.680 -13.220
  230    HZ3  LYS  25           HZ3      LYS  25  29.223  -3.574 -14.277
  231    H    SER  26           H        SER  26  21.609  -3.004 -11.550
  232    HA   SER  26           HA       SER  26  22.428  -3.194  -8.845
  233    HG   SER  26           HG       SER  26  20.737  -1.338 -10.678
  234    HB2  SER  26           HB2      SER  26  19.619  -3.073  -9.994
  235    HB3  SER  26           HB3      SER  26  20.080  -2.734  -8.310
  236    H    LEU  27           H        LEU  27  20.477  -5.433 -10.848
  237    HA   LEU  27           HA       LEU  27  19.921  -7.286  -8.754
  238    HG   LEU  27           HG       LEU  27  18.097  -6.424 -10.811
  239    HB2  LEU  27           HB2      LEU  27  20.161  -7.571 -11.752
  240    HB3  LEU  27           HB3      LEU  27  19.793  -8.961 -10.736
  241   HD11  LEU  27          HD11      LEU  27  16.514  -7.756 -12.160
  242   HD12  LEU  27          HD12      LEU  27  18.078  -7.580 -12.961
  243   HD13  LEU  27          HD13      LEU  27  17.671  -9.112 -12.179
  244   HD21  LEU  27          HD21      LEU  27  17.629  -9.177  -9.600
  245   HD22  LEU  27          HD22      LEU  27  17.744  -7.614  -8.751
  246   HD23  LEU  27          HD23      LEU  27  16.369  -7.935  -9.797
  247    H    TYR  28           H        TYR  28  22.616  -7.246 -11.199
  248    HA   TYR  28           HA       TYR  28  23.930  -9.495 -10.064
  249    HD1  TYR  28           HD2      TYR  28  24.603 -10.935 -11.697
  250    HD2  TYR  28           HD1      TYR  28  24.418  -7.265 -13.959
  251    HE1  TYR  28           HE2      TYR  28  23.929 -12.210 -13.708
  252    HE2  TYR  28           HE1      TYR  28  23.767  -8.533 -15.976
  253    HH   TYR  28           HH       TYR  28  23.299 -10.641 -16.875
  254    HB2  TYR  28           HB2      TYR  28  25.013  -7.158 -11.678
  255    HB3  TYR  28           HB3      TYR  28  25.986  -8.543 -11.209
  256    H    ALA  29           H        ALA  29  24.004  -6.084  -9.065
  257    HA   ALA  29           HA       ALA  29  26.372  -6.362  -7.455
  258    HB1  ALA  29           HB1      ALA  29  25.677  -4.206  -8.411
  259    HB2  ALA  29           HB2      ALA  29  24.193  -4.226  -7.428
  260    HB3  ALA  29           HB3      ALA  29  25.781  -4.108  -6.645
  261    H    ILE  30           H        ILE  30  22.849  -6.378  -6.632
  262    HA   ILE  30           HA       ILE  30  23.651  -7.093  -3.834
  263    HB   ILE  30           HB       ILE  30  21.520  -5.940  -3.171
  264   HG12  ILE  30          HG12      ILE  30  21.856  -4.338  -5.722
  265   HG13  ILE  30          HG13      ILE  30  20.616  -5.587  -5.508
  266   HG21  ILE  30          HG21      ILE  30  22.740  -3.799  -2.900
  267   HG22  ILE  30          HG22      ILE  30  23.831  -5.156  -2.681
  268   HG23  ILE  30          HG23      ILE  30  23.850  -4.251  -4.210
  269   HD11  ILE  30          HD11      ILE  30  20.886  -3.034  -3.862
  270   HD12  ILE  30          HD12      ILE  30  19.676  -3.382  -5.094
  271   HD13  ILE  30          HD13      ILE  30  19.684  -4.318  -3.585
  272    H    PHE  31           H        PHE  31  21.105  -7.749  -6.301
  273    HA   PHE  31           HA       PHE  31  19.773  -9.648  -4.593
  274    HD1  PHE  31           HD2      PHE  31  18.654  -7.119  -6.180
  275    HD2  PHE  31           HD1      PHE  31  17.038 -11.091  -6.588
  276    HE1  PHE  31           HE2      PHE  31  16.368  -6.238  -5.826
  277    HE2  PHE  31           HE1      PHE  31  14.763 -10.214  -6.127
  278    HZ   PHE  31           HZ       PHE  31  14.418  -7.789  -5.804
  279    HB2  PHE  31           HB2      PHE  31  19.786  -9.231  -7.566
  280    HB3  PHE  31           HB3      PHE  31  19.275 -10.778  -6.936
  281    H    SER  32           H        SER  32  22.631 -10.004  -6.778
  282    HA   SER  32           HA       SER  32  23.083 -12.684  -6.538
  283    HG   SER  32           HG       SER  32  25.061 -10.477  -8.411
  284    HB2  SER  32           HB2      SER  32  25.089 -10.411  -6.343
  285    HB3  SER  32           HB3      SER  32  25.555 -12.103  -6.560
  286    H    GLN  33           H        GLN  33  23.376 -10.358  -3.915
  287    HA   GLN  33           HA       GLN  33  25.092 -12.022  -2.261
  288    HB2  GLN  33           HB2      GLN  33  23.445  -9.573  -1.494
  289    HB3  GLN  33           HB3      GLN  33  24.721 -10.329  -0.543
  290    HG2  GLN  33           HG2      GLN  33  26.372  -9.832  -2.357
  291    HG3  GLN  33           HG3      GLN  33  25.102  -9.034  -3.281
  292   HE21  GLN  33          HE22      GLN  33  25.966  -6.935  -3.306
  293   HE22  GLN  33          HE21      GLN  33  26.227  -6.001  -1.848
  294    H    PHE  34           H        PHE  34  21.760 -12.178  -3.021
  295    HA   PHE  34           HA       PHE  34  21.245 -13.869  -0.625
  296    HD1  PHE  34           HD1      PHE  34  20.628 -12.345   1.460
  297    HD2  PHE  34           HD2      PHE  34  19.783  -9.804  -1.926
  298    HE1  PHE  34           HE1      PHE  34  21.385 -10.363   2.749
  299    HE2  PHE  34           HE2      PHE  34  20.532  -7.833  -0.634
  300    HZ   PHE  34           HZ       PHE  34  21.337  -8.103   1.707
  301    HB2  PHE  34           HB2      PHE  34  19.221 -12.089  -2.037
  302    HB3  PHE  34           HB3      PHE  34  18.972 -12.988  -0.547
  303    H    GLY  35           H        GLY  35  20.989 -13.528  -4.101
  304    HA2  GLY  35           HA2      GLY  35  20.736 -16.404  -4.270
  305    HA3  GLY  35           HA3      GLY  35  19.353 -15.517  -4.962
  306    H    GLN  36           H        GLN  36  22.644 -16.461  -5.430
  307    HA   GLN  36           HA       GLN  36  23.419 -14.484  -7.278
  308    HB2  GLN  36           HB2      GLN  36  24.694 -16.596  -6.167
  309    HB3  GLN  36           HB3      GLN  36  24.476 -17.200  -7.802
  310    HG2  GLN  36           HG2      GLN  36  25.740 -14.520  -7.004
  311    HG3  GLN  36           HG3      GLN  36  26.635 -15.970  -7.419
  312   HE21  GLN  36          HE22      GLN  36  25.235 -13.049  -8.777
  313   HE22  GLN  36          HE21      GLN  36  25.474 -13.536 -10.430
  314    H    ILE  37           H        ILE  37  23.153 -14.138  -9.313
  315    HA   ILE  37           HA       ILE  37  20.639 -14.816 -10.460
  316    HB   ILE  37           HB       ILE  37  23.013 -13.289 -11.621
  317   HG12  ILE  37          HG12      ILE  37  22.575 -12.314  -9.406
  318   HG13  ILE  37          HG13      ILE  37  22.146 -11.213 -10.688
  319   HG21  ILE  37          HG21      ILE  37  21.399 -13.530 -13.353
  320   HG22  ILE  37          HG22      ILE  37  20.043 -13.171 -12.258
  321   HG23  ILE  37          HG23      ILE  37  21.197 -11.906 -12.726
  322   HD11  ILE  37          HD11      ILE  37  20.525 -11.179  -8.871
  323   HD12  ILE  37          HD12      ILE  37  19.752 -11.727 -10.364
  324   HD13  ILE  37          HD13      ILE  37  20.183 -12.903  -9.098
  325    H    LEU  38           H        LEU  38  20.265 -15.659 -12.648
  326    HA   LEU  38           HA       LEU  38  22.511 -17.143 -13.872
  327    HG   LEU  38           HG       LEU  38  20.537 -18.758 -15.806
  328    HB2  LEU  38           HB2      LEU  38  20.980 -18.733 -12.783
  329    HB3  LEU  38           HB3      LEU  38  19.609 -18.016 -13.633
  330   HD11  LEU  38          HD11      LEU  38  22.731 -20.033 -14.103
  331   HD12  LEU  38          HD12      LEU  38  22.443 -20.380 -15.823
  332   HD13  LEU  38          HD13      LEU  38  22.946 -18.764 -15.328
  333   HD21  LEU  38          HD21      LEU  38  18.987 -20.203 -14.543
  334   HD22  LEU  38          HD22      LEU  38  20.135 -21.156 -15.493
  335   HD23  LEU  38          HD23      LEU  38  20.361 -20.987 -13.738
  336    H    ASP  39           H        ASP  39  19.381 -15.325 -14.334
  337    HA   ASP  39           HA       ASP  39  20.548 -14.072 -16.673
  338    HB2  ASP  39           HB2      ASP  39  19.685 -16.190 -17.692
  339    HB3  ASP  39           HB3      ASP  39  18.078 -15.808 -17.091
  340    H    ILE  40           H        ILE  40  18.980 -12.345 -17.559
  341    HA   ILE  40           HA       ILE  40  17.014 -11.392 -15.552
  342    HB   ILE  40           HB       ILE  40  19.332  -9.731 -16.643
  343   HG12  ILE  40          HG12      ILE  40  18.888 -10.664 -13.775
  344   HG13  ILE  40          HG13      ILE  40  20.122 -11.285 -14.874
  345   HG21  ILE  40          HG21      ILE  40  17.086  -8.994 -14.710
  346   HG22  ILE  40          HG22      ILE  40  18.443  -7.937 -15.166
  347   HG23  ILE  40          HG23      ILE  40  17.283  -8.393 -16.371
  348   HD11  ILE  40          HD11      ILE  40  21.130  -9.000 -15.005
  349   HD12  ILE  40          HD12      ILE  40  20.005  -8.484 -13.737
  350   HD13  ILE  40          HD13      ILE  40  21.186  -9.732 -13.386
  351    H    VAL  41           H        VAL  41  15.303 -10.303 -16.568
  352    HA   VAL  41           HA       VAL  41  15.592  -9.489 -19.399
  353    HB   VAL  41           HB       VAL  41  13.278 -11.160 -18.318
  354   HG11  VAL  41          HG11      VAL  41  13.962 -10.197 -21.143
  355   HG12  VAL  41          HG12      VAL  41  12.606 -11.259 -20.714
  356   HG13  VAL  41          HG13      VAL  41  12.631  -9.598 -20.129
  357   HG21  VAL  41          HG21      VAL  41  15.178 -12.663 -18.546
  358   HG22  VAL  41          HG22      VAL  41  14.059 -12.940 -19.875
  359   HG23  VAL  41          HG23      VAL  41  15.547 -12.015 -20.162
  360    H    ALA  42           H        ALA  42  15.380  -7.301 -19.135
  361    HA   ALA  42           HA       ALA  42  12.748  -6.305 -18.349
  362    HB1  ALA  42           HB1      ALA  42  15.345  -4.989 -17.425
  363    HB2  ALA  42           HB2      ALA  42  13.677  -4.467 -17.077
  364    HB3  ALA  42           HB3      ALA  42  14.307  -5.965 -16.370
  365    H    LEU  43           H        LEU  43  12.326  -4.305 -19.619
  366    HA   LEU  43           HA       LEU  43  14.289  -3.525 -21.677
  367    HG   LEU  43           HG       LEU  43  13.236  -6.388 -22.217
  368    HB2  LEU  43           HB2      LEU  43  11.480  -4.555 -22.296
  369    HB3  LEU  43           HB3      LEU  43  12.495  -3.699 -23.442
  370   HD11  LEU  43          HD11      LEU  43  11.207  -6.578 -23.568
  371   HD12  LEU  43          HD12      LEU  43  12.000  -5.742 -24.921
  372   HD13  LEU  43          HD13      LEU  43  12.578  -7.339 -24.387
  373   HD21  LEU  43          HD21      LEU  43  14.872  -6.479 -24.076
  374   HD22  LEU  43          HD22      LEU  43  14.398  -4.843 -24.586
  375   HD23  LEU  43          HD23      LEU  43  15.198  -5.103 -23.021
  376    H    LYS  44           H        LYS  44  13.673  -1.427 -22.641
  377    HA   LYS  44           HA       LYS  44  12.042   0.206 -20.794
  378    HB2  LYS  44           HB2      LYS  44  12.881   2.117 -22.062
  379    HB3  LYS  44           HB3      LYS  44  14.212   1.078 -21.558
  380    HG2  LYS  44           HG2      LYS  44  14.401   0.138 -23.828
  381    HG3  LYS  44           HG3      LYS  44  12.959   1.017 -24.343
  382    HD2  LYS  44           HD2      LYS  44  14.900   2.150 -25.181
  383    HD3  LYS  44           HD3      LYS  44  14.113   3.171 -23.973
  384    HE2  LYS  44           HE2      LYS  44  15.812   2.486 -22.285
  385    HE3  LYS  44           HE3      LYS  44  16.573   1.422 -23.475
  386    HZ1  LYS  44           HZ1      LYS  44  17.716   3.542 -23.321
  387    HZ2  LYS  44           HZ2      LYS  44  17.076   3.387 -24.809
  388    HZ3  LYS  44           HZ3      LYS  44  16.370   4.371 -23.711
  389    H    THR  45           H        THR  45  11.205  -1.726 -23.371
  390    HA   THR  45           HA       THR  45   9.252  -0.080 -24.678
  391    HB   THR  45           HB       THR  45   8.365  -2.437 -25.255
  392    HG1  THR  45           HG1      THR  45   9.687  -4.135 -24.706
  393   HG21  THR  45          HG21      THR  45   9.902  -1.178 -26.753
  394   HG22  THR  45          HG22      THR  45  11.300  -1.851 -25.886
  395   HG23  THR  45          HG23      THR  45  10.214  -2.919 -26.800
  396    H    LEU  46           H        LEU  46   6.927  -0.316 -24.369
  397    HA   LEU  46           HA       LEU  46   6.056   0.203 -21.789
  398    HG   LEU  46           HG       LEU  46   3.578   0.343 -21.551
  399    HB2  LEU  46           HB2      LEU  46   4.952   0.862 -23.778
  400    HB3  LEU  46           HB3      LEU  46   4.525  -0.794 -24.205
  401   HD11  LEU  46          HD11      LEU  46   3.029   2.091 -23.185
  402   HD12  LEU  46          HD12      LEU  46   2.257   0.891 -24.244
  403   HD13  LEU  46          HD13      LEU  46   1.565   1.262 -22.648
  404   HD21  LEU  46          HD21      LEU  46   2.283  -1.568 -23.567
  405   HD22  LEU  46          HD22      LEU  46   3.046  -2.049 -22.041
  406   HD23  LEU  46          HD23      LEU  46   1.584  -1.072 -22.012
  407    H    LYS  47           H        LYS  47   6.218  -2.932 -23.446
  408    HA   LYS  47           HA       LYS  47   4.775  -4.575 -21.736
  409    HB2  LYS  47           HB2      LYS  47   5.736  -5.256 -23.903
  410    HB3  LYS  47           HB3      LYS  47   7.365  -5.107 -23.257
  411    HG2  LYS  47           HG2      LYS  47   6.712  -7.442 -23.437
  412    HG3  LYS  47           HG3      LYS  47   7.032  -7.005 -21.772
  413    HD2  LYS  47           HD2      LYS  47   5.126  -8.458 -21.845
  414    HD3  LYS  47           HD3      LYS  47   4.566  -6.864 -21.342
  415    HE2  LYS  47           HE2      LYS  47   3.795  -6.415 -23.682
  416    HE3  LYS  47           HE3      LYS  47   4.396  -8.007 -24.170
  417    HZ1  LYS  47           HZ1      LYS  47   2.206  -7.500 -22.246
  418    HZ2  LYS  47           HZ2      LYS  47   2.062  -8.147 -23.738
  419    HZ3  LYS  47           HZ3      LYS  47   2.835  -8.985 -22.552
  420    H    MET  48           H        MET  48   7.979  -3.141 -21.082
  421    HA   MET  48           HA       MET  48   8.026  -4.560 -18.455
  422    HB2  MET  48           HB2      MET  48  10.343  -4.278 -20.377
  423    HB3  MET  48           HB3      MET  48  10.418  -4.960 -18.751
  424    HG2  MET  48           HG2      MET  48   8.457  -6.519 -19.793
  425    HG3  MET  48           HG3      MET  48   9.320  -6.108 -21.277
  426    HE1  MET  48           HE1      MET  48  10.661  -8.715 -17.744
  427    HE2  MET  48           HE2      MET  48   9.875  -7.133 -17.549
  428    HE3  MET  48           HE3      MET  48   8.999  -8.468 -18.319
  429    H    ARG  49           H        ARG  49   7.267  -1.779 -19.402
  430    HA   ARG  49           HA       ARG  49   9.259   0.046 -19.108
  431    HE   ARG  49           HE       ARG  49   8.365   4.489 -19.302
  432    HB2  ARG  49           HB2      ARG  49   6.838   0.339 -19.868
  433    HB3  ARG  49           HB3      ARG  49   6.383   0.491 -18.178
  434    HG2  ARG  49           HG2      ARG  49   6.559   2.680 -19.172
  435    HG3  ARG  49           HG3      ARG  49   7.860   2.488 -17.999
  436    HD2  ARG  49           HD2      ARG  49   9.438   1.965 -19.899
  437    HD3  ARG  49           HD3      ARG  49   8.098   2.225 -21.035
  438   HH11  ARG  49          HH21      ARG  49  10.114   2.996 -22.047
  439   HH12  ARG  49          HH22      ARG  49  10.822   4.504 -22.523
  440   HH21  ARG  49          HH11      ARG  49   9.273   6.304 -19.835
  441   HH22  ARG  49          HH12      ARG  49  10.341   6.500 -21.213
  442    H    GLY  50           H        GLY  50   7.350  -1.271 -16.402
  443    HA2  GLY  50           HA2      GLY  50   9.429  -0.272 -14.517
  444    HA3  GLY  50           HA3      GLY  50   7.709  -0.003 -14.186
  445    H    GLN  51           H        GLN  51   9.028  -2.945 -15.757
  446    HA   GLN  51           HA       GLN  51   8.720  -4.540 -13.351
  447    HB2  GLN  51           HB2      GLN  51   7.041  -6.063 -14.326
  448    HB3  GLN  51           HB3      GLN  51   6.423  -4.439 -14.029
  449    HG2  GLN  51           HG2      GLN  51   6.742  -3.960 -16.517
  450    HG3  GLN  51           HG3      GLN  51   7.135  -5.673 -16.711
  451   HE21  GLN  51          HE22      GLN  51   5.248  -5.691 -18.236
  452   HE22  GLN  51          HE21      GLN  51   3.647  -5.870 -17.549
  453    H    ALA  52           H        ALA  52   9.566  -6.739 -13.705
  454    HA   ALA  52           HA       ALA  52  11.332  -7.195 -16.003
  455    HB1  ALA  52           HB1      ALA  52  12.610  -5.518 -14.690
  456    HB2  ALA  52           HB2      ALA  52  12.390  -6.492 -13.220
  457    HB3  ALA  52           HB3      ALA  52  13.359  -7.125 -14.563
  458    H    PHE  53           H        PHE  53  12.388  -9.353 -15.720
  459    HA   PHE  53           HA       PHE  53  11.650 -10.786 -13.274
  460    HD1  PHE  53           HD2      PHE  53  12.318 -13.840 -16.168
  461    HD2  PHE  53           HD1      PHE  53   9.486 -10.685 -16.952
  462    HE1  PHE  53           HE2      PHE  53  12.266 -14.481 -18.563
  463    HE2  PHE  53           HE1      PHE  53   9.456 -11.311 -19.355
  464    HZ   PHE  53           HZ       PHE  53  10.831 -13.223 -20.160
  465    HB2  PHE  53           HB2      PHE  53  10.972 -12.827 -14.382
  466    HB3  PHE  53           HB3      PHE  53   9.862 -11.522 -14.687
  467    H    VAL  54           H        VAL  54  13.034 -12.576 -12.823
  468    HA   VAL  54           HA       VAL  54  15.614 -12.580 -14.235
  469    HB   VAL  54           HB       VAL  54  16.041 -10.713 -12.970
  470   HG11  VAL  54          HG11      VAL  54  15.581 -10.324 -10.612
  471   HG12  VAL  54          HG12      VAL  54  14.069 -10.668 -11.446
  472   HG13  VAL  54          HG13      VAL  54  14.853 -11.925 -10.458
  473   HG21  VAL  54          HG21      VAL  54  17.671 -11.306 -11.250
  474   HG22  VAL  54          HG22      VAL  54  17.050 -12.964 -11.186
  475   HG23  VAL  54          HG23      VAL  54  17.827 -12.361 -12.654
  476    H    ILE  55           H        ILE  55  16.781 -14.339 -13.849
  477    HA   ILE  55           HA       ILE  55  15.303 -16.687 -12.786
  478    HB   ILE  55           HB       ILE  55  17.316 -16.452 -15.073
  479   HG12  ILE  55          HG12      ILE  55  15.505 -17.126 -16.631
  480   HG13  ILE  55          HG13      ILE  55  14.314 -16.871 -15.375
  481   HG21  ILE  55          HG21      ILE  55  16.693 -18.786 -15.581
  482   HG22  ILE  55          HG22      ILE  55  17.349 -18.632 -13.956
  483   HG23  ILE  55          HG23      ILE  55  15.594 -18.796 -14.183
  484   HD11  ILE  55          HD11      ILE  55  14.606 -14.477 -15.500
  485   HD12  ILE  55          HD12      ILE  55  16.108 -14.648 -16.439
  486   HD13  ILE  55          HD13      ILE  55  14.543 -15.071 -17.152
  487    H    PHE  56           H        PHE  56  16.553 -18.023 -11.445
  488    HA   PHE  56           HA       PHE  56  19.319 -17.113 -10.754
  489    HD1  PHE  56           HD2      PHE  56  15.546 -16.388  -9.803
  490    HD2  PHE  56           HD1      PHE  56  19.282 -15.541  -7.842
  491    HE1  PHE  56           HE2      PHE  56  14.835 -14.043  -9.436
  492    HE2  PHE  56           HE1      PHE  56  18.520 -13.219  -7.394
  493    HZ   PHE  56           HZ       PHE  56  16.302 -12.463  -8.233
  494    HB2  PHE  56           HB2      PHE  56  17.194 -18.257  -8.921
  495    HB3  PHE  56           HB3      PHE  56  18.809 -17.757  -8.459
  496    H    LYS  57           H        LYS  57  20.516 -18.969  -9.543
  497    HA   LYS  57           HA       LYS  57  20.606 -21.128 -11.442
  498    HB2  LYS  57           HB2      LYS  57  22.011 -21.000  -8.748
  499    HB3  LYS  57           HB3      LYS  57  22.418 -22.023 -10.132
  500    HG2  LYS  57           HG2      LYS  57  22.781 -19.843 -11.466
  501    HG3  LYS  57           HG3      LYS  57  22.671 -19.004  -9.906
  502    HD2  LYS  57           HD2      LYS  57  24.500 -20.755  -9.154
  503    HD3  LYS  57           HD3      LYS  57  24.783 -20.950 -10.886
  504    HE2  LYS  57           HE2      LYS  57  24.899 -18.371  -9.271
  505    HE3  LYS  57           HE3      LYS  57  26.301 -19.287  -9.825
  506    HZ1  LYS  57           HZ1      LYS  57  25.658 -18.725 -12.109
  507    HZ2  LYS  57           HZ2      LYS  57  24.360 -17.848 -11.550
  508    HZ3  LYS  57           HZ3      LYS  57  25.848 -17.373 -11.180
  509    H    GLU  58           H        GLU  58  18.957 -20.818  -8.315
  510    HA   GLU  58           HA       GLU  58  17.869 -23.543  -8.602
  511    HB2  GLU  58           HB2      GLU  58  19.342 -22.527  -6.123
  512    HB3  GLU  58           HB3      GLU  58  18.322 -23.965  -6.172
  513    HG2  GLU  58           HG2      GLU  58  19.843 -24.956  -7.897
  514    HG3  GLU  58           HG3      GLU  58  20.912 -23.559  -7.720
  515    H    ILE  59           H        ILE  59  15.910 -23.806  -7.385
  516    HA   ILE  59           HA       ILE  59  14.272 -21.501  -7.258
  517    HB   ILE  59           HB       ILE  59  12.563 -22.934  -6.372
  518   HG12  ILE  59          HG12      ILE  59  14.708 -25.049  -5.876
  519   HG13  ILE  59          HG13      ILE  59  13.774 -24.193  -4.648
  520   HG21  ILE  59          HG21      ILE  59  14.107 -24.644  -8.344
  521   HG22  ILE  59          HG22      ILE  59  12.349 -24.447  -8.161
  522   HG23  ILE  59          HG23      ILE  59  13.324 -23.119  -8.789
  523   HD11  ILE  59          HD11      ILE  59  12.700 -26.221  -6.635
  524   HD12  ILE  59          HD12      ILE  59  12.843 -26.377  -4.878
  525   HD13  ILE  59          HD13      ILE  59  11.678 -25.227  -5.565
  526    H    GLY  60           H        GLY  60  16.198 -23.092  -4.713
  527    HA2  GLY  60           HA2      GLY  60  14.958 -21.769  -2.496
  528    HA3  GLY  60           HA3      GLY  60  16.574 -22.508  -2.524
  529    H    SER  61           H        SER  61  17.894 -21.026  -4.470
  530    HA   SER  61           HA       SER  61  18.628 -18.634  -3.170
  531    HG   SER  61           HG       SER  61  20.945 -20.305  -5.333
  532    HB2  SER  61           HB2      SER  61  18.960 -19.368  -6.116
  533    HB3  SER  61           HB3      SER  61  19.965 -18.257  -5.174
  534    H    ALA  62           H        ALA  62  16.449 -19.208  -5.996
  535    HA   ALA  62           HA       ALA  62  15.808 -16.492  -6.493
  536    HB1  ALA  62           HB1      ALA  62  13.786 -17.437  -7.584
  537    HB2  ALA  62           HB2      ALA  62  15.233 -18.350  -8.036
  538    HB3  ALA  62           HB3      ALA  62  14.124 -19.007  -6.828
  539    H    SER  63           H        SER  63  14.158 -18.913  -4.351
  540    HA   SER  63           HA       SER  63  12.117 -17.158  -3.496
  541    HG   SER  63           HG       SER  63  10.594 -18.703  -2.544
  542    HB2  SER  63           HB2      SER  63  12.480 -19.769  -3.172
  543    HB3  SER  63           HB3      SER  63  13.249 -19.284  -1.664
  544    H    ASN  64           H        ASN  64  15.341 -17.836  -2.101
  545    HA   ASN  64           HA       ASN  64  14.979 -16.223   0.207
  546    HB2  ASN  64           HB2      ASN  64  16.763 -17.952  -0.048
  547    HB3  ASN  64           HB3      ASN  64  17.595 -16.894  -1.193
  548   HD21  ASN  64          HD22      ASN  64  19.199 -15.667  -0.235
  549   HD22  ASN  64          HD21      ASN  64  19.202 -15.145   1.444
  550    H    ALA  65           H        ALA  65  16.379 -15.446  -2.996
  551    HA   ALA  65           HA       ALA  65  17.023 -12.738  -2.533
  552    HB1  ALA  65           HB1      ALA  65  16.861 -12.511  -4.955
  553    HB2  ALA  65           HB2      ALA  65  17.661 -14.039  -4.571
  554    HB3  ALA  65           HB3      ALA  65  15.962 -14.028  -5.106
  555    H    LEU  66           H        LEU  66  14.002 -14.171  -3.868
  556    HA   LEU  66           HA       LEU  66  12.495 -11.852  -4.175
  557    HG   LEU  66           HG       LEU  66  10.297 -12.666  -5.342
  558    HB2  LEU  66           HB2      LEU  66  12.024 -14.278  -4.851
  559    HB3  LEU  66           HB3      LEU  66  11.411 -14.551  -3.240
  560   HD11  LEU  66          HD11      LEU  66   8.389 -14.272  -5.310
  561   HD12  LEU  66          HD12      LEU  66   9.905 -15.032  -5.809
  562   HD13  LEU  66          HD13      LEU  66   9.284 -15.290  -4.167
  563   HD21  LEU  66          HD21      LEU  66   9.765 -11.660  -3.176
  564   HD22  LEU  66          HD22      LEU  66   8.325 -12.389  -3.850
  565   HD23  LEU  66          HD23      LEU  66   9.212 -13.234  -2.556
  566    H    ARG  67           H        ARG  67  12.461 -14.054  -1.311
  567    HA   ARG  67           HA       ARG  67  10.636 -12.316   0.068
  568    HE   ARG  67           HE       ARG  67   9.633 -16.494   2.296
  569    HB2  ARG  67           HB2      ARG  67  12.234 -14.782   0.880
  570    HB3  ARG  67           HB3      ARG  67  11.111 -13.980   1.986
  571    HG2  ARG  67           HG2      ARG  67   9.225 -14.619   0.828
  572    HG3  ARG  67           HG3      ARG  67  10.010 -14.571  -0.737
  573    HD2  ARG  67           HD2      ARG  67   9.524 -16.827  -0.430
  574    HD3  ARG  67           HD3      ARG  67  11.255 -16.694  -0.130
  575   HH11  ARG  67          HH21      ARG  67  10.991 -18.894   0.008
  576   HH12  ARG  67          HH22      ARG  67  11.065 -20.137   1.212
  577   HH21  ARG  67          HH11      ARG  67   9.645 -18.057   3.741
  578   HH22  ARG  67          HH12      ARG  67  10.263 -19.671   3.438
  579    H    THR  68           H        THR  68  14.212 -12.480   0.111
  580    HA   THR  68           HA       THR  68  14.414 -10.749   2.428
  581    HB   THR  68           HB       THR  68  16.401 -11.179   0.153
  582    HG1  THR  68           HG1      THR  68  16.059 -13.102   1.032
  583   HG21  THR  68          HG21      THR  68  18.082 -10.590   1.916
  584   HG22  THR  68          HG22      THR  68  17.029  -9.237   1.497
  585   HG23  THR  68          HG23      THR  68  16.754 -10.138   3.004
  586    H    MET  69           H        MET  69  14.220 -10.216  -1.130
  587    HA   MET  69           HA       MET  69  14.677  -7.354  -0.770
  588    HB2  MET  69           HB2      MET  69  14.229  -9.071  -3.239
  589    HB3  MET  69           HB3      MET  69  14.632  -7.361  -3.258
  590    HG2  MET  69           HG2      MET  69  16.363  -9.578  -2.079
  591    HG3  MET  69           HG3      MET  69  16.640  -8.770  -3.601
  592    HE1  MET  69           HE1      MET  69  17.627  -6.254  -3.837
  593    HE2  MET  69           HE2      MET  69  16.120  -5.724  -3.058
  594    HE3  MET  69           HE3      MET  69  17.690  -5.140  -2.464
  595    H    GLN  70           H        GLN  70  11.863  -9.327  -0.870
  596    HA   GLN  70           HA       GLN  70   9.961  -7.675  -2.018
  597    HB2  GLN  70           HB2      GLN  70   9.646 -10.004  -1.115
  598    HB3  GLN  70           HB3      GLN  70   9.761  -9.371   0.521
  599    HG2  GLN  70           HG2      GLN  70   7.499  -9.810   0.081
  600    HG3  GLN  70           HG3      GLN  70   7.641  -8.051   0.071
  601   HE21  GLN  70          HE22      GLN  70   6.206 -10.621  -1.564
  602   HE22  GLN  70          HE21      GLN  70   6.160  -9.974  -3.184
  603    H    GLY  71           H        GLY  71   9.271  -5.633  -1.625
  604    HA2  GLY  71           HA2      GLY  71   8.758  -3.703  -0.548
  605    HA3  GLY  71           HA3      GLY  71   8.970  -4.523   1.001
  606    H    PHE  72           H        PHE  72  11.871  -4.852  -0.833
  607    HA   PHE  72           HA       PHE  72  13.308  -3.110   0.958
  608    HD1  PHE  72           HD2      PHE  72  15.875  -4.301   1.643
  609    HD2  PHE  72           HD1      PHE  72  15.828  -2.900  -2.433
  610    HE1  PHE  72           HE2      PHE  72  18.151  -3.354   1.940
  611    HE2  PHE  72           HE1      PHE  72  18.104  -1.942  -2.129
  612    HZ   PHE  72           HZ       PHE  72  19.267  -2.170   0.057
  613    HB2  PHE  72           HB2      PHE  72  14.242  -5.163  -0.057
  614    HB3  PHE  72           HB3      PHE  72  14.145  -4.428  -1.656
  615    HA   PRO  73           HA       PRO  73  12.955   0.564  -1.716
  616    HB2  PRO  73           HB2      PRO  73  14.670   2.280  -0.537
  617    HB3  PRO  73           HB3      PRO  73  13.136   1.767   0.226
  618    HG2  PRO  73           HG2      PRO  73  15.917   0.657   0.750
  619    HG3  PRO  73           HG3      PRO  73  14.695   1.186   1.948
  620    HD2  PRO  73           HD2      PRO  73  15.015  -1.436   1.186
  621    HD3  PRO  73           HD3      PRO  73  13.426  -0.763   1.652
  622    H    PHE  74           H        PHE  74  13.796  -0.803  -3.456
  623    HA   PHE  74           HA       PHE  74  16.594  -1.213  -3.968
  624    HD1  PHE  74           HD1      PHE  74  17.127  -3.412  -5.045
  625    HD2  PHE  74           HD2      PHE  74  14.861  -1.451  -8.151
  626    HE1  PHE  74           HE1      PHE  74  18.390  -4.669  -6.772
  627    HE2  PHE  74           HE2      PHE  74  16.162  -2.678  -9.864
  628    HZ   PHE  74           HZ       PHE  74  17.880  -4.335  -9.182
  629    HB2  PHE  74           HB2      PHE  74  14.641  -2.473  -4.837
  630    HB3  PHE  74           HB3      PHE  74  14.230  -1.136  -5.895
  631    H    TYR  75           H        TYR  75  14.275   1.255  -4.825
  632    HA   TYR  75           HA       TYR  75  16.265   3.304  -5.194
  633    HD1  TYR  75           HD2      TYR  75  17.490   4.571  -7.258
  634    HD2  TYR  75           HD1      TYR  75  15.901   0.751  -8.489
  635    HE1  TYR  75           HE2      TYR  75  19.602   4.084  -8.441
  636    HE2  TYR  75           HE1      TYR  75  18.032   0.241  -9.660
  637    HH   TYR  75           HH       TYR  75  20.770   2.576  -9.758
  638    HB2  TYR  75           HB2      TYR  75  14.436   2.418  -7.472
  639    HB3  TYR  75           HB3      TYR  75  15.014   4.068  -7.356
  640    H    ASP  76           H        ASP  76  14.170   5.150  -6.114
  641    HA   ASP  76           HA       ASP  76  12.897   5.828  -3.694
  642    HB2  ASP  76           HB2      ASP  76  11.827   7.565  -5.003
  643    HB3  ASP  76           HB3      ASP  76  13.500   7.395  -5.513
  644    H    LYS  77           H        LYS  77  12.084   3.069  -5.194
  645    HA   LYS  77           HA       LYS  77   9.240   3.299  -4.476
  646    HB2  LYS  77           HB2      LYS  77  10.341   2.410  -7.125
  647    HB3  LYS  77           HB3      LYS  77   9.046   1.453  -6.411
  648    HG2  LYS  77           HG2      LYS  77   7.579   3.371  -6.240
  649    HG3  LYS  77           HG3      LYS  77   8.841   4.455  -6.860
  650    HD2  LYS  77           HD2      LYS  77   8.837   3.406  -9.003
  651    HD3  LYS  77           HD3      LYS  77   7.865   2.051  -8.462
  652    HE2  LYS  77           HE2      LYS  77   6.863   4.931  -8.596
  653    HE3  LYS  77           HE3      LYS  77   6.662   3.738  -9.884
  654    HZ1  LYS  77           HZ1      LYS  77   5.467   2.328  -8.245
  655    HZ2  LYS  77           HZ2      LYS  77   5.485   3.581  -7.181
  656    HZ3  LYS  77           HZ3      LYS  77   4.699   3.734  -8.597
  657    HA   PRO  78           HA       PRO  78  10.773  -0.316  -2.147
  658    HB2  PRO  78           HB2      PRO  78   7.804  -0.676  -1.759
  659    HB3  PRO  78           HB3      PRO  78   9.117  -0.780  -0.548
  660    HG2  PRO  78           HG2      PRO  78   7.529   1.418  -0.676
  661    HG3  PRO  78           HG3      PRO  78   9.297   1.590  -0.423
  662    HD2  PRO  78           HD2      PRO  78   7.734   1.905  -2.997
  663    HD3  PRO  78           HD3      PRO  78   9.039   2.932  -2.327
  664    H    MET  79           H        MET  79  11.034  -2.450  -2.939
  665    HA   MET  79           HA       MET  79   9.989  -3.093  -5.523
  666    HB2  MET  79           HB2      MET  79  11.119  -5.038  -3.468
  667    HB3  MET  79           HB3      MET  79  10.966  -5.295  -5.211
  668    HG2  MET  79           HG2      MET  79  12.474  -3.225  -5.487
  669    HG3  MET  79           HG3      MET  79  12.794  -3.376  -3.769
  670    HE1  MET  79           HE1      MET  79  12.802  -5.731  -7.049
  671    HE2  MET  79           HE2      MET  79  13.749  -4.227  -7.205
  672    HE3  MET  79           HE3      MET  79  14.576  -5.789  -7.159
  673    H    GLN  80           H        GLN  80   8.493  -4.700  -6.146
  674    HA   GLN  80           HA       GLN  80   6.799  -5.997  -4.111
  675    HB2  GLN  80           HB2      GLN  80   5.794  -4.529  -6.599
  676    HB3  GLN  80           HB3      GLN  80   4.822  -5.627  -5.625
  677    HG2  GLN  80           HG2      GLN  80   6.053  -3.045  -4.545
  678    HG3  GLN  80           HG3      GLN  80   4.429  -3.177  -5.199
  679   HE21  GLN  80          HE22      GLN  80   6.531  -4.223  -2.490
  680   HE22  GLN  80          HE21      GLN  80   5.208  -4.661  -1.426
  681    H    ILE  81           H        ILE  81   7.047  -8.122  -4.546
  682    HA   ILE  81           HA       ILE  81   7.869  -8.946  -7.271
  683    HB   ILE  81           HB       ILE  81   9.166 -10.105  -4.803
  684   HG12  ILE  81          HG12      ILE  81  10.164  -7.575  -6.162
  685   HG13  ILE  81          HG13      ILE  81   9.629  -7.753  -4.482
  686   HG21  ILE  81          HG21      ILE  81   9.446 -11.244  -7.002
  687   HG22  ILE  81          HG22      ILE  81  10.108  -9.756  -7.681
  688   HG23  ILE  81          HG23      ILE  81  10.976 -10.637  -6.412
  689   HD11  ILE  81          HD11      ILE  81  11.522  -9.342  -4.080
  690   HD12  ILE  81          HD12      ILE  81  12.156  -8.898  -5.687
  691   HD13  ILE  81          HD13      ILE  81  11.987  -7.666  -4.433
  692    H    ALA  82           H        ALA  82   7.438 -11.165  -7.751
  693    HA   ALA  82           HA       ALA  82   6.160 -12.908  -5.786
  694    HB1  ALA  82           HB1      ALA  82   4.216 -11.701  -6.810
  695    HB2  ALA  82           HB2      ALA  82   4.767 -12.219  -8.423
  696    HB3  ALA  82           HB3      ALA  82   4.233 -13.420  -7.225
  697    H    TYR  83           H        TYR  83   5.898 -15.172  -6.959
  698    HA   TYR  83           HA       TYR  83   8.322 -15.762  -8.505
  699    HD1  TYR  83           HD1      TYR  83   4.758 -18.136  -9.185
  700    HD2  TYR  83           HD2      TYR  83   6.197 -17.106  -5.260
  701    HE1  TYR  83           HE1      TYR  83   2.500 -18.563  -8.261
  702    HE2  TYR  83           HE2      TYR  83   3.927 -17.496  -4.321
  703    HH   TYR  83           HH       TYR  83   1.734 -18.135  -4.774
  704    HB2  TYR  83           HB2      TYR  83   7.205 -18.050  -8.650
  705    HB3  TYR  83           HB3      TYR  83   7.746 -17.501  -7.074
  706    H    SER  84           H        SER  84   8.323 -16.272 -10.791
  707    HA   SER  84           HA       SER  84   6.728 -14.498 -12.246
  708    HG   SER  84           HG       SER  84   8.915 -17.460 -13.886
  709    HB2  SER  84           HB2      SER  84   7.729 -15.708 -14.242
  710    HB3  SER  84           HB3      SER  84   8.888 -15.102 -13.041
  711    H    LYS  85           H        LYS  85   6.123 -17.924 -11.609
  712    HA   LYS  85           HA       LYS  85   4.210 -18.421 -13.578
  713    HB2  LYS  85           HB2      LYS  85   5.309 -20.001 -11.879
  714    HB3  LYS  85           HB3      LYS  85   4.009 -19.546 -10.767
  715    HG2  LYS  85           HG2      LYS  85   2.329 -20.364 -12.390
  716    HG3  LYS  85           HG3      LYS  85   3.610 -20.767 -13.539
  717    HD2  LYS  85           HD2      LYS  85   3.270 -21.996 -10.765
  718    HD3  LYS  85           HD3      LYS  85   2.716 -22.721 -12.280
  719    HE2  LYS  85           HE2      LYS  85   5.066 -22.754 -13.120
  720    HE3  LYS  85           HE3      LYS  85   5.620 -22.095 -11.575
  721    HZ1  LYS  85           HZ1      LYS  85   4.761 -24.094 -10.493
  722    HZ2  LYS  85           HZ2      LYS  85   4.260 -24.704 -11.925
  723    HZ3  LYS  85           HZ3      LYS  85   5.848 -24.490 -11.639
  724    H    SER  86           H        SER  86   3.895 -16.194 -10.947
  725    HA   SER  86           HA       SER  86   1.082 -16.180 -10.585
  726    HG   SER  86           HG       SER  86   3.890 -15.289  -9.111
  727    HB2  SER  86           HB2      SER  86   3.003 -13.825 -10.400
  728    HB3  SER  86           HB3      SER  86   1.436 -14.005  -9.593
  729    H    ASP  87           H        ASP  87   2.945 -15.152 -13.419
  730    HA   ASP  87           HA       ASP  87   0.572 -13.598 -14.361
  731    HB2  ASP  87           HB2      ASP  87   2.274 -12.029 -13.685
  732    HB3  ASP  87           HB3      ASP  87   3.493 -12.857 -14.648
  733    H    SER  88           H        SER  88  -0.358 -14.520 -15.965
  734    HA   SER  88           HA       SER  88   0.598 -16.717 -17.328
  735    HG   SER  88           HG       SER  88  -2.929 -15.951 -16.909
  736    HB2  SER  88           HB2      SER  88  -1.533 -14.794 -18.317
  737    HB3  SER  88           HB3      SER  88  -1.445 -16.546 -18.566
  738    H    ASP  89           H        ASP  89   1.275 -13.306 -18.115
  739    HA   ASP  89           HA       ASP  89   1.500 -13.904 -20.988
  740    HB2  ASP  89           HB2      ASP  89   0.505 -11.768 -20.239
  741    HB3  ASP  89           HB3      ASP  89   2.040 -11.324 -19.484
  742    H    ILE  90           H        ILE  90   3.637 -13.023 -18.240
  743    HA   ILE  90           HA       ILE  90   6.025 -13.383 -19.872
  744    HB   ILE  90           HB       ILE  90   7.333 -13.364 -17.890
  745   HG12  ILE  90          HG12      ILE  90   4.744 -13.595 -16.332
  746   HG13  ILE  90          HG13      ILE  90   6.064 -14.764 -16.376
  747   HG21  ILE  90          HG21      ILE  90   6.371 -11.259 -18.864
  748   HG22  ILE  90          HG22      ILE  90   5.125 -11.297 -17.595
  749   HG23  ILE  90          HG23      ILE  90   6.842 -11.123 -17.169
  750   HD11  ILE  90          HD11      ILE  90   7.562 -13.064 -15.304
  751   HD12  ILE  90          HD12      ILE  90   6.139 -11.997 -15.148
  752   HD13  ILE  90          HD13      ILE  90   6.170 -13.540 -14.304
  753    H    VAL  91           H        VAL  91   3.947 -15.575 -17.928
  754    HA   VAL  91           HA       VAL  91   5.623 -17.828 -18.208
  755    HB   VAL  91           HB       VAL  91   2.656 -17.485 -17.791
  756   HG11  VAL  91          HG11      VAL  91   2.867 -19.615 -19.074
  757   HG12  VAL  91          HG12      VAL  91   4.127 -20.162 -17.958
  758   HG13  VAL  91          HG13      VAL  91   2.462 -19.921 -17.382
  759   HG21  VAL  91          HG21      VAL  91   3.166 -18.358 -15.598
  760   HG22  VAL  91          HG22      VAL  91   4.837 -18.751 -16.071
  761   HG23  VAL  91          HG23      VAL  91   4.324 -17.064 -15.934
  762    H    ALA  92           H        ALA  92   3.106 -16.495 -20.466
  763    HA   ALA  92           HA       ALA  92   3.449 -18.467 -22.467
  764    HB1  ALA  92           HB1      ALA  92   2.730 -15.533 -22.866
  765    HB2  ALA  92           HB2      ALA  92   2.377 -16.889 -23.956
  766    HB3  ALA  92           HB3      ALA  92   1.584 -16.793 -22.384
  767    H    LYS  93           H        LYS  93   5.240 -15.369 -21.935
  768    HA   LYS  93           HA       LYS  93   6.893 -15.590 -24.243
  769    HB2  LYS  93           HB2      LYS  93   7.388 -14.285 -21.534
  770    HB3  LYS  93           HB3      LYS  93   8.555 -14.206 -22.831
  771    HG2  LYS  93           HG2      LYS  93   5.696 -13.164 -23.005
  772    HG3  LYS  93           HG3      LYS  93   7.109 -12.185 -22.652
  773    HD2  LYS  93           HD2      LYS  93   6.517 -13.660 -25.250
  774    HD3  LYS  93           HD3      LYS  93   6.431 -11.929 -24.990
  775    HE2  LYS  93           HE2      LYS  93   8.988 -13.597 -24.851
  776    HE3  LYS  93           HE3      LYS  93   8.453 -12.669 -26.248
  777    HZ1  LYS  93           HZ1      LYS  93   9.154 -11.492 -23.620
  778    HZ2  LYS  93           HZ2      LYS  93  10.057 -11.432 -24.973
  779    HZ3  LYS  93           HZ3      LYS  93   8.633 -10.650 -24.925
  780    H    ILE  94           H        ILE  94   7.556 -16.871 -20.886
  781    HA   ILE  94           HA       ILE  94  10.030 -17.999 -21.852
  782    HB   ILE  94           HB       ILE  94  10.289 -19.070 -19.727
  783   HG12  ILE  94          HG12      ILE  94   7.479 -18.155 -19.078
  784   HG13  ILE  94          HG13      ILE  94   7.990 -19.824 -19.301
  785   HG21  ILE  94          HG21      ILE  94  10.478 -17.071 -18.383
  786   HG22  ILE  94          HG22      ILE  94  10.786 -16.629 -20.061
  787   HG23  ILE  94          HG23      ILE  94   9.220 -16.243 -19.319
  788   HD11  ILE  94          HD11      ILE  94   9.507 -19.578 -17.315
  789   HD12  ILE  94          HD12      ILE  94   8.804 -17.963 -17.036
  790   HD13  ILE  94          HD13      ILE  94   7.779 -19.402 -16.945
  791    H    LYS  95           H        LYS  95   6.722 -19.274 -21.752
  792    HA   LYS  95           HA       LYS  95   7.406 -21.984 -22.430
  793    HB2  LYS  95           HB2      LYS  95   4.983 -20.221 -22.952
  794    HB3  LYS  95           HB3      LYS  95   5.110 -21.785 -23.726
  795    HG2  LYS  95           HG2      LYS  95   5.156 -21.367 -20.705
  796    HG3  LYS  95           HG3      LYS  95   3.756 -21.821 -21.677
  797    HD2  LYS  95           HD2      LYS  95   5.303 -23.816 -22.501
  798    HD3  LYS  95           HD3      LYS  95   6.257 -23.427 -21.072
  799    HE2  LYS  95           HE2      LYS  95   4.750 -25.218 -20.531
  800    HE3  LYS  95           HE3      LYS  95   4.226 -23.781 -19.644
  801    HZ1  LYS  95           HZ1      LYS  95   3.024 -24.592 -22.226
  802    HZ2  LYS  95           HZ2      LYS  95   2.415 -25.096 -20.805
  803    HZ3  LYS  95           HZ3      LYS  95   2.427 -23.504 -21.132
  804    H    GLY  96           H        GLY  96   6.987 -19.022 -24.427
  805    HA2  GLY  96           HA2      GLY  96   9.118 -19.247 -25.980
  806    HA3  GLY  96           HA3      GLY  96   8.068 -20.413 -26.798
  807    H    THR  97           H        THR  97   5.597 -18.674 -26.093
  808    HA   THR  97           HA       THR  97   5.980 -16.497 -28.063
  809    HB   THR  97           HB       THR  97   3.884 -18.670 -28.459
  810    HG1  THR  97           HG1      THR  97   5.778 -19.740 -28.779
  811   HG21  THR  97          HG21      THR  97   3.796 -17.789 -30.761
  812   HG22  THR  97          HG22      THR  97   3.506 -16.484 -29.605
  813   HG23  THR  97          HG23      THR  97   5.089 -16.626 -30.390
  814    H    PHE  98           H        PHE  98   4.811 -14.763 -27.291
  815    HA   PHE  98           HA       PHE  98   3.108 -14.902 -25.038
  816    HD1  PHE  98           HD1      PHE  98   1.156 -12.219 -27.667
  817    HD2  PHE  98           HD2      PHE  98   5.459 -12.599 -27.761
  818    HE1  PHE  98           HE1      PHE  98   1.193 -11.301 -29.968
  819    HE2  PHE  98           HE2      PHE  98   5.483 -11.682 -30.062
  820    HZ   PHE  98           HZ       PHE  98   3.353 -11.035 -31.175
  821    HB2  PHE  98           HB2      PHE  98   2.485 -12.600 -25.585
  822    HB3  PHE  98           HB3      PHE  98   4.213 -12.850 -25.650
  823    H    LYS  99           H        LYS  99   2.370 -15.192 -28.477
  824    HA   LYS  99           HA       LYS  99  -0.460 -14.888 -28.298
  825    HB2  LYS  99           HB2      LYS  99   0.988 -14.683 -30.356
  826    HB3  LYS  99           HB3      LYS  99   1.180 -16.443 -30.345
  827    HG2  LYS  99           HG2      LYS  99  -1.289 -16.694 -30.653
  828    HG3  LYS  99           HG3      LYS  99  -1.459 -14.934 -30.611
  829    HD2  LYS  99           HD2      LYS  99  -1.533 -15.674 -32.900
  830    HD3  LYS  99           HD3      LYS  99  -0.025 -14.779 -32.656
  831    HE2  LYS  99           HE2      LYS  99   1.214 -16.929 -32.435
  832    HE3  LYS  99           HE3      LYS  99  -0.296 -17.826 -32.610
  833    HZ1  LYS  99           HZ1      LYS  99  -0.495 -16.922 -34.856
  834    HZ2  LYS  99           HZ2      LYS  99   0.901 -16.087 -34.693
  835    HZ3  LYS  99           HZ3      LYS  99   0.916 -17.716 -34.692
  836    H    GLU 100           H        GLU 100   1.639 -17.668 -27.625
  837    HA   GLU 100           HA       GLU 100  -0.378 -19.676 -28.162
  838    HB2  GLU 100           HB2      GLU 100   2.033 -20.105 -28.390
  839    HB3  GLU 100           HB3      GLU 100   2.284 -19.773 -26.674
  840    HG2  GLU 100           HG2      GLU 100   2.314 -22.168 -27.119
  841    HG3  GLU 100           HG3      GLU 100   0.978 -21.751 -26.058
  842    H    ARG 101           H        ARG 101  -1.494 -20.930 -26.569
  843    HA   ARG 101           HA       ARG 101  -2.492 -19.404 -24.318
  844    HE   ARG 101           HE       ARG 101  -6.117 -21.132 -24.892
  845    HB2  ARG 101           HB2      ARG 101  -3.879 -21.026 -25.540
  846    HB3  ARG 101           HB3      ARG 101  -2.814 -22.343 -25.041
  847    HG2  ARG 101           HG2      ARG 101  -3.392 -21.917 -22.657
  848    HG3  ARG 101           HG3      ARG 101  -4.448 -20.586 -23.144
  849    HD2  ARG 101           HD2      ARG 101  -4.786 -23.507 -23.957
  850    HD3  ARG 101           HD3      ARG 101  -5.659 -22.704 -22.641
  851   HH11  ARG 101          HH11      ARG 101  -6.839 -24.463 -23.898
  852   HH12  ARG 101          HH12      ARG 101  -8.258 -24.596 -24.866
  853   HH21  ARG 101          HH21      ARG 101  -8.005 -21.311 -26.193
  854   HH22  ARG 101          HH22      ARG 101  -8.936 -22.758 -26.193
  855    HA   PRO 102           HA       PRO 102   1.226 -20.386 -22.141
  856    HB2  PRO 102           HB2      PRO 102   0.582 -19.425 -19.573
  857    HB3  PRO 102           HB3      PRO 102   1.181 -18.458 -20.942
  858    HG2  PRO 102           HG2      PRO 102  -1.649 -18.824 -19.976
  859    HG3  PRO 102           HG3      PRO 102  -0.865 -17.345 -20.614
  860    HD2  PRO 102           HD2      PRO 102  -2.537 -18.890 -22.117
  861    HD3  PRO 102           HD3      PRO 102  -1.142 -18.022 -22.823
  862    H    LYS 103           H        LYS 103  -1.842 -21.303 -20.558
  863    HA   LYS 103           HA       LYS 103  -0.461 -23.158 -18.793
  864    HB2  LYS 103           HB2      LYS 103  -3.425 -22.466 -19.072
  865    HB3  LYS 103           HB3      LYS 103  -2.740 -23.488 -17.803
  866    HG2  LYS 103           HG2      LYS 103  -1.350 -21.612 -16.987
  867    HG3  LYS 103           HG3      LYS 103  -2.002 -20.566 -18.250
  868    HD2  LYS 103           HD2      LYS 103  -3.135 -20.068 -16.200
  869    HD3  LYS 103           HD3      LYS 103  -4.284 -20.831 -17.309
  870    HE2  LYS 103           HE2      LYS 103  -3.993 -22.997 -16.120
  871    HE3  LYS 103           HE3      LYS 103  -2.803 -22.253 -15.044
  872    HZ1  LYS 103           HZ1      LYS 103  -4.985 -22.354 -14.024
  873    HZ2  LYS 103           HZ2      LYS 103  -4.560 -20.796 -14.221
  874    HZ3  LYS 103           HZ3      LYS 103  -5.660 -21.480 -15.220
  875    H    LYS 104           H        LYS 104  -0.547 -23.765 -21.676
  876    HA   LYS 104           HA       LYS 104  -2.022 -26.291 -21.939
  877    HB2  LYS 104           HB2      LYS 104   0.155 -24.918 -23.560
  878    HB3  LYS 104           HB3      LYS 104  -0.266 -26.615 -23.835
  879    HG2  LYS 104           HG2      LYS 104  -2.596 -26.054 -24.269
  880    HG3  LYS 104           HG3      LYS 104  -2.297 -24.346 -23.911
  881    HD2  LYS 104           HD2      LYS 104  -0.840 -24.125 -25.839
  882    HD3  LYS 104           HD3      LYS 104  -0.903 -25.874 -26.154
  883    HE2  LYS 104           HE2      LYS 104  -3.302 -25.759 -26.632
  884    HE3  LYS 104           HE3      LYS 104  -3.344 -24.045 -26.203
  885    HZ1  LYS 104           HZ1      LYS 104  -1.875 -23.587 -28.064
  886    HZ2  LYS 104           HZ2      LYS 104  -1.843 -25.175 -28.488
  887    HZ3  LYS 104           HZ3      LYS 104  -3.238 -24.335 -28.587
  Start of MODEL   12
    1    HA   MET   1           HA       MET   1   2.425 -19.766   3.125
    2    H1   MET   1           H1       MET   1   1.275 -17.832   3.894
    3    H2   MET   1           H2       MET   1   0.317 -17.803   2.570
    4    H3   MET   1           H3       MET   1   0.202 -19.044   3.638
    5    HB2  MET   1           HB2      MET   1   0.557 -20.776   1.886
    6    HB3  MET   1           HB3      MET   1   0.637 -19.498   0.668
    7    HG2  MET   1           HG2      MET   1   1.714 -21.578  -0.076
    8    HG3  MET   1           HG3      MET   1   2.839 -20.233  -0.036
    9    HE1  MET   1           HE1      MET   1   5.221 -23.203   0.725
   10    HE2  MET   1           HE2      MET   1   3.871 -23.115  -0.429
   11    HE3  MET   1           HE3      MET   1   4.962 -21.724  -0.224
   12    H    GLU   2           H        GLU   2   4.418 -18.927   2.821
   13    HA   GLU   2           HA       GLU   2   4.850 -16.370   1.522
   14    HB2  GLU   2           HB2      GLU   2   7.180 -16.739   2.035
   15    HB3  GLU   2           HB3      GLU   2   6.178 -17.113   3.436
   16    HG2  GLU   2           HG2      GLU   2   6.351 -19.587   2.731
   17    HG3  GLU   2           HG3      GLU   2   7.599 -19.072   1.592
   18    H    MET   3           H        MET   3   6.431 -16.152  -0.328
   19    HA   MET   3           HA       MET   3   5.194 -17.301  -2.550
   20    HB2  MET   3           HB2      MET   3   7.819 -15.790  -2.247
   21    HB3  MET   3           HB3      MET   3   7.161 -16.283  -3.802
   22    HG2  MET   3           HG2      MET   3   6.526 -13.998  -3.406
   23    HG3  MET   3           HG3      MET   3   5.111 -15.023  -3.424
   24    HE1  MET   3           HE1      MET   3   7.446 -12.711  -1.135
   25    HE2  MET   3           HE2      MET   3   6.776 -13.065   0.468
   26    HE3  MET   3           HE3      MET   3   7.658 -14.324  -0.419
   27    H    LEU   4           H        LEU   4   5.506 -19.062  -3.795
   28    HA   LEU   4           HA       LEU   4   6.879 -21.250  -2.640
   29    HG   LEU   4           HG       LEU   4   4.981 -22.753  -2.908
   30    HB2  LEU   4           HB2      LEU   4   5.412 -20.840  -5.259
   31    HB3  LEU   4           HB3      LEU   4   6.309 -22.316  -4.948
   32   HD11  LEU   4          HD11      LEU   4   4.180 -20.524  -2.290
   33   HD12  LEU   4          HD12      LEU   4   3.290 -20.383  -3.825
   34   HD13  LEU   4          HD13      LEU   4   2.805 -21.577  -2.605
   35   HD21  LEU   4          HD21      LEU   4   4.411 -23.771  -5.078
   36   HD22  LEU   4          HD22      LEU   4   2.957 -23.471  -4.117
   37   HD23  LEU   4          HD23      LEU   4   3.365 -22.388  -5.467
   38    HA   PRO   5           HA       PRO   5  10.924 -20.788  -4.653
   39    HB2  PRO   5           HB2      PRO   5  11.000 -23.754  -4.123
   40    HB3  PRO   5           HB3      PRO   5  12.266 -22.524  -3.847
   41    HG2  PRO   5           HG2      PRO   5  10.798 -23.445  -1.772
   42    HG3  PRO   5           HG3      PRO   5  11.156 -21.691  -1.912
   43    HD2  PRO   5           HD2      PRO   5   8.617 -23.156  -2.685
   44    HD3  PRO   5           HD3      PRO   5   8.816 -21.613  -1.796
   45    H    ASN   6           H        ASN   6  11.208 -20.637  -6.737
   46    HA   ASN   6           HA       ASN   6  11.314 -22.901  -8.450
   47    HB2  ASN   6           HB2      ASN   6   8.881 -22.238  -8.848
   48    HB3  ASN   6           HB3      ASN   6   9.473 -20.660  -9.407
   49   HD21  ASN   6          HD22      ASN   6   9.827 -20.618 -11.688
   50   HD22  ASN   6          HD21      ASN   6  10.395 -22.008 -12.610
   51    H    GLN   7           H        GLN   7  12.827 -22.230 -10.247
   52    HA   GLN   7           HA       GLN   7  14.582 -20.288  -9.145
   53    HB2  GLN   7           HB2      GLN   7  16.186 -20.980 -10.663
   54    HB3  GLN   7           HB3      GLN   7  15.284 -22.409 -10.200
   55    HG2  GLN   7           HG2      GLN   7  14.021 -22.293 -12.361
   56    HG3  GLN   7           HG3      GLN   7  14.981 -20.883 -12.830
   57   HE21  GLN   7          HE22      GLN   7  17.572 -21.357 -12.411
   58   HE22  GLN   7          HE21      GLN   7  18.082 -22.852 -13.161
   59    H    THR   8           H        THR   8  11.967 -19.128 -10.413
   60    HA   THR   8           HA       THR   8  13.297 -16.882 -11.760
   61    HB   THR   8           HB       THR   8  10.844 -18.256 -12.936
   62    HG1  THR   8           HG1      THR   8  12.631 -19.522 -13.327
   63   HG21  THR   8          HG21      THR   8  10.878 -15.865 -13.470
   64   HG22  THR   8          HG22      THR   8  12.574 -15.965 -13.968
   65   HG23  THR   8          HG23      THR   8  11.313 -16.793 -14.909
   66    H    ILE   9           H        ILE   9  12.195 -14.924 -11.392
   67    HA   ILE   9           HA       ILE   9   9.682 -14.990  -9.852
   68    HB   ILE   9           HB       ILE   9  10.414 -13.642  -8.094
   69   HG12  ILE   9          HG12      ILE   9  12.881 -13.018  -9.701
   70   HG13  ILE   9          HG13      ILE   9  11.601 -11.926  -9.200
   71   HG21  ILE   9          HG21      ILE   9  12.757 -15.541  -8.510
   72   HG22  ILE   9          HG22      ILE   9  12.247 -14.851  -6.985
   73   HG23  ILE   9          HG23      ILE   9  11.170 -15.968  -7.829
   74   HD11  ILE   9          HD11      ILE   9  13.712 -13.145  -7.392
   75   HD12  ILE   9          HD12      ILE   9  13.475 -11.445  -7.820
   76   HD13  ILE   9          HD13      ILE   9  12.294 -12.294  -6.794
   77    H    TYR  10           H        TYR  10   8.791 -12.731  -9.728
   78    HA   TYR  10           HA       TYR  10   9.253 -11.166 -12.225
   79    HD1  TYR  10           HD2      TYR  10   8.195 -10.296 -13.972
   80    HD2  TYR  10           HD1      TYR  10   4.601 -11.090 -11.721
   81    HE1  TYR  10           HE2      TYR  10   6.945  -8.778 -15.454
   82    HE2  TYR  10           HE1      TYR  10   3.326  -9.618 -13.239
   83    HH   TYR  10           HH       TYR  10   3.399  -8.287 -15.164
   84    HB2  TYR  10           HB2      TYR  10   7.340 -12.694 -12.485
   85    HB3  TYR  10           HB3      TYR  10   6.619 -12.071 -11.009
   86    H    ILE  11           H        ILE  11   9.747  -9.193 -11.681
   87    HA   ILE  11           HA       ILE  11   9.157  -8.087  -8.974
   88    HB   ILE  11           HB       ILE  11  11.216  -7.450 -11.146
   89   HG12  ILE  11          HG12      ILE  11  11.728  -8.372  -8.283
   90   HG13  ILE  11          HG13      ILE  11  11.540  -9.518  -9.605
   91   HG21  ILE  11          HG21      ILE  11  10.816  -6.057  -8.455
   92   HG22  ILE  11          HG22      ILE  11  12.142  -5.763  -9.606
   93   HG23  ILE  11          HG23      ILE  11  10.495  -5.353 -10.055
   94   HD11  ILE  11          HD11      ILE  11  13.474  -8.486 -10.778
   95   HD12  ILE  11          HD12      ILE  11  13.748  -7.457  -9.348
   96   HD13  ILE  11          HD13      ILE  11  13.863  -9.227  -9.218
   97    H    ASN  12           H        ASN  12   7.559  -6.537  -8.953
   98    HA   ASN  12           HA       ASN  12   6.552  -5.590 -11.599
   99    HB2  ASN  12           HB2      ASN  12   5.417  -7.632 -10.420
  100    HB3  ASN  12           HB3      ASN  12   4.753  -6.430  -9.310
  101   HD21  ASN  12          HD22      ASN  12   5.185  -7.123 -12.823
  102   HD22  ASN  12          HD21      ASN  12   3.659  -6.441 -13.328
  103    H    ASN  13           H        ASN  13   8.010  -4.208  -9.129
  104    HA   ASN  13           HA       ASN  13   6.510  -1.776  -9.618
  105    HB2  ASN  13           HB2      ASN  13   5.569  -2.600  -7.439
  106    HB3  ASN  13           HB3      ASN  13   7.192  -2.473  -6.738
  107   HD21  ASN  13          HD21      ASN  13   6.883  -0.686  -5.308
  108   HD22  ASN  13          HD22      ASN  13   6.268   0.864  -5.842
  109    H    LEU  14           H        LEU  14   8.582  -2.281 -10.964
  110    HA   LEU  14           HA       LEU  14  11.120  -1.440  -9.755
  111    HG   LEU  14           HG       LEU  14  12.615  -3.043 -11.018
  112    HB2  LEU  14           HB2      LEU  14  10.369  -2.913 -11.991
  113    HB3  LEU  14           HB3      LEU  14  10.731  -1.346 -12.703
  114   HD11  LEU  14          HD11      LEU  14  13.695  -3.468 -13.218
  115   HD12  LEU  14          HD12      LEU  14  12.018  -4.007 -13.224
  116   HD13  LEU  14          HD13      LEU  14  12.465  -2.485 -14.028
  117   HD21  LEU  14          HD21      LEU  14  13.093  -0.417 -12.508
  118   HD22  LEU  14          HD22      LEU  14  13.345  -0.754 -10.768
  119   HD23  LEU  14          HD23      LEU  14  14.387  -1.495 -11.971
  120    H    ASN  15           H        ASN  15  12.156   0.610 -10.492
  121    HA   ASN  15           HA       ASN  15  10.195   2.804 -10.898
  122    HB2  ASN  15           HB2      ASN  15  11.908   2.940  -9.078
  123    HB3  ASN  15           HB3      ASN  15  13.175   2.971 -10.299
  124   HD21  ASN  15          HD22      ASN  15  12.417   5.028  -8.313
  125   HD22  ASN  15          HD21      ASN  15  11.935   6.458  -9.215
  126    H    GLU  16           H        GLU  16   9.713   3.111 -12.965
  127    HA   GLU  16           HA       GLU  16  10.897   1.973 -15.174
  128    HB2  GLU  16           HB2      GLU  16   9.257   4.525 -14.914
  129    HB3  GLU  16           HB3      GLU  16   9.664   3.797 -16.471
  130    HG2  GLU  16           HG2      GLU  16   8.473   1.757 -15.921
  131    HG3  GLU  16           HG3      GLU  16   8.148   2.326 -14.280
  132    H    LYS  17           H        LYS  17  11.934   5.003 -13.618
  133    HA   LYS  17           HA       LYS  17  13.219   6.108 -15.886
  134    HB2  LYS  17           HB2      LYS  17  14.086   7.734 -14.482
  135    HB3  LYS  17           HB3      LYS  17  12.542   7.278 -13.769
  136    HG2  LYS  17           HG2      LYS  17  13.952   5.709 -12.217
  137    HG3  LYS  17           HG3      LYS  17  15.360   6.596 -12.828
  138    HD2  LYS  17           HD2      LYS  17  14.266   8.740 -12.113
  139    HD3  LYS  17           HD3      LYS  17  12.915   7.798 -11.480
  140    HE2  LYS  17           HE2      LYS  17  14.245   8.267  -9.582
  141    HE3  LYS  17           HE3      LYS  17  14.567   6.574  -9.971
  142    HZ1  LYS  17           HZ1      LYS  17  16.650   7.322 -11.037
  143    HZ2  LYS  17           HZ2      LYS  17  16.313   8.878 -10.665
  144    HZ3  LYS  17           HZ3      LYS  17  16.599   7.805  -9.480
  145    H    ILE  18           H        ILE  18  14.237   3.500 -13.807
  146    HA   ILE  18           HA       ILE  18  17.083   3.903 -14.012
  147    HB   ILE  18           HB       ILE  18  15.439   1.416 -13.349
  148   HG12  ILE  18          HG12      ILE  18  14.862   3.190 -11.795
  149   HG13  ILE  18          HG13      ILE  18  15.819   1.970 -10.987
  150   HG21  ILE  18          HG21      ILE  18  17.464   0.667 -12.094
  151   HG22  ILE  18          HG22      ILE  18  17.706   0.747 -13.835
  152   HG23  ILE  18          HG23      ILE  18  18.370   2.025 -12.796
  153   HD11  ILE  18          HD11      ILE  18  16.860   4.681 -11.970
  154   HD12  ILE  18          HD12      ILE  18  16.415   4.286 -10.314
  155   HD13  ILE  18          HD13      ILE  18  17.801   3.473 -11.063
  156    H    LYS  19           H        LYS  19  18.472   3.326 -15.625
  157    HA   LYS  19           HA       LYS  19  17.436   2.456 -18.182
  158    HB2  LYS  19           HB2      LYS  19  20.236   2.615 -16.985
  159    HB3  LYS  19           HB3      LYS  19  19.973   2.014 -18.608
  160    HG2  LYS  19           HG2      LYS  19  19.041   4.773 -17.721
  161    HG3  LYS  19           HG3      LYS  19  20.646   4.451 -18.396
  162    HD2  LYS  19           HD2      LYS  19  19.612   3.491 -20.437
  163    HD3  LYS  19           HD3      LYS  19  18.003   3.903 -19.833
  164    HE2  LYS  19           HE2      LYS  19  20.255   5.890 -20.388
  165    HE3  LYS  19           HE3      LYS  19  18.921   5.536 -21.487
  166    HZ1  LYS  19           HZ1      LYS  19  18.623   6.741 -18.796
  167    HZ2  LYS  19           HZ2      LYS  19  18.481   7.520 -20.216
  168    HZ3  LYS  19           HZ3      LYS  19  17.386   6.388 -19.811
  169    H    LYS  20           H        LYS  20  17.724   0.395 -19.185
  170    HA   LYS  20           HA       LYS  20  17.286  -1.892 -17.485
  171    HB2  LYS  20           HB2      LYS  20  17.923  -1.454 -20.413
  172    HB3  LYS  20           HB3      LYS  20  17.883  -3.072 -19.745
  173    HG2  LYS  20           HG2      LYS  20  15.746  -2.386 -20.811
  174    HG3  LYS  20           HG3      LYS  20  15.594  -2.984 -19.169
  175    HD2  LYS  20           HD2      LYS  20  15.667   0.013 -19.559
  176    HD3  LYS  20           HD3      LYS  20  14.251  -0.859 -20.086
  177    HE2  LYS  20           HE2      LYS  20  13.836  -1.816 -17.921
  178    HE3  LYS  20           HE3      LYS  20  15.344  -1.174 -17.260
  179    HZ1  LYS  20           HZ1      LYS  20  13.281   0.663 -18.293
  180    HZ2  LYS  20           HZ2      LYS  20  13.177   0.066 -16.779
  181    HZ3  LYS  20           HZ3      LYS  20  14.473   0.968 -17.200
  182    H    GLU  21           H        GLU  21  20.188  -0.486 -18.951
  183    HA   GLU  21           HA       GLU  21  22.042  -2.513 -18.216
  184    HB2  GLU  21           HB2      GLU  21  22.463  -0.862 -19.861
  185    HB3  GLU  21           HB3      GLU  21  22.171   0.474 -18.748
  186    HG2  GLU  21           HG2      GLU  21  24.191  -0.064 -17.467
  187    HG3  GLU  21           HG3      GLU  21  24.464  -1.521 -18.436
  188    H    GLU  22           H        GLU  22  20.864   0.397 -16.422
  189    HA   GLU  22           HA       GLU  22  22.574  -0.003 -14.136
  190    HB2  GLU  22           HB2      GLU  22  19.960   1.488 -14.537
  191    HB3  GLU  22           HB3      GLU  22  20.857   1.502 -13.016
  192    HG2  GLU  22           HG2      GLU  22  22.775   2.542 -14.074
  193    HG3  GLU  22           HG3      GLU  22  22.026   2.455 -15.662
  194    H    LEU  23           H        LEU  23  19.242  -0.984 -14.965
  195    HA   LEU  23           HA       LEU  23  18.530  -2.316 -12.572
  196    HG   LEU  23           HG       LEU  23  15.622  -3.608 -14.791
  197    HB2  LEU  23           HB2      LEU  23  16.915  -1.760 -14.234
  198    HB3  LEU  23           HB3      LEU  23  17.775  -2.589 -15.499
  199   HD11  LEU  23          HD11      LEU  23  16.288  -5.883 -15.018
  200   HD12  LEU  23          HD12      LEU  23  17.233  -4.852 -16.108
  201   HD13  LEU  23          HD13      LEU  23  17.966  -5.490 -14.639
  202   HD21  LEU  23          HD21      LEU  23  15.503  -4.944 -12.763
  203   HD22  LEU  23          HD22      LEU  23  17.168  -4.529 -12.329
  204   HD23  LEU  23          HD23      LEU  23  15.923  -3.272 -12.332
  205    H    LYS  24           H        LYS  24  20.139  -3.640 -15.537
  206    HA   LYS  24           HA       LYS  24  20.503  -6.247 -14.512
  207    HB2  LYS  24           HB2      LYS  24  21.953  -4.605 -16.623
  208    HB3  LYS  24           HB3      LYS  24  22.513  -6.229 -16.190
  209    HG2  LYS  24           HG2      LYS  24  20.319  -7.187 -16.698
  210    HG3  LYS  24           HG3      LYS  24  19.674  -5.606 -17.124
  211    HD2  LYS  24           HD2      LYS  24  21.947  -7.054 -18.555
  212    HD3  LYS  24           HD3      LYS  24  20.256  -7.015 -19.075
  213    HE2  LYS  24           HE2      LYS  24  20.390  -4.518 -19.245
  214    HE3  LYS  24           HE3      LYS  24  22.112  -4.609 -18.836
  215    HZ1  LYS  24           HZ1      LYS  24  22.452  -5.935 -20.844
  216    HZ2  LYS  24           HZ2      LYS  24  20.867  -5.846 -21.228
  217    HZ3  LYS  24           HZ3      LYS  24  21.785  -4.501 -21.230
  218    H    LYS  25           H        LYS  25  22.773  -3.457 -14.388
  219    HA   LYS  25           HA       LYS  25  24.786  -4.799 -12.933
  220    HB2  LYS  25           HB2      LYS  25  25.115  -2.629 -14.056
  221    HB3  LYS  25           HB3      LYS  25  23.990  -1.851 -12.946
  222    HG2  LYS  25           HG2      LYS  25  26.283  -1.321 -12.363
  223    HG3  LYS  25           HG3      LYS  25  25.520  -2.226 -11.059
  224    HD2  LYS  25           HD2      LYS  25  26.675  -4.294 -11.789
  225    HD3  LYS  25           HD3      LYS  25  27.415  -3.428 -13.140
  226    HE2  LYS  25           HE2      LYS  25  27.815  -2.771 -10.180
  227    HE3  LYS  25           HE3      LYS  25  28.902  -3.780 -11.136
  228    HZ1  LYS  25           HZ1      LYS  25  29.340  -1.868 -12.562
  229    HZ2  LYS  25           HZ2      LYS  25  28.358  -0.916 -11.662
  230    HZ3  LYS  25           HZ3      LYS  25  29.718  -1.533 -11.016
  231    H    SER  26           H        SER  26  21.948  -2.939 -11.717
  232    HA   SER  26           HA       SER  26  22.670  -3.095  -8.992
  233    HG   SER  26           HG       SER  26  21.191  -1.222 -10.965
  234    HB2  SER  26           HB2      SER  26  19.902  -2.842 -10.225
  235    HB3  SER  26           HB3      SER  26  20.344  -2.447  -8.550
  236    H    LEU  27           H        LEU  27  20.538  -5.237 -10.926
  237    HA   LEU  27           HA       LEU  27  19.822  -7.010  -8.814
  238    HG   LEU  27           HG       LEU  27  18.208  -6.035 -10.894
  239    HB2  LEU  27           HB2      LEU  27  20.231  -7.413 -11.790
  240    HB3  LEU  27           HB3      LEU  27  19.655  -8.710 -10.750
  241   HD11  LEU  27          HD11      LEU  27  16.720  -7.163 -12.556
  242   HD12  LEU  27          HD12      LEU  27  18.381  -6.930 -13.127
  243   HD13  LEU  27          HD13      LEU  27  17.869  -8.532 -12.593
  244   HD21  LEU  27          HD21      LEU  27  17.571  -7.420  -8.994
  245   HD22  LEU  27          HD22      LEU  27  16.268  -7.417 -10.179
  246   HD23  LEU  27          HD23      LEU  27  17.334  -8.834 -10.046
  247    H    TYR  28           H        TYR  28  22.559  -7.195 -11.187
  248    HA   TYR  28           HA       TYR  28  23.642  -9.549 -10.051
  249    HD1  TYR  28           HD2      TYR  28  24.649 -11.011 -12.182
  250    HD2  TYR  28           HD1      TYR  28  27.418  -7.963 -10.885
  251    HE1  TYR  28           HE2      TYR  28  26.497 -12.653 -12.298
  252    HE2  TYR  28           HE1      TYR  28  29.273  -9.599 -10.989
  253    HH   TYR  28           HH       TYR  28  28.780 -13.021 -11.988
  254    HB2  TYR  28           HB2      TYR  28  24.119  -8.546 -12.322
  255    HB3  TYR  28           HB3      TYR  28  25.153  -7.363 -11.531
  256    H    ALA  29           H        ALA  29  24.019  -6.149  -9.104
  257    HA   ALA  29           HA       ALA  29  26.301  -6.577  -7.402
  258    HB1  ALA  29           HB1      ALA  29  24.283  -4.291  -7.460
  259    HB2  ALA  29           HB2      ALA  29  25.847  -4.289  -6.624
  260    HB3  ALA  29           HB3      ALA  29  25.796  -4.383  -8.393
  261    H    ILE  30           H        ILE  30  22.746  -6.298  -6.710
  262    HA   ILE  30           HA       ILE  30  23.408  -7.012  -3.886
  263    HB   ILE  30           HB       ILE  30  21.273  -5.846  -3.329
  264   HG12  ILE  30          HG12      ILE  30  21.720  -4.245  -5.854
  265   HG13  ILE  30          HG13      ILE  30  20.494  -5.521  -5.737
  266   HG21  ILE  30          HG21      ILE  30  23.584  -5.083  -2.775
  267   HG22  ILE  30          HG22      ILE  30  23.660  -4.206  -4.318
  268   HG23  ILE  30          HG23      ILE  30  22.512  -3.715  -3.055
  269   HD11  ILE  30          HD11      ILE  30  19.429  -4.297  -3.851
  270   HD12  ILE  30          HD12      ILE  30  20.624  -2.992  -4.037
  271   HD13  ILE  30          HD13      ILE  30  19.491  -3.340  -5.344
  272    H    PHE  31           H        PHE  31  20.917  -7.777  -6.405
  273    HA   PHE  31           HA       PHE  31  19.468  -9.506  -4.601
  274    HD1  PHE  31           HD1      PHE  31  18.598  -6.974  -6.344
  275    HD2  PHE  31           HD2      PHE  31  16.635 -10.795  -6.754
  276    HE1  PHE  31           HE1      PHE  31  16.388  -5.868  -6.172
  277    HE2  PHE  31           HE2      PHE  31  14.433  -9.684  -6.538
  278    HZ   PHE  31           HZ       PHE  31  14.303  -7.225  -6.248
  279    HB2  PHE  31           HB2      PHE  31  19.602  -9.308  -7.613
  280    HB3  PHE  31           HB3      PHE  31  18.925 -10.728  -6.853
  281    H    SER  32           H        SER  32  22.252 -10.098  -6.837
  282    HA   SER  32           HA       SER  32  22.524 -12.808  -6.293
  283    HG   SER  32           HG       SER  32  24.196 -11.494  -9.045
  284    HB2  SER  32           HB2      SER  32  24.633 -10.763  -6.968
  285    HB3  SER  32           HB3      SER  32  24.871 -12.519  -7.033
  286    H    GLN  33           H        GLN  33  23.064 -10.307  -3.926
  287    HA   GLN  33           HA       GLN  33  25.021 -11.817  -2.379
  288    HB2  GLN  33           HB2      GLN  33  23.125  -9.632  -1.440
  289    HB3  GLN  33           HB3      GLN  33  24.549 -10.222  -0.598
  290    HG2  GLN  33           HG2      GLN  33  24.514  -8.716  -3.233
  291    HG3  GLN  33           HG3      GLN  33  24.976  -8.051  -1.676
  292   HE21  GLN  33          HE22      GLN  33  26.493  -8.208  -4.220
  293   HE22  GLN  33          HE21      GLN  33  27.971  -9.083  -3.851
  294    H    PHE  34           H        PHE  34  21.600 -12.069  -2.933
  295    HA   PHE  34           HA       PHE  34  21.293 -13.856  -0.568
  296    HD1  PHE  34           HD1      PHE  34  20.848 -12.247   1.512
  297    HD2  PHE  34           HD2      PHE  34  19.594  -9.846  -1.850
  298    HE1  PHE  34           HE1      PHE  34  21.623 -10.197   2.678
  299    HE2  PHE  34           HE2      PHE  34  20.364  -7.806  -0.679
  300    HZ   PHE  34           HZ       PHE  34  21.381  -7.973   1.588
  301    HB2  PHE  34           HB2      PHE  34  19.126 -12.152  -1.850
  302    HB3  PHE  34           HB3      PHE  34  19.036 -13.009  -0.320
  303    H    GLY  35           H        GLY  35  20.834 -13.489  -4.019
  304    HA2  GLY  35           HA2      GLY  35  20.650 -16.373  -4.186
  305    HA3  GLY  35           HA3      GLY  35  19.201 -15.522  -4.778
  306    H    GLN  36           H        GLN  36  22.438 -16.391  -5.468
  307    HA   GLN  36           HA       GLN  36  23.353 -14.533  -7.284
  308    HB2  GLN  36           HB2      GLN  36  24.647 -16.470  -6.593
  309    HB3  GLN  36           HB3      GLN  36  23.566 -17.552  -7.476
  310    HG2  GLN  36           HG2      GLN  36  25.674 -17.163  -8.692
  311    HG3  GLN  36           HG3      GLN  36  24.280 -16.634  -9.614
  312   HE21  GLN  36          HE22      GLN  36  24.475 -14.603 -10.563
  313   HE22  GLN  36          HE21      GLN  36  25.563 -13.347 -10.006
  314    H    ILE  37           H        ILE  37  22.388 -13.539  -8.888
  315    HA   ILE  37           HA       ILE  37  20.152 -14.456 -10.403
  316    HB   ILE  37           HB       ILE  37  22.314 -12.373 -10.930
  317   HG12  ILE  37          HG12      ILE  37  20.839 -12.007  -8.865
  318   HG13  ILE  37          HG13      ILE  37  20.961 -10.708 -10.029
  319   HG21  ILE  37          HG21      ILE  37  19.700 -12.829 -12.417
  320   HG22  ILE  37          HG22      ILE  37  20.634 -11.324 -12.466
  321   HG23  ILE  37          HG23      ILE  37  21.355 -12.813 -13.073
  322   HD11  ILE  37          HD11      ILE  37  18.742 -11.135 -10.890
  323   HD12  ILE  37          HD12      ILE  37  18.616 -12.643  -9.956
  324   HD13  ILE  37          HD13      ILE  37  18.659 -11.067  -9.132
  325    H    LEU  38           H        LEU  38  20.079 -15.407 -12.439
  326    HA   LEU  38           HA       LEU  38  22.590 -16.451 -13.633
  327    HG   LEU  38           HG       LEU  38  20.859 -18.316 -15.611
  328    HB2  LEU  38           HB2      LEU  38  21.259 -18.228 -12.582
  329    HB3  LEU  38           HB3      LEU  38  19.817 -17.691 -13.452
  330   HD11  LEU  38          HD11      LEU  38  22.929 -19.715 -15.594
  331   HD12  LEU  38          HD12      LEU  38  23.248 -18.057 -15.081
  332   HD13  LEU  38          HD13      LEU  38  23.145 -19.350 -13.865
  333   HD21  LEU  38          HD21      LEU  38  19.445 -19.906 -14.355
  334   HD22  LEU  38          HD22      LEU  38  20.694 -20.736 -15.296
  335   HD23  LEU  38          HD23      LEU  38  20.886 -20.546 -13.540
  336    H    ASP  39           H        ASP  39  19.293 -15.010 -14.181
  337    HA   ASP  39           HA       ASP  39  20.380 -13.749 -16.562
  338    HB2  ASP  39           HB2      ASP  39  19.602 -15.955 -17.481
  339    HB3  ASP  39           HB3      ASP  39  17.973 -15.575 -16.937
  340    H    ILE  40           H        ILE  40  18.729 -12.192 -17.507
  341    HA   ILE  40           HA       ILE  40  16.869 -11.075 -15.488
  342    HB   ILE  40           HB       ILE  40  19.213  -9.616 -16.778
  343   HG12  ILE  40          HG12      ILE  40  18.858 -10.347 -13.840
  344   HG13  ILE  40          HG13      ILE  40  19.996 -11.102 -14.954
  345   HG21  ILE  40          HG21      ILE  40  17.346  -8.103 -16.566
  346   HG22  ILE  40          HG22      ILE  40  17.087  -8.572 -14.878
  347   HG23  ILE  40          HG23      ILE  40  18.536  -7.680 -15.360
  348   HD11  ILE  40          HD11      ILE  40  20.157  -8.283 -13.912
  349   HD12  ILE  40          HD12      ILE  40  21.285  -9.607 -13.655
  350   HD13  ILE  40          HD13      ILE  40  21.145  -8.897 -15.264
  351    H    VAL  41           H        VAL  41  15.129 -10.102 -16.522
  352    HA   VAL  41           HA       VAL  41  15.308  -9.452 -19.412
  353    HB   VAL  41           HB       VAL  41  13.112 -11.107 -18.097
  354   HG11  VAL  41          HG11      VAL  41  13.574 -10.350 -21.022
  355   HG12  VAL  41          HG12      VAL  41  12.278 -11.399 -20.407
  356   HG13  VAL  41          HG13      VAL  41  12.302  -9.690 -19.971
  357   HG21  VAL  41          HG21      VAL  41  13.862 -12.967 -19.554
  358   HG22  VAL  41          HG22      VAL  41  15.293 -12.017 -20.007
  359   HG23  VAL  41          HG23      VAL  41  15.050 -12.549 -18.327
  360    H    ALA  42           H        ALA  42  15.257  -7.249 -19.067
  361    HA   ALA  42           HA       ALA  42  12.624  -6.123 -18.441
  362    HB1  ALA  42           HB1      ALA  42  13.634  -4.229 -17.265
  363    HB2  ALA  42           HB2      ALA  42  14.084  -5.720 -16.411
  364    HB3  ALA  42           HB3      ALA  42  15.262  -4.916 -17.469
  365    H    LEU  43           H        LEU  43  12.363  -4.153 -19.854
  366    HA   LEU  43           HA       LEU  43  14.354  -3.885 -22.040
  367    HG   LEU  43           HG       LEU  43  13.062  -6.714 -21.968
  368    HB2  LEU  43           HB2      LEU  43  11.479  -4.780 -22.460
  369    HB3  LEU  43           HB3      LEU  43  12.556  -4.289 -23.742
  370   HD11  LEU  43          HD11      LEU  43  12.287  -8.044 -23.882
  371   HD12  LEU  43          HD12      LEU  43  11.003  -7.006 -23.246
  372   HD13  LEU  43          HD13      LEU  43  11.840  -6.554 -24.748
  373   HD21  LEU  43          HD21      LEU  43  14.312  -5.834 -24.617
  374   HD22  LEU  43          HD22      LEU  43  15.112  -5.793 -23.033
  375   HD23  LEU  43          HD23      LEU  43  14.661  -7.344 -23.746
  376    H    LYS  44           H        LYS  44  13.681  -2.121 -23.562
  377    HA   LYS  44           HA       LYS  44  12.687   0.170 -22.083
  378    HB2  LYS  44           HB2      LYS  44  13.343  -0.212 -25.040
  379    HB3  LYS  44           HB3      LYS  44  12.899   1.331 -24.298
  380    HG2  LYS  44           HG2      LYS  44  14.850   1.192 -22.776
  381    HG3  LYS  44           HG3      LYS  44  15.333  -0.341 -23.526
  382    HD2  LYS  44           HD2      LYS  44  15.579   0.795 -25.714
  383    HD3  LYS  44           HD3      LYS  44  15.091   2.335 -24.973
  384    HE2  LYS  44           HE2      LYS  44  17.039   2.228 -23.444
  385    HE3  LYS  44           HE3      LYS  44  17.516   0.675 -24.144
  386    HZ1  LYS  44           HZ1      LYS  44  18.770   2.498 -25.102
  387    HZ2  LYS  44           HZ2      LYS  44  17.859   1.808 -26.261
  388    HZ3  LYS  44           HZ3      LYS  44  17.417   3.244 -25.617
  389    H    THR  45           H        THR  45  11.075  -2.308 -23.987
  390    HA   THR  45           HA       THR  45   8.808  -0.797 -24.835
  391    HB   THR  45           HB       THR  45   7.825  -3.234 -24.769
  392    HG1  THR  45           HG1      THR  45   9.390  -4.825 -24.646
  393   HG21  THR  45          HG21      THR  45  10.275  -2.589 -26.481
  394   HG22  THR  45          HG22      THR  45   9.041  -3.817 -26.840
  395   HG23  THR  45          HG23      THR  45   8.602  -2.103 -26.832
  396    H    LEU  46           H        LEU  46   6.926  -0.306 -23.754
  397    HA   LEU  46           HA       LEU  46   7.075   0.372 -21.110
  398    HG   LEU  46           HG       LEU  46   4.080  -0.051 -20.257
  399    HB2  LEU  46           HB2      LEU  46   5.408   1.263 -22.687
  400    HB3  LEU  46           HB3      LEU  46   4.589  -0.299 -22.728
  401   HD11  LEU  46          HD11      LEU  46   4.246   2.211 -19.264
  402   HD12  LEU  46          HD12      LEU  46   5.845   1.555 -19.617
  403   HD13  LEU  46          HD13      LEU  46   5.133   2.781 -20.693
  404   HD21  LEU  46          HD21      LEU  46   3.032   2.123 -22.099
  405   HD22  LEU  46          HD22      LEU  46   2.427   0.455 -21.957
  406   HD23  LEU  46          HD23      LEU  46   2.274   1.562 -20.588
  407    H    LYS  47           H        LYS  47   5.624  -2.633 -22.386
  408    HA   LYS  47           HA       LYS  47   4.550  -3.570 -19.968
  409    HB2  LYS  47           HB2      LYS  47   4.348  -5.728 -21.102
  410    HB3  LYS  47           HB3      LYS  47   3.879  -4.405 -22.166
  411    HG2  LYS  47           HG2      LYS  47   6.101  -4.535 -23.305
  412    HG3  LYS  47           HG3      LYS  47   6.565  -5.868 -22.234
  413    HD2  LYS  47           HD2      LYS  47   4.685  -7.229 -23.101
  414    HD3  LYS  47           HD3      LYS  47   4.213  -5.892 -24.175
  415    HE2  LYS  47           HE2      LYS  47   6.436  -6.006 -25.285
  416    HE3  LYS  47           HE3      LYS  47   6.905  -7.335 -24.219
  417    HZ1  LYS  47           HZ1      LYS  47   6.134  -8.144 -26.357
  418    HZ2  LYS  47           HZ2      LYS  47   5.118  -8.659 -25.194
  419    HZ3  LYS  47           HZ3      LYS  47   4.684  -7.428 -26.179
  420    H    MET  48           H        MET  48   7.874  -3.294 -20.649
  421    HA   MET  48           HA       MET  48   8.595  -5.145 -18.452
  422    HB2  MET  48           HB2      MET  48   9.717  -4.978 -21.260
  423    HB3  MET  48           HB3      MET  48  10.661  -5.693 -19.954
  424    HG2  MET  48           HG2      MET  48   7.908  -6.792 -20.423
  425    HG3  MET  48           HG3      MET  48   9.151  -7.114 -21.616
  426    HE1  MET  48           HE1      MET  48   9.344  -8.579 -17.219
  427    HE2  MET  48           HE2      MET  48   9.634  -6.884 -17.635
  428    HE3  MET  48           HE3      MET  48   8.026  -7.602 -17.907
  429    H    ARG  49           H        ARG  49   8.234  -2.110 -18.921
  430    HA   ARG  49           HA       ARG  49  10.995  -1.094 -18.725
  431    HE   ARG  49           HE       ARG  49   9.895   1.732 -21.567
  432    HB2  ARG  49           HB2      ARG  49   9.241  -0.052 -20.169
  433    HB3  ARG  49           HB3      ARG  49   8.309   0.358 -18.725
  434    HG2  ARG  49           HG2      ARG  49  10.214   1.802 -17.953
  435    HG3  ARG  49           HG3      ARG  49  11.095   1.400 -19.434
  436    HD2  ARG  49           HD2      ARG  49   8.375   2.771 -19.294
  437    HD3  ARG  49           HD3      ARG  49   9.923   3.595 -19.551
  438   HH11  ARG  49          HH21      ARG  49   7.608   4.287 -20.626
  439   HH12  ARG  49          HH22      ARG  49   7.021   4.525 -22.230
  440   HH21  ARG  49          HH11      ARG  49   9.163   2.024 -23.610
  441   HH22  ARG  49          HH12      ARG  49   7.930   3.189 -24.008
  442    H    GLY  50           H        GLY  50   8.142  -1.601 -16.693
  443    HA2  GLY  50           HA2      GLY  50   9.514  -0.415 -14.311
  444    HA3  GLY  50           HA3      GLY  50   7.783  -0.259 -14.646
  445    H    GLN  51           H        GLN  51   9.131  -3.270 -15.572
  446    HA   GLN  51           HA       GLN  51   8.775  -4.724 -13.109
  447    HB2  GLN  51           HB2      GLN  51   7.118  -6.282 -14.083
  448    HB3  GLN  51           HB3      GLN  51   6.440  -4.685 -13.825
  449    HG2  GLN  51           HG2      GLN  51   7.409  -5.666 -16.544
  450    HG3  GLN  51           HG3      GLN  51   5.779  -5.913 -15.952
  451   HE21  GLN  51          HE22      GLN  51   4.340  -4.036 -15.662
  452   HE22  GLN  51          HE21      GLN  51   4.706  -2.544 -16.491
  453    H    ALA  52           H        ALA  52   9.602  -6.993 -13.519
  454    HA   ALA  52           HA       ALA  52  11.163  -7.401 -15.975
  455    HB1  ALA  52           HB1      ALA  52  12.627  -5.905 -14.623
  456    HB2  ALA  52           HB2      ALA  52  12.502  -7.025 -13.248
  457    HB3  ALA  52           HB3      ALA  52  13.306  -7.539 -14.744
  458    H    PHE  53           H        PHE  53  12.162  -9.562 -15.949
  459    HA   PHE  53           HA       PHE  53  11.101 -11.403 -13.842
  460    HD1  PHE  53           HD2      PHE  53   9.230 -13.600 -14.380
  461    HD2  PHE  53           HD1      PHE  53   9.590 -10.844 -17.683
  462    HE1  PHE  53           HE2      PHE  53   6.775 -13.684 -14.724
  463    HE2  PHE  53           HE1      PHE  53   7.127 -10.897 -17.993
  464    HZ   PHE  53           HZ       PHE  53   5.716 -12.328 -16.519
  465    HB2  PHE  53           HB2      PHE  53  11.546 -11.987 -16.800
  466    HB3  PHE  53           HB3      PHE  53  11.389 -13.217 -15.567
  467    H    VAL  54           H        VAL  54  12.772 -12.635 -12.919
  468    HA   VAL  54           HA       VAL  54  15.418 -12.493 -14.204
  469    HB   VAL  54           HB       VAL  54  16.589 -11.830 -12.225
  470   HG11  VAL  54          HG11      VAL  54  15.892 -10.027 -13.743
  471   HG12  VAL  54          HG12      VAL  54  14.392  -9.792 -12.824
  472   HG13  VAL  54          HG13      VAL  54  15.942  -9.473 -12.057
  473   HG21  VAL  54          HG21      VAL  54  15.499 -10.923 -10.223
  474   HG22  VAL  54          HG22      VAL  54  13.890 -11.272 -10.904
  475   HG23  VAL  54          HG23      VAL  54  15.001 -12.590 -10.486
  476    H    ILE  55           H        ILE  55  16.719 -14.200 -13.716
  477    HA   ILE  55           HA       ILE  55  15.287 -16.618 -12.729
  478    HB   ILE  55           HB       ILE  55  17.230 -16.305 -15.053
  479   HG12  ILE  55          HG12      ILE  55  15.404 -17.065 -16.558
  480   HG13  ILE  55          HG13      ILE  55  14.245 -16.897 -15.255
  481   HG21  ILE  55          HG21      ILE  55  15.689 -18.742 -14.096
  482   HG22  ILE  55          HG22      ILE  55  16.667 -18.671 -15.577
  483   HG23  ILE  55          HG23      ILE  55  17.450 -18.493 -14.017
  484   HD11  ILE  55          HD11      ILE  55  14.327 -14.507 -15.405
  485   HD12  ILE  55          HD12      ILE  55  15.876 -14.534 -16.286
  486   HD13  ILE  55          HD13      ILE  55  14.377 -15.065 -17.067
  487    H    PHE  56           H        PHE  56  16.675 -18.075 -11.621
  488    HA   PHE  56           HA       PHE  56  19.309 -17.006 -10.686
  489    HD1  PHE  56           HD1      PHE  56  15.402 -16.576  -9.801
  490    HD2  PHE  56           HD2      PHE  56  19.125 -15.596  -7.877
  491    HE1  PHE  56           HE1      PHE  56  14.544 -14.325  -9.258
  492    HE2  PHE  56           HE2      PHE  56  18.246 -13.335  -7.320
  493    HZ   PHE  56           HZ       PHE  56  15.953 -12.700  -8.020
  494    HB2  PHE  56           HB2      PHE  56  17.089 -18.352  -9.100
  495    HB3  PHE  56           HB3      PHE  56  18.642 -17.859  -8.455
  496    H    LYS  57           H        LYS  57  20.607 -18.740  -9.590
  497    HA   LYS  57           HA       LYS  57  20.854 -21.014 -11.285
  498    HB2  LYS  57           HB2      LYS  57  22.544 -21.804  -9.725
  499    HB3  LYS  57           HB3      LYS  57  22.778 -20.112 -10.146
  500    HG2  LYS  57           HG2      LYS  57  21.964 -19.376  -7.969
  501    HG3  LYS  57           HG3      LYS  57  21.462 -21.020  -7.545
  502    HD2  LYS  57           HD2      LYS  57  23.806 -21.798  -7.653
  503    HD3  LYS  57           HD3      LYS  57  24.332 -20.178  -8.112
  504    HE2  LYS  57           HE2      LYS  57  24.787 -20.605  -5.760
  505    HE3  LYS  57           HE3      LYS  57  23.632 -19.282  -5.935
  506    HZ1  LYS  57           HZ1      LYS  57  22.808 -22.080  -5.333
  507    HZ2  LYS  57           HZ2      LYS  57  23.079 -20.936  -4.188
  508    HZ3  LYS  57           HZ3      LYS  57  21.875 -20.733  -5.268
  509    H    GLU  58           H        GLU  58  18.988 -20.646  -8.262
  510    HA   GLU  58           HA       GLU  58  18.075 -23.448  -8.464
  511    HB2  GLU  58           HB2      GLU  58  19.565 -22.237  -6.085
  512    HB3  GLU  58           HB3      GLU  58  18.578 -23.693  -5.977
  513    HG2  GLU  58           HG2      GLU  58  20.030 -24.832  -7.624
  514    HG3  GLU  58           HG3      GLU  58  21.050 -23.394  -7.728
  515    H    ILE  59           H        ILE  59  16.207 -23.841  -7.118
  516    HA   ILE  59           HA       ILE  59  14.340 -21.708  -7.065
  517    HB   ILE  59           HB       ILE  59  12.818 -23.272  -6.091
  518   HG12  ILE  59          HG12      ILE  59  15.177 -25.086  -5.438
  519   HG13  ILE  59          HG13      ILE  59  14.123 -24.262  -4.284
  520   HG21  ILE  59          HG21      ILE  59  13.630 -23.567  -8.506
  521   HG22  ILE  59          HG22      ILE  59  14.530 -24.974  -7.924
  522   HG23  ILE  59          HG23      ILE  59  12.761 -24.915  -7.767
  523   HD11  ILE  59          HD11      ILE  59  13.462 -26.551  -4.363
  524   HD12  ILE  59          HD12      ILE  59  12.184 -25.603  -5.147
  525   HD13  ILE  59          HD13      ILE  59  13.336 -26.542  -6.126
  526    H    GLY  60           H        GLY  60  16.456 -23.004  -4.515
  527    HA2  GLY  60           HA2      GLY  60  15.209 -21.641  -2.319
  528    HA3  GLY  60           HA3      GLY  60  16.857 -22.299  -2.371
  529    H    SER  61           H        SER  61  17.952 -20.843  -4.525
  530    HA   SER  61           HA       SER  61  18.606 -18.347  -3.323
  531    HG   SER  61           HG       SER  61  20.382 -19.768  -3.865
  532    HB2  SER  61           HB2      SER  61  18.909 -19.262  -6.231
  533    HB3  SER  61           HB3      SER  61  19.839 -17.990  -5.431
  534    H    ALA  62           H        ALA  62  16.376 -19.181  -6.048
  535    HA   ALA  62           HA       ALA  62  15.641 -16.517  -6.657
  536    HB1  ALA  62           HB1      ALA  62  13.623 -17.596  -7.667
  537    HB2  ALA  62           HB2      ALA  62  15.121 -18.436  -8.099
  538    HB3  ALA  62           HB3      ALA  62  14.054 -19.114  -6.853
  539    H    SER  63           H        SER  63  14.000 -18.874  -4.457
  540    HA   SER  63           HA       SER  63  11.952 -17.016  -3.711
  541    HG   SER  63           HG       SER  63  13.496 -20.270  -3.090
  542    HB2  SER  63           HB2      SER  63  11.633 -18.595  -1.785
  543    HB3  SER  63           HB3      SER  63  11.533 -19.330  -3.389
  544    H    ASN  64           H        ASN  64  15.067 -17.850  -2.232
  545    HA   ASN  64           HA       ASN  64  14.749 -16.196   0.064
  546    HB2  ASN  64           HB2      ASN  64  16.506 -17.951  -0.136
  547    HB3  ASN  64           HB3      ASN  64  17.387 -16.901  -1.257
  548   HD21  ASN  64          HD22      ASN  64  18.985 -15.701  -0.217
  549   HD22  ASN  64          HD21      ASN  64  18.904 -15.170   1.454
  550    H    ALA  65           H        ALA  65  16.191 -15.442  -3.127
  551    HA   ALA  65           HA       ALA  65  16.899 -12.746  -2.652
  552    HB1  ALA  65           HB1      ALA  65  16.684 -12.484  -5.091
  553    HB2  ALA  65           HB2      ALA  65  17.511 -14.003  -4.717
  554    HB3  ALA  65           HB3      ALA  65  15.801 -14.014  -5.226
  555    H    LEU  66           H        LEU  66  13.875 -14.146  -3.991
  556    HA   LEU  66           HA       LEU  66  12.353 -11.838  -4.241
  557    HG   LEU  66           HG       LEU  66  10.076 -12.594  -5.244
  558    HB2  LEU  66           HB2      LEU  66  11.867 -14.216  -4.958
  559    HB3  LEU  66           HB3      LEU  66  11.349 -14.573  -3.325
  560   HD11  LEU  66          HD11      LEU  66   9.719 -14.874  -5.933
  561   HD12  LEU  66          HD12      LEU  66   9.315 -15.375  -4.282
  562   HD13  LEU  66          HD13      LEU  66   8.223 -14.303  -5.180
  563   HD21  LEU  66          HD21      LEU  66   9.192 -13.411  -2.451
  564   HD22  LEU  66          HD22      LEU  66   9.597 -11.766  -3.009
  565   HD23  LEU  66          HD23      LEU  66   8.167 -12.545  -3.630
  566    H    ARG  67           H        ARG  67  12.351 -14.061  -1.383
  567    HA   ARG  67           HA       ARG  67  10.580 -12.426   0.108
  568    HE   ARG  67           HE       ARG  67  12.029 -16.840  -0.123
  569    HB2  ARG  67           HB2      ARG  67  12.554 -14.614   0.892
  570    HB3  ARG  67           HB3      ARG  67  11.505 -13.831   2.080
  571    HG2  ARG  67           HG2      ARG  67   9.506 -14.509   0.969
  572    HG3  ARG  67           HG3      ARG  67  10.369 -15.118  -0.444
  573    HD2  ARG  67           HD2      ARG  67  10.686 -16.261   2.364
  574    HD3  ARG  67           HD3      ARG  67   9.571 -16.906   1.147
  575   HH11  ARG  67          HH21      ARG  67  10.736 -18.393   2.811
  576   HH12  ARG  67          HH22      ARG  67  11.868 -19.705   2.788
  577   HH21  ARG  67          HH11      ARG  67  13.288 -18.912  -0.344
  578   HH22  ARG  67          HH12      ARG  67  13.340 -19.950   1.011
  579    H    THR  68           H        THR  68  14.191 -12.430   0.020
  580    HA   THR  68           HA       THR  68  14.446 -10.612   2.231
  581    HB   THR  68           HB       THR  68  16.387 -11.105  -0.072
  582    HG1  THR  68           HG1      THR  68  16.004 -13.028   0.837
  583   HG21  THR  68          HG21      THR  68  16.790 -10.057   2.770
  584   HG22  THR  68          HG22      THR  68  18.101 -10.545   1.679
  585   HG23  THR  68          HG23      THR  68  17.074  -9.173   1.254
  586    H    MET  69           H        MET  69  14.175 -10.150  -1.326
  587    HA   MET  69           HA       MET  69  14.592  -7.268  -1.036
  588    HB2  MET  69           HB2      MET  69  14.083  -9.000  -3.484
  589    HB3  MET  69           HB3      MET  69  14.501  -7.290  -3.505
  590    HG2  MET  69           HG2      MET  69  16.235  -9.580  -2.481
  591    HG3  MET  69           HG3      MET  69  16.490  -8.647  -3.934
  592    HE1  MET  69           HE1      MET  69  17.533  -6.139  -3.965
  593    HE2  MET  69           HE2      MET  69  16.050  -5.658  -3.110
  594    HE3  MET  69           HE3      MET  69  17.639  -5.155  -2.495
  595    H    GLN  70           H        GLN  70  11.853  -9.306  -0.897
  596    HA   GLN  70           HA       GLN  70   9.836  -7.756  -2.020
  597    HB2  GLN  70           HB2      GLN  70   9.690 -10.090  -1.029
  598    HB3  GLN  70           HB3      GLN  70   9.781  -9.379   0.574
  599    HG2  GLN  70           HG2      GLN  70   7.557 -10.005   0.143
  600    HG3  GLN  70           HG3      GLN  70   7.581  -8.235   0.106
  601   HE21  GLN  70          HE22      GLN  70   6.312 -10.916  -1.482
  602   HE22  GLN  70          HE21      GLN  70   6.195 -10.288  -3.112
  603    H    GLY  71           H        GLY  71   9.140  -5.717  -1.625
  604    HA2  GLY  71           HA2      GLY  71   8.593  -3.808  -0.519
  605    HA3  GLY  71           HA3      GLY  71   9.000  -4.570   1.019
  606    H    PHE  72           H        PHE  72  11.752  -4.902  -0.973
  607    HA   PHE  72           HA       PHE  72  13.225  -3.104   0.691
  608    HD1  PHE  72           HD2      PHE  72  15.854  -4.318   1.294
  609    HD2  PHE  72           HD1      PHE  72  15.595  -2.785  -2.729
  610    HE1  PHE  72           HE2      PHE  72  18.114  -3.318   1.524
  611    HE2  PHE  72           HE1      PHE  72  17.858  -1.780  -2.490
  612    HZ   PHE  72           HZ       PHE  72  19.117  -2.046  -0.364
  613    HB2  PHE  72           HB2      PHE  72  14.155  -5.149  -0.317
  614    HB3  PHE  72           HB3      PHE  72  14.005  -4.442  -1.927
  615    HA   PRO  73           HA       PRO  73  12.545   0.559  -1.846
  616    HB2  PRO  73           HB2      PRO  73  14.110   2.385  -0.618
  617    HB3  PRO  73           HB3      PRO  73  12.661   1.674   0.151
  618    HG2  PRO  73           HG2      PRO  73  15.553   0.812   0.524
  619    HG3  PRO  73           HG3      PRO  73  14.336   1.169   1.790
  620    HD2  PRO  73           HD2      PRO  73  14.847  -1.373   0.899
  621    HD3  PRO  73           HD3      PRO  73  13.214  -0.857   1.417
  622    H    PHE  74           H        PHE  74  13.538  -0.758  -3.615
  623    HA   PHE  74           HA       PHE  74  16.311  -0.916  -4.107
  624    HD1  PHE  74           HD1      PHE  74  17.012  -3.173  -5.481
  625    HD2  PHE  74           HD2      PHE  74  14.629  -0.859  -8.233
  626    HE1  PHE  74           HE1      PHE  74  18.300  -4.108  -7.391
  627    HE2  PHE  74           HE2      PHE  74  15.936  -1.779 -10.131
  628    HZ   PHE  74           HZ       PHE  74  17.746  -3.426  -9.718
  629    HB2  PHE  74           HB2      PHE  74  14.606  -2.377  -5.013
  630    HB3  PHE  74           HB3      PHE  74  13.934  -1.074  -5.985
  631    H    TYR  75           H        TYR  75  13.936   1.364  -5.528
  632    HA   TYR  75           HA       TYR  75  15.961   3.450  -5.756
  633    HD1  TYR  75           HD1      TYR  75  17.472   4.660  -7.341
  634    HD2  TYR  75           HD2      TYR  75  16.772   0.682  -8.858
  635    HE1  TYR  75           HE1      TYR  75  19.876   4.444  -7.861
  636    HE2  TYR  75           HE2      TYR  75  19.175   0.457  -9.387
  637    HH   TYR  75           HH       TYR  75  21.549   3.086  -8.735
  638    HB2  TYR  75           HB2      TYR  75  14.901   2.032  -8.206
  639    HB3  TYR  75           HB3      TYR  75  15.165   3.765  -8.266
  640    H    ASP  76           H        ASP  76  14.529   4.251  -4.155
  641    HA   ASP  76           HA       ASP  76  12.832   5.448  -3.319
  642    HB2  ASP  76           HB2      ASP  76  13.881   7.028  -4.915
  643    HB3  ASP  76           HB3      ASP  76  12.671   6.596  -6.123
  644    H    LYS  77           H        LYS  77  12.093   2.834  -4.340
  645    HA   LYS  77           HA       LYS  77   9.174   3.109  -4.231
  646    HB2  LYS  77           HB2      LYS  77  10.728   1.870  -6.543
  647    HB3  LYS  77           HB3      LYS  77   9.231   1.133  -5.998
  648    HG2  LYS  77           HG2      LYS  77   8.044   3.324  -6.354
  649    HG3  LYS  77           HG3      LYS  77   9.528   3.944  -7.128
  650    HD2  LYS  77           HD2      LYS  77   9.461   2.152  -8.780
  651    HD3  LYS  77           HD3      LYS  77   8.156   1.348  -7.923
  652    HE2  LYS  77           HE2      LYS  77   6.755   3.472  -8.363
  653    HE3  LYS  77           HE3      LYS  77   7.997   3.894  -9.552
  654    HZ1  LYS  77           HZ1      LYS  77   7.555   1.670 -10.578
  655    HZ2  LYS  77           HZ2      LYS  77   6.342   1.430  -9.496
  656    HZ3  LYS  77           HZ3      LYS  77   6.223   2.642 -10.595
  657    HA   PRO  78           HA       PRO  78  10.339  -0.608  -1.849
  658    HB2  PRO  78           HB2      PRO  78   7.856  -1.379  -0.992
  659    HB3  PRO  78           HB3      PRO  78   8.751  -0.013  -0.257
  660    HG2  PRO  78           HG2      PRO  78   6.533   0.097  -2.312
  661    HG3  PRO  78           HG3      PRO  78   6.758   1.118  -0.861
  662    HD2  PRO  78           HD2      PRO  78   7.505   1.883  -3.407
  663    HD3  PRO  78           HD3      PRO  78   8.349   2.455  -1.936
  664    H    MET  79           H        MET  79  10.825  -2.387  -3.056
  665    HA   MET  79           HA       MET  79   9.623  -3.020  -5.545
  666    HB2  MET  79           HB2      MET  79  11.247  -4.707  -3.599
  667    HB3  MET  79           HB3      MET  79  10.847  -5.227  -5.244
  668    HG2  MET  79           HG2      MET  79  12.287  -2.619  -4.679
  669    HG3  MET  79           HG3      MET  79  13.137  -4.146  -4.845
  670    HE1  MET  79           HE1      MET  79  13.102  -5.617  -7.218
  671    HE2  MET  79           HE2      MET  79  13.798  -4.510  -8.424
  672    HE3  MET  79           HE3      MET  79  14.400  -4.494  -6.753
  673    H    GLN  80           H        GLN  80   8.217  -4.729  -6.150
  674    HA   GLN  80           HA       GLN  80   6.767  -6.182  -4.019
  675    HB2  GLN  80           HB2      GLN  80   5.463  -4.800  -6.416
  676    HB3  GLN  80           HB3      GLN  80   4.672  -5.942  -5.323
  677    HG2  GLN  80           HG2      GLN  80   5.128  -4.389  -3.407
  678    HG3  GLN  80           HG3      GLN  80   5.793  -3.212  -4.539
  679   HE21  GLN  80          HE22      GLN  80   2.921  -4.229  -2.985
  680   HE22  GLN  80          HE21      GLN  80   1.785  -3.357  -3.983
  681    H    ILE  81           H        ILE  81   6.949  -8.310  -4.505
  682    HA   ILE  81           HA       ILE  81   7.755  -9.078  -7.255
  683    HB   ILE  81           HB       ILE  81   9.123 -10.222  -4.811
  684   HG12  ILE  81          HG12      ILE  81   9.995  -7.636  -6.151
  685   HG13  ILE  81          HG13      ILE  81   9.535  -7.880  -4.455
  686   HG21  ILE  81          HG21      ILE  81  10.007  -9.803  -7.701
  687   HG22  ILE  81          HG22      ILE  81  10.914 -10.673  -6.458
  688   HG23  ILE  81          HG23      ILE  81   9.393 -11.320  -7.041
  689   HD11  ILE  81          HD11      ILE  81  11.888  -7.669  -4.527
  690   HD12  ILE  81          HD12      ILE  81  11.513  -9.365  -4.153
  691   HD13  ILE  81          HD13      ILE  81  12.057  -8.893  -5.785
  692    H    ALA  82           H        ALA  82   7.359 -11.274  -7.765
  693    HA   ALA  82           HA       ALA  82   5.895 -12.986  -5.857
  694    HB1  ALA  82           HB1      ALA  82   4.117 -11.809  -7.134
  695    HB2  ALA  82           HB2      ALA  82   4.888 -12.297  -8.662
  696    HB3  ALA  82           HB3      ALA  82   4.193 -13.523  -7.582
  697    H    TYR  83           H        TYR  83   5.866 -15.279  -6.778
  698    HA   TYR  83           HA       TYR  83   8.466 -15.858  -8.042
  699    HD1  TYR  83           HD1      TYR  83   5.356 -16.779  -5.301
  700    HD2  TYR  83           HD2      TYR  83   6.261 -19.458  -8.561
  701    HE1  TYR  83           HE1      TYR  83   3.116 -17.805  -5.072
  702    HE2  TYR  83           HE2      TYR  83   4.024 -20.484  -8.345
  703    HH   TYR  83           HH       TYR  83   1.986 -20.467  -7.207
  704    HB2  TYR  83           HB2      TYR  83   8.018 -18.150  -7.531
  705    HB3  TYR  83           HB3      TYR  83   7.734 -17.187  -6.100
  706    H    SER  84           H        SER  84   8.505 -17.412  -9.923
  707    HA   SER  84           HA       SER  84   6.104 -17.241 -11.686
  708    HG   SER  84           HG       SER  84   6.953 -14.887 -12.047
  709    HB2  SER  84           HB2      SER  84   8.975 -16.803 -12.582
  710    HB3  SER  84           HB3      SER  84   7.497 -16.592 -13.536
  711    H    LYS  85           H        LYS  85   5.538 -19.306 -12.112
  712    HA   LYS  85           HA       LYS  85   7.355 -21.570 -11.912
  713    HB2  LYS  85           HB2      LYS  85   4.631 -21.186 -13.230
  714    HB3  LYS  85           HB3      LYS  85   5.464 -22.730 -13.181
  715    HG2  LYS  85           HG2      LYS  85   4.578 -21.138 -10.734
  716    HG3  LYS  85           HG3      LYS  85   3.684 -22.468 -11.439
  717    HD2  LYS  85           HD2      LYS  85   6.412 -22.625 -10.104
  718    HD3  LYS  85           HD3      LYS  85   4.891 -23.215  -9.465
  719    HE2  LYS  85           HE2      LYS  85   6.377 -24.324 -11.893
  720    HE3  LYS  85           HE3      LYS  85   6.274 -25.054 -10.294
  721    HZ1  LYS  85           HZ1      LYS  85   4.029 -24.722 -12.207
  722    HZ2  LYS  85           HZ2      LYS  85   4.718 -26.109 -11.721
  723    HZ3  LYS  85           HZ3      LYS  85   3.843 -25.246 -10.655
  724    H    SER  86           H        SER  86   8.452 -22.618 -13.616
  725    HA   SER  86           HA       SER  86   9.428 -20.961 -15.651
  726    HG   SER  86           HG       SER  86  11.409 -23.603 -14.230
  727    HB2  SER  86           HB2      SER  86   9.558 -23.994 -15.549
  728    HB3  SER  86           HB3      SER  86  10.728 -22.880 -16.280
  729    H    ASP  87           H        ASP  87   6.558 -22.940 -15.675
  730    HA   ASP  87           HA       ASP  87   6.167 -22.429 -18.592
  731    HB2  ASP  87           HB2      ASP  87   7.027 -24.697 -18.414
  732    HB3  ASP  87           HB3      ASP  87   5.863 -25.083 -17.147
  733    H    SER  88           H        SER  88   4.615 -23.514 -15.474
  734    HA   SER  88           HA       SER  88   2.010 -23.263 -16.310
  735    HG   SER  88           HG       SER  88   2.991 -25.085 -14.444
  736    HB2  SER  88           HB2      SER  88   2.704 -22.410 -13.523
  737    HB3  SER  88           HB3      SER  88   1.429 -23.487 -14.080
  738    H    ASP  89           H        ASP  89   4.225 -20.616 -15.445
  739    HA   ASP  89           HA       ASP  89   2.187 -18.624 -15.017
  740    HB2  ASP  89           HB2      ASP  89   4.465 -18.353 -14.145
  741    HB3  ASP  89           HB3      ASP  89   5.114 -18.348 -15.791
  742    H    ILE  90           H        ILE  90   4.163 -19.516 -17.889
  743    HA   ILE  90           HA       ILE  90   2.894 -17.449 -19.485
  744    HB   ILE  90           HB       ILE  90   3.970 -18.400 -21.421
  745   HG12  ILE  90          HG12      ILE  90   5.154 -20.553 -19.629
  746   HG13  ILE  90          HG13      ILE  90   3.867 -20.828 -20.816
  747   HG21  ILE  90          HG21      ILE  90   6.228 -17.823 -20.769
  748   HG22  ILE  90          HG22      ILE  90   5.104 -16.828 -19.843
  749   HG23  ILE  90          HG23      ILE  90   5.893 -18.218 -19.068
  750   HD11  ILE  90          HD11      ILE  90   5.413 -20.060 -22.623
  751   HD12  ILE  90          HD12      ILE  90   6.720 -19.965 -21.416
  752   HD13  ILE  90          HD13      ILE  90   5.957 -21.520 -21.774
  753    H    VAL  91           H        VAL  91   2.229 -20.896 -18.852
  754    HA   VAL  91           HA       VAL  91   0.164 -21.107 -20.790
  755    HB   VAL  91           HB       VAL  91   0.669 -22.542 -18.160
  756   HG11  VAL  91          HG11      VAL  91  -1.753 -22.712 -18.563
  757   HG12  VAL  91          HG12      VAL  91  -1.460 -23.186 -20.252
  758   HG13  VAL  91          HG13      VAL  91  -0.973 -24.256 -18.916
  759   HG21  VAL  91          HG21      VAL  91   1.346 -24.390 -19.639
  760   HG22  VAL  91          HG22      VAL  91   0.941 -23.423 -21.074
  761   HG23  VAL  91          HG23      VAL  91   2.286 -22.947 -20.024
  762    H    ALA  92           H        ALA  92   0.105 -20.019 -17.324
  763    HA   ALA  92           HA       ALA  92  -2.661 -19.436 -17.302
  764    HB1  ALA  92           HB1      ALA  92  -1.258 -19.657 -15.269
  765    HB2  ALA  92           HB2      ALA  92  -0.442 -18.127 -15.672
  766    HB3  ALA  92           HB3      ALA  92  -2.175 -18.147 -15.288
  767    H    LYS  93           H        LYS  93   0.115 -17.469 -18.432
  768    HA   LYS  93           HA       LYS  93  -1.381 -15.066 -18.827
  769    HB2  LYS  93           HB2      LYS  93   1.131 -16.111 -20.155
  770    HB3  LYS  93           HB3      LYS  93   0.367 -14.588 -20.619
  771    HG2  LYS  93           HG2      LYS  93   0.582 -13.696 -18.360
  772    HG3  LYS  93           HG3      LYS  93   1.201 -15.230 -17.759
  773    HD2  LYS  93           HD2      LYS  93   3.034 -13.687 -18.031
  774    HD3  LYS  93           HD3      LYS  93   3.207 -15.002 -19.201
  775    HE2  LYS  93           HE2      LYS  93   2.259 -13.542 -20.982
  776    HE3  LYS  93           HE3      LYS  93   2.034 -12.243 -19.803
  777    HZ1  LYS  93           HZ1      LYS  93   4.442 -12.168 -19.524
  778    HZ2  LYS  93           HZ2      LYS  93   4.654 -13.378 -20.609
  779    HZ3  LYS  93           HZ3      LYS  93   4.052 -11.943 -21.090
  780    H    ILE  94           H        ILE  94  -0.659 -17.724 -21.222
  781    HA   ILE  94           HA       ILE  94  -2.327 -16.427 -23.153
  782    HB   ILE  94           HB       ILE  94  -2.124 -18.386 -24.525
  783   HG12  ILE  94          HG12      ILE  94  -0.785 -19.770 -22.179
  784   HG13  ILE  94          HG13      ILE  94  -2.389 -20.156 -22.807
  785   HG21  ILE  94          HG21      ILE  94   0.552 -17.843 -23.162
  786   HG22  ILE  94          HG22      ILE  94   0.265 -18.301 -24.850
  787   HG23  ILE  94          HG23      ILE  94  -0.249 -16.715 -24.278
  788   HD11  ILE  94          HD11      ILE  94  -1.340 -20.769 -24.999
  789   HD12  ILE  94          HD12      ILE  94   0.261 -20.535 -24.250
  790   HD13  ILE  94          HD13      ILE  94  -0.829 -21.784 -23.635
  791    H    LYS  95           H        LYS  95  -3.119 -18.778 -20.628
  792    HA   LYS  95           HA       LYS  95  -5.851 -19.175 -21.569
  793    HB2  LYS  95           HB2      LYS  95  -4.394 -19.760 -18.958
  794    HB3  LYS  95           HB3      LYS  95  -6.091 -20.143 -19.184
  795    HG2  LYS  95           HG2      LYS  95  -3.864 -21.258 -20.943
  796    HG3  LYS  95           HG3      LYS  95  -4.540 -22.068 -19.528
  797    HD2  LYS  95           HD2      LYS  95  -6.806 -21.990 -20.595
  798    HD3  LYS  95           HD3      LYS  95  -6.082 -21.332 -22.064
  799    HE2  LYS  95           HE2      LYS  95  -5.331 -24.004 -20.791
  800    HE3  LYS  95           HE3      LYS  95  -6.515 -23.815 -22.084
  801    HZ1  LYS  95           HZ1      LYS  95  -4.757 -22.941 -23.503
  802    HZ2  LYS  95           HZ2      LYS  95  -3.641 -23.140 -22.317
  803    HZ3  LYS  95           HZ3      LYS  95  -4.383 -24.433 -22.973
  804    H    GLY  96           H        GLY  96  -4.346 -16.503 -19.999
  805    HA2  GLY  96           HA2      GLY  96  -5.306 -14.536 -19.290
  806    HA3  GLY  96           HA3      GLY  96  -6.921 -15.241 -19.445
  807    H    THR  97           H        THR  97  -5.598 -17.629 -17.685
  808    HA   THR  97           HA       THR  97  -6.899 -16.862 -15.311
  809    HB   THR  97           HB       THR  97  -5.719 -19.025 -14.500
  810    HG1  THR  97           HG1      THR  97  -4.817 -20.232 -16.121
  811   HG21  THR  97          HG21      THR  97  -7.272 -20.407 -15.814
  812   HG22  THR  97          HG22      THR  97  -8.066 -18.900 -15.328
  813   HG23  THR  97          HG23      THR  97  -7.484 -19.097 -16.996
  814    H    PHE  98           H        PHE  98  -3.683 -16.084 -16.357
  815    HA   PHE  98           HA       PHE  98  -2.430 -15.799 -13.856
  816    HD1  PHE  98           HD1      PHE  98  -3.423 -14.482 -17.654
  817    HD2  PHE  98           HD2      PHE  98  -0.450 -12.261 -15.458
  818    HE1  PHE  98           HE1      PHE  98  -3.704 -12.577 -19.203
  819    HE2  PHE  98           HE2      PHE  98  -0.739 -10.354 -17.011
  820    HZ   PHE  98           HZ       PHE  98  -2.355 -10.510 -18.896
  821    HB2  PHE  98           HB2      PHE  98  -0.846 -14.469 -14.867
  822    HB3  PHE  98           HB3      PHE  98  -1.357 -15.553 -16.130
  823    H    LYS  99           H        LYS  99  -4.983 -13.796 -15.277
  824    HA   LYS  99           HA       LYS  99  -5.138 -12.299 -12.744
  825    HB2  LYS  99           HB2      LYS  99  -4.999 -10.094 -13.741
  826    HB3  LYS  99           HB3      LYS  99  -3.544 -11.007 -14.060
  827    HG2  LYS  99           HG2      LYS  99  -3.798 -10.114 -16.107
  828    HG3  LYS  99           HG3      LYS  99  -4.762 -11.567 -16.377
  829    HD2  LYS  99           HD2      LYS  99  -6.835 -10.220 -15.947
  830    HD3  LYS  99           HD3      LYS  99  -5.824  -8.792 -15.669
  831    HE2  LYS  99           HE2      LYS  99  -4.921  -8.945 -17.950
  832    HE3  LYS  99           HE3      LYS  99  -5.834 -10.430 -18.247
  833    HZ1  LYS  99           HZ1      LYS  99  -7.107  -7.819 -17.667
  834    HZ2  LYS  99           HZ2      LYS  99  -6.882  -8.419 -19.164
  835    HZ3  LYS  99           HZ3      LYS  99  -7.873  -9.203 -18.138
  836    H    GLU 100           H        GLU 100  -6.830 -13.934 -15.130
  837    HA   GLU 100           HA       GLU 100  -9.334 -12.444 -14.575
  838    HB2  GLU 100           HB2      GLU 100  -7.998 -11.933 -16.805
  839    HB3  GLU 100           HB3      GLU 100  -8.620 -13.484 -17.339
  840    HG2  GLU 100           HG2      GLU 100 -10.920 -12.693 -17.102
  841    HG3  GLU 100           HG3      GLU 100 -10.383 -11.240 -16.257
  842    H    ARG 101           H        ARG 101 -11.210 -13.874 -15.644
  843    HA   ARG 101           HA       ARG 101 -11.082 -16.560 -14.507
  844    HE   ARG 101           HE       ARG 101 -15.218 -14.264 -15.843
  845    HB2  ARG 101           HB2      ARG 101 -13.108 -15.189 -16.333
  846    HB3  ARG 101           HB3      ARG 101 -13.304 -16.807 -15.673
  847    HG2  ARG 101           HG2      ARG 101 -14.464 -15.817 -14.035
  848    HG3  ARG 101           HG3      ARG 101 -12.884 -15.460 -13.348
  849    HD2  ARG 101           HD2      ARG 101 -14.209 -13.461 -13.295
  850    HD3  ARG 101           HD3      ARG 101 -12.955 -13.217 -14.520
  851   HH11  ARG 101          HH21      ARG 101 -14.408 -11.314 -14.034
  852   HH12  ARG 101          HH22      ARG 101 -15.583 -10.336 -14.829
  853   HH21  ARG 101          HH11      ARG 101 -16.788 -12.985 -16.896
  854   HH22  ARG 101          HH12      ARG 101 -16.979 -11.309 -16.478
  855    HA   PRO 102           HA       PRO 102  -9.566 -18.778 -18.116
  856    HB2  PRO 102           HB2      PRO 102 -12.032 -20.500 -17.882
  857    HB3  PRO 102           HB3      PRO 102 -10.323 -21.001 -18.063
  858    HG2  PRO 102           HG2      PRO 102 -11.573 -21.121 -15.648
  859    HG3  PRO 102           HG3      PRO 102  -9.876 -20.569 -15.770
  860    HD2  PRO 102           HD2      PRO 102 -12.380 -18.914 -15.465
  861    HD3  PRO 102           HD3      PRO 102 -10.779 -18.706 -14.692
  862    H    LYS 103           H        LYS 103 -12.962 -17.766 -18.011
  863    HA   LYS 103           HA       LYS 103 -12.814 -16.777 -20.758
  864    HB2  LYS 103           HB2      LYS 103 -13.838 -19.130 -20.856
  865    HB3  LYS 103           HB3      LYS 103 -15.128 -18.532 -19.807
  866    HG2  LYS 103           HG2      LYS 103 -15.612 -16.768 -21.623
  867    HG3  LYS 103           HG3      LYS 103 -14.412 -17.584 -22.619
  868    HD2  LYS 103           HD2      LYS 103 -16.587 -18.355 -23.293
  869    HD3  LYS 103           HD3      LYS 103 -15.767 -19.681 -22.478
  870    HE2  LYS 103           HE2      LYS 103 -18.064 -19.653 -21.765
  871    HE3  LYS 103           HE3      LYS 103 -17.063 -19.189 -20.391
  872    HZ1  LYS 103           HZ1      LYS 103 -17.708 -16.875 -20.753
  873    HZ2  LYS 103           HZ2      LYS 103 -18.544 -17.281 -22.112
  874    HZ3  LYS 103           HZ3      LYS 103 -19.044 -17.802 -20.655
  875    H    LYS 104           H        LYS 104 -14.205 -14.930 -20.936
  876    HA   LYS 104           HA       LYS 104 -14.953 -13.478 -18.625
  877    HB2  LYS 104           HB2      LYS 104 -14.642 -12.518 -20.910
  878    HB3  LYS 104           HB3      LYS 104 -16.128 -13.329 -21.438
  879    HG2  LYS 104           HG2      LYS 104 -17.430 -12.024 -19.777
  880    HG3  LYS 104           HG3      LYS 104 -15.937 -11.245 -19.213
  881    HD2  LYS 104           HD2      LYS 104 -15.598 -10.268 -21.470
  882    HD3  LYS 104           HD3      LYS 104 -17.088 -11.056 -22.034
  883    HE2  LYS 104           HE2      LYS 104 -18.391  -9.799 -20.327
  884    HE3  LYS 104           HE3      LYS 104 -16.908  -9.012 -19.772
  885    HZ1  LYS 104           HZ1      LYS 104 -18.074  -8.727 -22.482
  886    HZ2  LYS 104           HZ2      LYS 104 -18.134  -7.608 -21.300
  887    HZ3  LYS 104           HZ3      LYS 104 -16.702  -7.999 -21.968
  Start of MODEL   13
    1    HA   MET   1           HA       MET   1  10.140 -19.140   3.132
    2    H1   MET   1           H1       MET   1   9.666 -21.455   3.173
    3    H2   MET   1           H2       MET   1   9.763 -21.583   1.549
    4    H3   MET   1           H3       MET   1  11.112 -21.236   2.426
    5    HB2  MET   1           HB2      MET   1  10.350 -19.540   0.108
    6    HB3  MET   1           HB3      MET   1  10.158 -17.973   0.883
    7    HG2  MET   1           HG2      MET   1  12.436 -18.145   0.472
    8    HG3  MET   1           HG3      MET   1  12.268 -18.414   2.199
    9    HE1  MET   1           HE1      MET   1  15.420 -20.539   1.039
   10    HE2  MET   1           HE2      MET   1  14.856 -19.036   0.282
   11    HE3  MET   1           HE3      MET   1  14.854 -19.194   2.056
   12    H    GLU   2           H        GLU   2   8.460 -17.442   2.518
   13    HA   GLU   2           HA       GLU   2   5.840 -18.467   2.883
   14    HB2  GLU   2           HB2      GLU   2   6.852 -15.740   1.983
   15    HB3  GLU   2           HB3      GLU   2   5.162 -16.086   2.373
   16    HG2  GLU   2           HG2      GLU   2   5.754 -16.667   4.674
   17    HG3  GLU   2           HG3      GLU   2   7.472 -16.485   4.324
   18    H    MET   3           H        MET   3   7.413 -17.082   0.005
   19    HA   MET   3           HA       MET   3   5.349 -17.950  -1.869
   20    HB2  MET   3           HB2      MET   3   8.230 -17.136  -2.453
   21    HB3  MET   3           HB3      MET   3   6.854 -17.145  -3.556
   22    HG2  MET   3           HG2      MET   3   7.088 -14.892  -3.046
   23    HG3  MET   3           HG3      MET   3   5.796 -15.393  -1.961
   24    HE1  MET   3           HE1      MET   3   7.569 -12.644   0.176
   25    HE2  MET   3           HE2      MET   3   7.216 -12.655  -1.567
   26    HE3  MET   3           HE3      MET   3   6.019 -13.289  -0.412
   27    H    LEU   4           H        LEU   4   5.335 -19.842  -3.036
   28    HA   LEU   4           HA       LEU   4   6.945 -22.040  -2.276
   29    HG   LEU   4           HG       LEU   4   5.998 -21.733  -5.915
   30    HB2  LEU   4           HB2      LEU   4   6.022 -23.304  -3.984
   31    HB3  LEU   4           HB3      LEU   4   4.751 -22.383  -3.195
   32   HD11  LEU   4          HD11      LEU   4   3.847 -22.534  -6.810
   33   HD12  LEU   4          HD12      LEU   4   4.667 -23.806  -5.886
   34   HD13  LEU   4          HD13      LEU   4   3.303 -22.933  -5.161
   35   HD21  LEU   4          HD21      LEU   4   3.975 -20.219  -6.110
   36   HD22  LEU   4          HD22      LEU   4   3.737 -20.439  -4.356
   37   HD23  LEU   4          HD23      LEU   4   5.222 -19.682  -4.984
   38    HA   PRO   5           HA       PRO   5  10.677 -21.144  -4.651
   39    HB2  PRO   5           HB2      PRO   5  10.787 -24.151  -4.840
   40    HB3  PRO   5           HB3      PRO   5  12.102 -22.984  -4.469
   41    HG2  PRO   5           HG2      PRO   5  10.939 -24.342  -2.460
   42    HG3  PRO   5           HG3      PRO   5  11.256 -22.580  -2.295
   43    HD2  PRO   5           HD2      PRO   5   8.645 -23.958  -3.009
   44    HD3  PRO   5           HD3      PRO   5   8.948 -22.621  -1.853
   45    H    ASN   6           H        ASN   6  11.274 -20.918  -6.691
   46    HA   ASN   6           HA       ASN   6  10.495 -22.620  -8.884
   47    HB2  ASN   6           HB2      ASN   6   8.540 -21.030  -8.832
   48    HB3  ASN   6           HB3      ASN   6   9.663 -19.667  -8.833
   49   HD21  ASN   6          HD22      ASN   6   9.804 -18.736 -10.896
   50   HD22  ASN   6          HD21      ASN   6   9.650 -19.642 -12.378
   51    H    GLN   7           H        GLN   7  12.136 -22.129 -10.653
   52    HA   GLN   7           HA       GLN   7  14.574 -21.129  -9.511
   53    HB2  GLN   7           HB2      GLN   7  14.345 -22.947 -11.245
   54    HB3  GLN   7           HB3      GLN   7  14.014 -21.693 -12.455
   55    HG2  GLN   7           HG2      GLN   7  16.214 -20.697 -12.063
   56    HG3  GLN   7           HG3      GLN   7  16.520 -21.785 -10.708
   57   HE21  GLN   7          HE22      GLN   7  18.429 -21.605 -12.469
   58   HE22  GLN   7          HE21      GLN   7  18.521 -23.004 -13.538
   59    H    THR   8           H        THR   8  11.964 -19.386 -10.804
   60    HA   THR   8           HA       THR   8  13.632 -17.031 -11.478
   61    HB   THR   8           HB       THR   8  11.270 -18.145 -13.055
   62    HG1  THR   8           HG1      THR   8  12.850 -19.516 -13.466
   63   HG21  THR   8          HG21      THR   8  11.960 -16.610 -14.847
   64   HG22  THR   8          HG22      THR   8  11.545 -15.692 -13.401
   65   HG23  THR   8          HG23      THR   8  13.237 -15.949 -13.807
   66    H    ILE   9           H        ILE   9  12.421 -15.015 -11.268
   67    HA   ILE   9           HA       ILE   9   9.887 -15.173  -9.731
   68    HB   ILE   9           HB       ILE   9  10.569 -13.642  -8.088
   69   HG12  ILE   9          HG12      ILE   9  13.027 -13.136  -9.764
   70   HG13  ILE   9          HG13      ILE   9  11.756 -12.006  -9.341
   71   HG21  ILE   9          HG21      ILE   9  12.357 -14.779  -6.895
   72   HG22  ILE   9          HG22      ILE   9  11.366 -15.979  -7.730
   73   HG23  ILE   9          HG23      ILE   9  12.955 -15.518  -8.374
   74   HD11  ILE   9          HD11      ILE   9  13.715 -11.471  -8.059
   75   HD12  ILE   9          HD12      ILE   9  12.467 -12.080  -6.956
   76   HD13  ILE   9          HD13      ILE   9  13.832 -13.110  -7.412
   77    H    TYR  10           H        TYR  10   8.884 -12.912  -9.671
   78    HA   TYR  10           HA       TYR  10   9.230 -11.453 -12.248
   79    HD1  TYR  10           HD2      TYR  10   7.727 -10.255 -13.711
   80    HD2  TYR  10           HD1      TYR  10   4.615 -11.787 -11.138
   81    HE1  TYR  10           HE2      TYR  10   6.103  -8.736 -14.777
   82    HE2  TYR  10           HE1      TYR  10   2.982 -10.269 -12.200
   83    HH   TYR  10           HH       TYR  10   2.623  -8.682 -13.863
   84    HB2  TYR  10           HB2      TYR  10   7.351 -12.935 -12.485
   85    HB3  TYR  10           HB3      TYR  10   6.770 -12.579 -10.864
   86    H    ILE  11           H        ILE  11   9.107  -9.256 -11.982
   87    HA   ILE  11           HA       ILE  11   8.910  -8.180  -9.209
   88    HB   ILE  11           HB       ILE  11  10.961  -7.718 -11.413
   89   HG12  ILE  11          HG12      ILE  11  11.339  -8.570  -8.508
   90   HG13  ILE  11          HG13      ILE  11  11.258  -9.697  -9.861
   91   HG21  ILE  11          HG21      ILE  11  12.014  -5.992 -10.003
   92   HG22  ILE  11          HG22      ILE  11  10.399  -5.506 -10.452
   93   HG23  ILE  11          HG23      ILE  11  10.694  -6.135  -8.816
   94   HD11  ILE  11          HD11      ILE  11  13.547  -9.415  -9.308
   95   HD12  ILE  11          HD12      ILE  11  13.274  -8.606 -10.864
   96   HD13  ILE  11          HD13      ILE  11  13.438  -7.649  -9.368
   97    H    ASN  12           H        ASN  12   7.991  -6.163  -9.054
   98    HA   ASN  12           HA       ASN  12   6.872  -4.775 -11.391
   99    HB2  ASN  12           HB2      ASN  12   5.376  -6.705  -9.819
  100    HB3  ASN  12           HB3      ASN  12   4.808  -5.111  -9.360
  101   HD21  ASN  12          HD22      ASN  12   5.735  -6.930 -12.352
  102   HD22  ASN  12          HD21      ASN  12   4.371  -6.341 -13.301
  103    H    ASN  13           H        ASN  13   5.686  -2.792 -10.559
  104    HA   ASN  13           HA       ASN  13   5.967  -0.739  -9.758
  105    HB2  ASN  13           HB2      ASN  13   4.893  -1.894  -7.754
  106    HB3  ASN  13           HB3      ASN  13   6.505  -1.953  -7.035
  107   HD21  ASN  13          HD22      ASN  13   6.679  -0.301  -5.518
  108   HD22  ASN  13          HD21      ASN  13   5.952   1.288  -5.691
  109    H    LEU  14           H        LEU  14   8.287  -2.068 -10.836
  110    HA   LEU  14           HA       LEU  14  10.712  -1.258  -9.461
  111    HG   LEU  14           HG       LEU  14  12.428  -2.882 -10.512
  112    HB2  LEU  14           HB2      LEU  14  10.129  -3.058 -11.354
  113    HB3  LEU  14           HB3      LEU  14  10.382  -1.705 -12.441
  114   HD11  LEU  14          HD11      LEU  14  13.408  -3.871 -12.476
  115   HD12  LEU  14          HD12      LEU  14  11.720  -4.349 -12.398
  116   HD13  LEU  14          HD13      LEU  14  12.222  -3.084 -13.540
  117   HD21  LEU  14          HD21      LEU  14  13.057  -0.569 -10.860
  118   HD22  LEU  14          HD22      LEU  14  14.084  -1.558 -11.891
  119   HD23  LEU  14          HD23      LEU  14  12.717  -0.681 -12.606
  120    H    ASN  15           H        ASN  15  11.804   0.826  -9.845
  121    HA   ASN  15           HA       ASN  15  10.109   2.975 -10.825
  122    HB2  ASN  15           HB2      ASN  15  11.827   3.307  -9.048
  123    HB3  ASN  15           HB3      ASN  15  13.098   3.072 -10.257
  124   HD21  ASN  15          HD22      ASN  15  12.591   5.521  -8.679
  125   HD22  ASN  15          HD21      ASN  15  12.176   6.770  -9.822
  126    H    GLU  16           H        GLU  16   9.616   3.123 -12.890
  127    HA   GLU  16           HA       GLU  16  10.941   1.684 -14.902
  128    HB2  GLU  16           HB2      GLU  16   9.412   2.875 -16.447
  129    HB3  GLU  16           HB3      GLU  16   8.595   2.114 -15.093
  130    HG2  GLU  16           HG2      GLU  16   9.335   5.042 -14.857
  131    HG3  GLU  16           HG3      GLU  16   8.022   4.589 -15.929
  132    H    LYS  17           H        LYS  17  11.866   4.817 -13.659
  133    HA   LYS  17           HA       LYS  17  12.989   5.810 -16.086
  134    HB2  LYS  17           HB2      LYS  17  14.156   7.402 -14.801
  135    HB3  LYS  17           HB3      LYS  17  12.600   7.154 -14.042
  136    HG2  LYS  17           HG2      LYS  17  13.853   7.171 -12.168
  137    HG3  LYS  17           HG3      LYS  17  14.004   5.446 -12.505
  138    HD2  LYS  17           HD2      LYS  17  16.208   5.816 -13.544
  139    HD3  LYS  17           HD3      LYS  17  16.052   7.560 -13.342
  140    HE2  LYS  17           HE2      LYS  17  15.973   5.591 -11.010
  141    HE3  LYS  17           HE3      LYS  17  17.474   6.289 -11.625
  142    HZ1  LYS  17           HZ1      LYS  17  16.624   8.490 -11.103
  143    HZ2  LYS  17           HZ2      LYS  17  15.226   7.874 -10.518
  144    HZ3  LYS  17           HZ3      LYS  17  16.640   7.564  -9.768
  145    H    ILE  18           H        ILE  18  14.029   3.273 -13.919
  146    HA   ILE  18           HA       ILE  18  16.814   3.232 -14.491
  147    HB   ILE  18           HB       ILE  18  14.847   1.068 -13.636
  148   HG12  ILE  18          HG12      ILE  18  14.970   2.903 -12.003
  149   HG13  ILE  18          HG13      ILE  18  15.671   1.429 -11.369
  150   HG21  ILE  18          HG21      ILE  18  17.877   0.957 -13.505
  151   HG22  ILE  18          HG22      ILE  18  16.759  -0.207 -12.772
  152   HG23  ILE  18          HG23      ILE  18  16.813  -0.026 -14.527
  153   HD11  ILE  18          HD11      ILE  18  17.268   3.802 -12.458
  154   HD12  ILE  18          HD12      ILE  18  16.963   3.448 -10.758
  155   HD13  ILE  18          HD13      ILE  18  17.950   2.338 -11.719
  156    H    LYS  19           H        LYS  19  17.812   2.870 -16.322
  157    HA   LYS  19           HA       LYS  19  16.582   1.909 -18.748
  158    HB2  LYS  19           HB2      LYS  19  18.553   3.462 -18.526
  159    HB3  LYS  19           HB3      LYS  19  19.496   2.129 -17.868
  160    HG2  LYS  19           HG2      LYS  19  19.285   0.937 -20.065
  161    HG3  LYS  19           HG3      LYS  19  18.408   2.344 -20.705
  162    HD2  LYS  19           HD2      LYS  19  20.385   3.777 -20.232
  163    HD3  LYS  19           HD3      LYS  19  21.229   2.391 -19.521
  164    HE2  LYS  19           HE2      LYS  19  20.978   1.214 -21.777
  165    HE3  LYS  19           HE3      LYS  19  20.397   2.755 -22.429
  166    HZ1  LYS  19           HZ1      LYS  19  22.749   2.521 -22.805
  167    HZ2  LYS  19           HZ2      LYS  19  22.550   3.721 -21.720
  168    HZ3  LYS  19           HZ3      LYS  19  23.064   2.232 -21.227
  169    H    LYS  20           H        LYS  20  17.071  -0.155 -19.804
  170    HA   LYS  20           HA       LYS  20  16.839  -2.500 -18.287
  171    HB2  LYS  20           HB2      LYS  20  16.376  -2.169 -20.708
  172    HB3  LYS  20           HB3      LYS  20  18.109  -2.113 -21.043
  173    HG2  LYS  20           HG2      LYS  20  16.775  -4.523 -19.731
  174    HG3  LYS  20           HG3      LYS  20  16.750  -4.261 -21.481
  175    HD2  LYS  20           HD2      LYS  20  19.417  -4.004 -21.079
  176    HD3  LYS  20           HD3      LYS  20  19.037  -5.079 -19.735
  177    HE2  LYS  20           HE2      LYS  20  18.395  -5.534 -22.690
  178    HE3  LYS  20           HE3      LYS  20  19.719  -6.284 -21.807
  179    HZ1  LYS  20           HZ1      LYS  20  17.857  -7.777 -22.000
  180    HZ2  LYS  20           HZ2      LYS  20  18.062  -7.419 -20.424
  181    HZ3  LYS  20           HZ3      LYS  20  16.830  -6.735 -21.281
  182    H    GLU  21           H        GLU  21  19.798  -0.974 -19.574
  183    HA   GLU  21           HA       GLU  21  21.674  -2.895 -18.658
  184    HB2  GLU  21           HB2      GLU  21  22.135  -1.290 -20.375
  185    HB3  GLU  21           HB3      GLU  21  21.766   0.067 -19.312
  186    HG2  GLU  21           HG2      GLU  21  23.756  -0.339 -17.967
  187    HG3  GLU  21           HG3      GLU  21  24.105  -1.825 -18.869
  188    H    GLU  22           H        GLU  22  20.336   0.054 -17.079
  189    HA   GLU  22           HA       GLU  22  22.008  -0.122 -14.750
  190    HB2  GLU  22           HB2      GLU  22  19.341   1.240 -15.247
  191    HB3  GLU  22           HB3      GLU  22  20.273   1.411 -13.755
  192    HG2  GLU  22           HG2      GLU  22  22.136   2.410 -14.967
  193    HG3  GLU  22           HG3      GLU  22  21.313   2.199 -16.508
  194    H    LEU  23           H        LEU  23  18.772  -1.373 -15.592
  195    HA   LEU  23           HA       LEU  23  18.091  -2.525 -13.091
  196    HG   LEU  23           HG       LEU  23  15.353  -4.254 -15.289
  197    HB2  LEU  23           HB2      LEU  23  16.390  -2.273 -14.661
  198    HB3  LEU  23           HB3      LEU  23  17.301  -2.965 -15.977
  199   HD11  LEU  23          HD11      LEU  23  17.315  -5.376 -16.384
  200   HD12  LEU  23          HD12      LEU  23  17.799  -5.954 -14.785
  201   HD13  LEU  23          HD13      LEU  23  16.236  -6.427 -15.441
  202   HD21  LEU  23          HD21      LEU  23  16.852  -4.928 -12.738
  203   HD22  LEU  23          HD22      LEU  23  15.564  -3.727 -12.842
  204   HD23  LEU  23          HD23      LEU  23  15.219  -5.436 -13.214
  205    H    LYS  24           H        LYS  24  19.883  -3.974 -15.908
  206    HA   LYS  24           HA       LYS  24  20.361  -6.467 -14.617
  207    HB2  LYS  24           HB2      LYS  24  22.028  -4.973 -16.693
  208    HB3  LYS  24           HB3      LYS  24  22.426  -6.585 -16.087
  209    HG2  LYS  24           HG2      LYS  24  20.097  -7.330 -16.821
  210    HG3  LYS  24           HG3      LYS  24  19.966  -5.797 -17.683
  211    HD2  LYS  24           HD2      LYS  24  22.063  -7.975 -18.091
  212    HD3  LYS  24           HD3      LYS  24  20.714  -7.615 -19.170
  213    HE2  LYS  24           HE2      LYS  24  21.680  -5.395 -19.682
  214    HE3  LYS  24           HE3      LYS  24  22.999  -5.684 -18.540
  215    HZ1  LYS  24           HZ1      LYS  24  22.531  -7.279 -20.996
  216    HZ2  LYS  24           HZ2      LYS  24  23.684  -6.144 -20.806
  217    HZ3  LYS  24           HZ3      LYS  24  23.745  -7.513 -19.932
  218    H    LYS  25           H        LYS  25  22.410  -3.484 -14.641
  219    HA   LYS  25           HA       LYS  25  24.431  -4.613 -12.986
  220    HB2  LYS  25           HB2      LYS  25  23.563  -1.717 -13.396
  221    HB3  LYS  25           HB3      LYS  25  24.904  -2.198 -12.353
  222    HG2  LYS  25           HG2      LYS  25  25.919  -3.421 -14.352
  223    HG3  LYS  25           HG3      LYS  25  24.669  -2.676 -15.351
  224    HD2  LYS  25           HD2      LYS  25  26.661  -1.357 -15.550
  225    HD3  LYS  25           HD3      LYS  25  25.497  -0.412 -14.606
  226    HE2  LYS  25           HE2      LYS  25  26.650  -1.112 -12.501
  227    HE3  LYS  25           HE3      LYS  25  27.766  -2.106 -13.437
  228    HZ1  LYS  25           HZ1      LYS  25  28.739   0.027 -12.874
  229    HZ2  LYS  25           HZ2      LYS  25  28.589  -0.078 -14.491
  230    HZ3  LYS  25           HZ3      LYS  25  27.550   0.846 -13.629
  231    H    SER  26           H        SER  26  21.452  -2.813 -12.047
  232    HA   SER  26           HA       SER  26  22.101  -2.691  -9.294
  233    HG   SER  26           HG       SER  26  20.564  -1.122 -11.519
  234    HB2  SER  26           HB2      SER  26  19.360  -2.723 -10.613
  235    HB3  SER  26           HB3      SER  26  19.744  -2.116  -8.985
  236    H    LEU  27           H        LEU  27  20.152  -5.065 -11.123
  237    HA   LEU  27           HA       LEU  27  19.454  -6.747  -8.930
  238    HG   LEU  27           HG       LEU  27  17.639  -6.184 -11.027
  239    HB2  LEU  27           HB2      LEU  27  19.817  -7.156 -11.909
  240    HB3  LEU  27           HB3      LEU  27  19.545  -8.543 -10.873
  241   HD11  LEU  27          HD11      LEU  27  16.216  -7.714 -12.360
  242   HD12  LEU  27          HD12      LEU  27  17.768  -7.409 -13.145
  243   HD13  LEU  27          HD13      LEU  27  17.498  -8.951 -12.308
  244   HD21  LEU  27          HD21      LEU  27  17.425  -8.935  -9.734
  245   HD22  LEU  27          HD22      LEU  27  17.357  -7.343  -8.935
  246   HD23  LEU  27          HD23      LEU  27  16.046  -7.843  -9.993
  247    H    TYR  28           H        TYR  28  22.283  -6.981 -11.211
  248    HA   TYR  28           HA       TYR  28  23.350  -9.175  -9.752
  249    HD1  TYR  28           HD1      TYR  28  23.677 -10.733 -12.108
  250    HD2  TYR  28           HD2      TYR  28  27.104  -8.629 -10.537
  251    HE1  TYR  28           HE1      TYR  28  24.953 -12.853 -12.078
  252    HE2  TYR  28           HE2      TYR  28  28.386 -10.746 -10.487
  253    HH   TYR  28           HH       TYR  28  28.347 -13.043 -10.908
  254    HB2  TYR  28           HB2      TYR  28  23.840  -8.268 -12.188
  255    HB3  TYR  28           HB3      TYR  28  25.138  -7.388 -11.386
  256    H    ALA  29           H        ALA  29  23.676  -5.687  -9.246
  257    HA   ALA  29           HA       ALA  29  25.950  -5.768  -7.545
  258    HB1  ALA  29           HB1      ALA  29  25.221  -3.539  -6.804
  259    HB2  ALA  29           HB2      ALA  29  25.180  -3.685  -8.568
  260    HB3  ALA  29           HB3      ALA  29  23.668  -3.751  -7.627
  261    H    ILE  30           H        ILE  30  22.389  -5.989  -6.840
  262    HA   ILE  30           HA       ILE  30  23.181  -6.641  -4.027
  263    HB   ILE  30           HB       ILE  30  20.998  -5.553  -3.397
  264   HG12  ILE  30          HG12      ILE  30  21.380  -3.956  -5.944
  265   HG13  ILE  30          HG13      ILE  30  20.143  -5.212  -5.755
  266   HG21  ILE  30          HG21      ILE  30  23.264  -3.758  -4.413
  267   HG22  ILE  30          HG22      ILE  30  22.181  -3.424  -3.046
  268   HG23  ILE  30          HG23      ILE  30  23.357  -4.723  -2.932
  269   HD11  ILE  30          HD11      ILE  30  19.117  -3.930  -3.909
  270   HD12  ILE  30          HD12      ILE  30  20.367  -2.672  -4.071
  271   HD13  ILE  30          HD13      ILE  30  19.242  -2.952  -5.391
  272    H    PHE  31           H        PHE  31  20.711  -7.548  -6.460
  273    HA   PHE  31           HA       PHE  31  19.350  -9.327  -4.622
  274    HD1  PHE  31           HD1      PHE  31  18.276  -6.865  -6.310
  275    HD2  PHE  31           HD2      PHE  31  16.561 -10.798  -6.741
  276    HE1  PHE  31           HE1      PHE  31  15.999  -5.904  -6.141
  277    HE2  PHE  31           HE2      PHE  31  14.290  -9.830  -6.526
  278    HZ   PHE  31           HZ       PHE  31  14.003  -7.383  -6.248
  279    HB2  PHE  31           HB2      PHE  31  19.395  -9.065  -7.621
  280    HB3  PHE  31           HB3      PHE  31  18.845 -10.563  -6.918
  281    H    SER  32           H        SER  32  22.140  -9.812  -6.879
  282    HA   SER  32           HA       SER  32  22.456 -12.541  -6.469
  283    HG   SER  32           HG       SER  32  24.247 -11.256  -9.120
  284    HB2  SER  32           HB2      SER  32  24.561 -10.441  -6.992
  285    HB3  SER  32           HB3      SER  32  24.824 -12.192  -7.109
  286    H    GLN  33           H        GLN  33  22.962 -10.106  -4.046
  287    HA   GLN  33           HA       GLN  33  24.908 -11.522  -2.428
  288    HB2  GLN  33           HB2      GLN  33  22.721  -9.592  -1.574
  289    HB3  GLN  33           HB3      GLN  33  24.109 -10.069  -0.610
  290    HG2  GLN  33           HG2      GLN  33  25.653  -8.945  -2.128
  291    HG3  GLN  33           HG3      GLN  33  24.334  -8.522  -3.226
  292   HE21  GLN  33          HE22      GLN  33  22.342  -7.494  -1.857
  293   HE22  GLN  33          HE21      GLN  33  22.825  -6.160  -0.818
  294    H    PHE  34           H        PHE  34  21.421 -11.794  -2.951
  295    HA   PHE  34           HA       PHE  34  21.145 -13.560  -0.571
  296    HD1  PHE  34           HD1      PHE  34  20.714 -11.926   1.346
  297    HD2  PHE  34           HD2      PHE  34  19.256  -9.641  -2.017
  298    HE1  PHE  34           HE1      PHE  34  21.392  -9.821   2.471
  299    HE2  PHE  34           HE2      PHE  34  19.911  -7.549  -0.877
  300    HZ   PHE  34           HZ       PHE  34  20.991  -7.628   1.365
  301    HB2  PHE  34           HB2      PHE  34  18.997 -11.976  -2.027
  302    HB3  PHE  34           HB3      PHE  34  18.843 -12.775  -0.469
  303    H    GLY  35           H        GLY  35  20.714 -13.398  -4.050
  304    HA2  GLY  35           HA2      GLY  35  20.547 -16.310  -4.015
  305    HA3  GLY  35           HA3      GLY  35  19.180 -15.476  -4.799
  306    H    GLN  36           H        GLN  36  22.397 -16.539  -5.195
  307    HA   GLN  36           HA       GLN  36  23.394 -14.716  -7.077
  308    HB2  GLN  36           HB2      GLN  36  24.790 -16.455  -6.146
  309    HB3  GLN  36           HB3      GLN  36  23.817 -17.720  -6.910
  310    HG2  GLN  36           HG2      GLN  36  25.934 -17.305  -8.121
  311    HG3  GLN  36           HG3      GLN  36  24.517 -17.031  -9.118
  312   HE21  GLN  36          HE22      GLN  36  24.577 -15.165 -10.375
  313   HE22  GLN  36          HE21      GLN  36  25.634 -13.809 -10.047
  314    H    ILE  37           H        ILE  37  22.610 -14.018  -8.869
  315    HA   ILE  37           HA       ILE  37  20.384 -15.076 -10.286
  316    HB   ILE  37           HB       ILE  37  22.471 -12.920 -10.815
  317   HG12  ILE  37          HG12      ILE  37  19.571 -12.841  -9.857
  318   HG13  ILE  37          HG13      ILE  37  20.993 -12.575  -8.849
  319   HG21  ILE  37          HG21      ILE  37  21.637 -13.555 -13.013
  320   HG22  ILE  37          HG22      ILE  37  19.952 -13.480 -12.435
  321   HG23  ILE  37          HG23      ILE  37  20.957 -12.024 -12.558
  322   HD11  ILE  37          HD11      ILE  37  19.981 -10.764 -11.047
  323   HD12  ILE  37          HD12      ILE  37  20.056 -10.464  -9.309
  324   HD13  ILE  37          HD13      ILE  37  21.560 -10.571 -10.245
  325    H    LEU  38           H        LEU  38  20.308 -15.844 -12.432
  326    HA   LEU  38           HA       LEU  38  22.768 -17.041 -13.579
  327    HG   LEU  38           HG       LEU  38  20.938 -18.732 -15.662
  328    HB2  LEU  38           HB2      LEU  38  21.306 -18.775 -12.631
  329    HB3  LEU  38           HB3      LEU  38  19.921 -18.117 -13.499
  330   HD11  LEU  38          HD11      LEU  38  22.934 -20.210 -15.720
  331   HD12  LEU  38          HD12      LEU  38  23.342 -18.605 -15.113
  332   HD13  LEU  38          HD13      LEU  38  23.171 -19.962 -13.977
  333   HD21  LEU  38          HD21      LEU  38  20.681 -21.164 -15.413
  334   HD22  LEU  38          HD22      LEU  38  20.844 -21.016 -13.648
  335   HD23  LEU  38          HD23      LEU  38  19.450 -20.296 -14.483
  336    H    ASP  39           H        ASP  39  19.530 -15.450 -14.169
  337    HA   ASP  39           HA       ASP  39  20.652 -14.159 -16.514
  338    HB2  ASP  39           HB2      ASP  39  19.938 -16.345 -17.489
  339    HB3  ASP  39           HB3      ASP  39  18.303 -16.059 -16.906
  340    H    ILE  40           H        ILE  40  18.988 -12.558 -17.452
  341    HA   ILE  40           HA       ILE  40  17.080 -11.576 -15.398
  342    HB   ILE  40           HB       ILE  40  19.408 -10.004 -16.609
  343   HG12  ILE  40          HG12      ILE  40  18.918 -10.827 -13.714
  344   HG13  ILE  40          HG13      ILE  40  20.158 -11.486 -14.783
  345   HG21  ILE  40          HG21      ILE  40  17.154  -9.122 -14.755
  346   HG22  ILE  40          HG22      ILE  40  18.580  -8.137 -15.162
  347   HG23  ILE  40          HG23      ILE  40  17.449  -8.567 -16.418
  348   HD11  ILE  40          HD11      ILE  40  20.079  -8.704 -13.607
  349   HD12  ILE  40          HD12      ILE  40  21.271  -9.975 -13.343
  350   HD13  ILE  40          HD13      ILE  40  21.183  -9.184 -14.924
  351    H    VAL  41           H        VAL  41  15.347 -10.412 -16.351
  352    HA   VAL  41           HA       VAL  41  15.399  -9.988 -19.292
  353    HB   VAL  41           HB       VAL  41  13.156 -11.342 -17.755
  354   HG11  VAL  41          HG11      VAL  41  13.499 -10.823 -20.742
  355   HG12  VAL  41          HG12      VAL  41  12.174 -11.736 -19.989
  356   HG13  VAL  41          HG13      VAL  41  12.339 -10.010 -19.668
  357   HG21  VAL  41          HG21      VAL  41  13.681 -13.366 -19.095
  358   HG22  VAL  41          HG22      VAL  41  15.143 -12.564 -19.711
  359   HG23  VAL  41          HG23      VAL  41  14.981 -12.949 -17.983
  360    H    ALA  42           H        ALA  42  15.172  -7.893 -19.512
  361    HA   ALA  42           HA       ALA  42  12.785  -6.509 -18.712
  362    HB1  ALA  42           HB1      ALA  42  15.540  -5.475 -17.881
  363    HB2  ALA  42           HB2      ALA  42  14.049  -4.522 -17.840
  364    HB3  ALA  42           HB3      ALA  42  14.213  -5.933 -16.780
  365    H    LEU  43           H        LEU  43  12.862  -4.337 -20.041
  366    HA   LEU  43           HA       LEU  43  14.612  -4.415 -22.410
  367    HG   LEU  43           HG       LEU  43  12.742  -6.913 -22.409
  368    HB2  LEU  43           HB2      LEU  43  11.584  -4.670 -22.607
  369    HB3  LEU  43           HB3      LEU  43  12.626  -4.292 -23.953
  370   HD11  LEU  43          HD11      LEU  43  11.466  -6.255 -25.096
  371   HD12  LEU  43          HD12      LEU  43  11.611  -7.873 -24.371
  372   HD13  LEU  43          HD13      LEU  43  10.606  -6.643 -23.591
  373   HD21  LEU  43          HD21      LEU  43  14.022  -6.066 -25.056
  374   HD22  LEU  43          HD22      LEU  43  14.887  -6.361 -23.533
  375   HD23  LEU  43          HD23      LEU  43  14.073  -7.696 -24.347
  376    H    LYS  44           H        LYS  44  13.925  -2.455 -23.869
  377    HA   LYS  44           HA       LYS  44  13.966  -0.116 -22.165
  378    HB2  LYS  44           HB2      LYS  44  13.443  -0.223 -25.177
  379    HB3  LYS  44           HB3      LYS  44  14.024   1.154 -24.260
  380    HG2  LYS  44           HG2      LYS  44  15.558  -1.380 -24.930
  381    HG3  LYS  44           HG3      LYS  44  15.797   0.240 -25.585
  382    HD2  LYS  44           HD2      LYS  44  16.333   0.984 -23.178
  383    HD3  LYS  44           HD3      LYS  44  16.427  -0.733 -22.772
  384    HE2  LYS  44           HE2      LYS  44  18.096   0.781 -24.838
  385    HE3  LYS  44           HE3      LYS  44  18.655   0.216 -23.265
  386    HZ1  LYS  44           HZ1      LYS  44  18.311  -2.079 -24.067
  387    HZ2  LYS  44           HZ2      LYS  44  17.860  -1.516 -25.539
  388    HZ3  LYS  44           HZ3      LYS  44  19.370  -1.268 -25.002
  389    H    THR  45           H        THR  45  11.304  -1.917 -23.541
  390    HA   THR  45           HA       THR  45   9.468   0.243 -23.877
  391    HB   THR  45           HB       THR  45   7.843  -1.802 -23.649
  392    HG1  THR  45           HG1      THR  45   8.857  -3.790 -23.816
  393   HG21  THR  45          HG21      THR  45  10.033  -1.837 -25.784
  394   HG22  THR  45          HG22      THR  45   8.435  -2.608 -25.903
  395   HG23  THR  45          HG23      THR  45   8.559  -0.844 -25.823
  396    H    LEU  46           H        LEU  46   7.954   1.091 -22.419
  397    HA   LEU  46           HA       LEU  46   8.551   1.318 -19.714
  398    HG   LEU  46           HG       LEU  46   5.508   1.267 -18.690
  399    HB2  LEU  46           HB2      LEU  46   7.035   2.822 -20.851
  400    HB3  LEU  46           HB3      LEU  46   5.899   1.511 -21.176
  401   HD11  LEU  46          HD11      LEU  46   7.175   3.819 -18.531
  402   HD12  LEU  46          HD12      LEU  46   6.195   3.136 -17.214
  403   HD13  LEU  46          HD13      LEU  46   7.585   2.239 -17.822
  404   HD21  LEU  46          HD21      LEU  46   4.095   3.243 -18.494
  405   HD22  LEU  46          HD22      LEU  46   4.917   3.988 -19.888
  406   HD23  LEU  46          HD23      LEU  46   3.969   2.491 -20.089
  407    H    LYS  47           H        LYS  47   6.343  -0.994 -21.281
  408    HA   LYS  47           HA       LYS  47   5.285  -2.223 -19.017
  409    HB2  LYS  47           HB2      LYS  47   4.498  -2.402 -21.376
  410    HB3  LYS  47           HB3      LYS  47   5.865  -3.459 -21.754
  411    HG2  LYS  47           HG2      LYS  47   5.002  -5.182 -20.246
  412    HG3  LYS  47           HG3      LYS  47   3.721  -4.088 -19.675
  413    HD2  LYS  47           HD2      LYS  47   2.772  -4.000 -21.956
  414    HD3  LYS  47           HD3      LYS  47   4.031  -5.084 -22.553
  415    HE2  LYS  47           HE2      LYS  47   2.027  -5.794 -20.357
  416    HE3  LYS  47           HE3      LYS  47   1.777  -6.141 -22.067
  417    HZ1  LYS  47           HZ1      LYS  47   3.996  -7.243 -20.442
  418    HZ2  LYS  47           HZ2      LYS  47   2.668  -8.051 -20.928
  419    HZ3  LYS  47           HZ3      LYS  47   3.747  -7.540 -22.034
  420    H    MET  48           H        MET  48   8.559  -2.513 -20.232
  421    HA   MET  48           HA       MET  48   9.093  -4.724 -18.321
  422    HB2  MET  48           HB2      MET  48  10.020  -4.294 -21.158
  423    HB3  MET  48           HB3      MET  48  10.940  -5.317 -20.053
  424    HG2  MET  48           HG2      MET  48   8.030  -5.925 -20.206
  425    HG3  MET  48           HG3      MET  48   8.966  -6.217 -21.667
  426    HE1  MET  48           HE1      MET  48   8.553  -7.090 -17.852
  427    HE2  MET  48           HE2      MET  48   9.804  -8.328 -17.612
  428    HE3  MET  48           HE3      MET  48  10.280  -6.646 -17.892
  429    H    ARG  49           H        ARG  49   9.249  -1.625 -18.350
  430    HA   ARG  49           HA       ARG  49  12.000  -1.415 -17.180
  431    HE   ARG  49           HE       ARG  49  12.839   2.286 -21.308
  432    HB2  ARG  49           HB2      ARG  49   9.971   0.636 -18.167
  433    HB3  ARG  49           HB3      ARG  49  11.247   1.058 -17.040
  434    HG2  ARG  49           HG2      ARG  49  12.985   0.538 -18.585
  435    HG3  ARG  49           HG3      ARG  49  11.833  -0.110 -19.771
  436    HD2  ARG  49           HD2      ARG  49  10.860   2.011 -20.183
  437    HD3  ARG  49           HD3      ARG  49  11.526   2.730 -18.729
  438   HH11  ARG  49          HH21      ARG  49  13.244   3.316 -17.914
  439   HH12  ARG  49          HH22      ARG  49  14.723   4.168 -18.186
  440   HH21  ARG  49          HH11      ARG  49  14.816   3.447 -21.676
  441   HH22  ARG  49          HH12      ARG  49  15.617   4.258 -20.390
  442    H    GLY  50           H        GLY  50   8.466  -0.840 -16.626
  443    HA2  GLY  50           HA2      GLY  50   8.837  -0.360 -13.777
  444    HA3  GLY  50           HA3      GLY  50   7.312  -0.516 -14.657
  445    H    GLN  51           H        GLN  51   8.972  -3.185 -15.618
  446    HA   GLN  51           HA       GLN  51   8.258  -4.951 -13.382
  447    HB2  GLN  51           HB2      GLN  51   7.348  -5.542 -16.226
  448    HB3  GLN  51           HB3      GLN  51   6.885  -6.359 -14.737
  449    HG2  GLN  51           HG2      GLN  51   5.664  -4.227 -14.056
  450    HG3  GLN  51           HG3      GLN  51   6.008  -3.589 -15.669
  451   HE21  GLN  51          HE22      GLN  51   5.342  -5.138 -17.550
  452   HE22  GLN  51          HE21      GLN  51   3.774  -5.917 -17.357
  453    H    ALA  52           H        ALA  52   9.381  -7.073 -13.700
  454    HA   ALA  52           HA       ALA  52  11.222  -7.425 -15.918
  455    HB1  ALA  52           HB1      ALA  52  12.358  -6.877 -13.132
  456    HB2  ALA  52           HB2      ALA  52  13.279  -7.442 -14.540
  457    HB3  ALA  52           HB3      ALA  52  12.548  -5.833 -14.560
  458    H    PHE  53           H        PHE  53  12.561  -9.475 -15.467
  459    HA   PHE  53           HA       PHE  53  11.456 -11.250 -13.384
  460    HD1  PHE  53           HD2      PHE  53  10.498 -10.621 -17.400
  461    HD2  PHE  53           HD1      PHE  53   9.025 -13.233 -14.305
  462    HE1  PHE  53           HE2      PHE  53   8.174 -10.243 -18.191
  463    HE2  PHE  53           HE1      PHE  53   6.696 -12.857 -15.112
  464    HZ   PHE  53           HZ       PHE  53   6.270 -11.356 -17.039
  465    HB2  PHE  53           HB2      PHE  53  11.973 -12.258 -16.206
  466    HB3  PHE  53           HB3      PHE  53  11.381 -13.167 -14.845
  467    H    VAL  54           H        VAL  54  13.082 -12.908 -12.815
  468    HA   VAL  54           HA       VAL  54  15.694 -12.754 -14.069
  469    HB   VAL  54           HB       VAL  54  16.105 -10.899 -12.777
  470   HG11  VAL  54          HG11      VAL  54  15.645 -10.572 -10.402
  471   HG12  VAL  54          HG12      VAL  54  14.138 -10.909 -11.252
  472   HG13  VAL  54          HG13      VAL  54  14.926 -12.184 -10.297
  473   HG21  VAL  54          HG21      VAL  54  17.903 -12.507 -12.521
  474   HG22  VAL  54          HG22      VAL  54  17.742 -11.503 -11.079
  475   HG23  VAL  54          HG23      VAL  54  17.154 -13.177 -11.065
  476    H    ILE  55           H        ILE  55  16.857 -14.523 -13.723
  477    HA   ILE  55           HA       ILE  55  15.436 -16.901 -12.650
  478    HB   ILE  55           HB       ILE  55  17.412 -16.624 -14.957
  479   HG12  ILE  55          HG12      ILE  55  15.600 -17.379 -16.494
  480   HG13  ILE  55          HG13      ILE  55  14.411 -17.129 -15.248
  481   HG21  ILE  55          HG21      ILE  55  17.558 -18.798 -13.858
  482   HG22  ILE  55          HG22      ILE  55  15.802 -19.026 -14.019
  483   HG23  ILE  55          HG23      ILE  55  16.847 -18.984 -15.455
  484   HD11  ILE  55          HD11      ILE  55  14.598 -15.345 -17.022
  485   HD12  ILE  55          HD12      ILE  55  14.701 -14.721 -15.382
  486   HD13  ILE  55          HD13      ILE  55  16.181 -14.906 -16.356
  487    H    PHE  56           H        PHE  56  16.775 -18.235 -11.339
  488    HA   PHE  56           HA       PHE  56  19.475 -17.148 -10.640
  489    HD1  PHE  56           HD1      PHE  56  15.635 -16.636  -9.650
  490    HD2  PHE  56           HD2      PHE  56  19.369 -15.459  -7.876
  491    HE1  PHE  56           HE1      PHE  56  14.763 -14.348  -9.287
  492    HE2  PHE  56           HE2      PHE  56  18.470 -13.193  -7.454
  493    HZ   PHE  56           HZ       PHE  56  16.157 -12.630  -8.172
  494    HB2  PHE  56           HB2      PHE  56  17.408 -18.353  -8.787
  495    HB3  PHE  56           HB3      PHE  56  18.997 -17.748  -8.346
  496    H    LYS  57           H        LYS  57  20.738 -18.854  -9.316
  497    HA   LYS  57           HA       LYS  57  20.964 -21.142 -11.098
  498    HB2  LYS  57           HB2      LYS  57  22.507 -20.404  -8.571
  499    HB3  LYS  57           HB3      LYS  57  22.905 -21.743  -9.662
  500    HG2  LYS  57           HG2      LYS  57  22.986 -20.088 -11.572
  501    HG3  LYS  57           HG3      LYS  57  22.819 -18.780 -10.390
  502    HD2  LYS  57           HD2      LYS  57  24.948 -19.533  -9.314
  503    HD3  LYS  57           HD3      LYS  57  25.100 -20.793 -10.567
  504    HE2  LYS  57           HE2      LYS  57  24.945 -19.013 -12.327
  505    HE3  LYS  57           HE3      LYS  57  24.880 -17.786 -11.068
  506    HZ1  LYS  57           HZ1      LYS  57  27.163 -19.629 -11.580
  507    HZ2  LYS  57           HZ2      LYS  57  27.132 -18.043 -11.939
  508    HZ3  LYS  57           HZ3      LYS  57  27.137 -18.524 -10.379
  509    H    GLU  58           H        GLU  58  19.158 -20.704  -8.145
  510    HA   GLU  58           HA       GLU  58  18.504 -23.550  -8.166
  511    HB2  GLU  58           HB2      GLU  58  20.616 -23.119  -6.663
  512    HB3  GLU  58           HB3      GLU  58  19.490 -22.309  -5.569
  513    HG2  GLU  58           HG2      GLU  58  18.131 -24.421  -5.493
  514    HG3  GLU  58           HG3      GLU  58  19.325 -25.183  -6.552
  515    H    ILE  59           H        ILE  59  16.467 -23.911  -7.167
  516    HA   ILE  59           HA       ILE  59  14.676 -21.726  -7.211
  517    HB   ILE  59           HB       ILE  59  12.993 -23.294  -6.539
  518   HG12  ILE  59          HG12      ILE  59  15.246 -25.198  -5.739
  519   HG13  ILE  59          HG13      ILE  59  14.068 -24.446  -4.663
  520   HG21  ILE  59          HG21      ILE  59  13.142 -24.836  -8.332
  521   HG22  ILE  59          HG22      ILE  59  14.055 -23.419  -8.845
  522   HG23  ILE  59          HG23      ILE  59  14.917 -24.863  -8.291
  523   HD11  ILE  59          HD11      ILE  59  13.513 -26.581  -6.749
  524   HD12  ILE  59          HD12      ILE  59  13.406 -26.714  -4.989
  525   HD13  ILE  59          HD13      ILE  59  12.242 -25.702  -5.867
  526    H    GLY  60           H        GLY  60  16.438 -23.165  -4.454
  527    HA2  GLY  60           HA2      GLY  60  14.948 -21.754  -2.424
  528    HA3  GLY  60           HA3      GLY  60  16.548 -22.502  -2.253
  529    H    SER  61           H        SER  61  17.785 -20.994  -4.438
  530    HA   SER  61           HA       SER  61  18.596 -18.631  -2.977
  531    HG   SER  61           HG       SER  61  21.139 -20.192  -4.879
  532    HB2  SER  61           HB2      SER  61  19.154 -19.481  -5.857
  533    HB3  SER  61           HB3      SER  61  20.001 -18.216  -4.959
  534    H    ALA  62           H        ALA  62  16.626 -19.272  -5.927
  535    HA   ALA  62           HA       ALA  62  15.846 -16.622  -6.507
  536    HB1  ALA  62           HB1      ALA  62  15.346 -18.609  -7.946
  537    HB2  ALA  62           HB2      ALA  62  14.235 -19.205  -6.703
  538    HB3  ALA  62           HB3      ALA  62  13.872 -17.700  -7.561
  539    H    SER  63           H        SER  63  14.294 -19.047  -4.327
  540    HA   SER  63           HA       SER  63  12.176 -17.415  -3.462
  541    HG   SER  63           HG       SER  63  13.004 -20.432  -3.827
  542    HB2  SER  63           HB2      SER  63  13.608 -19.563  -1.840
  543    HB3  SER  63           HB3      SER  63  11.950 -18.973  -1.621
  544    H    ASN  64           H        ASN  64  15.463 -17.757  -2.097
  545    HA   ASN  64           HA       ASN  64  14.910 -16.111   0.183
  546    HB2  ASN  64           HB2      ASN  64  16.814 -17.753   0.030
  547    HB3  ASN  64           HB3      ASN  64  17.616 -16.659  -1.097
  548   HD21  ASN  64          HD21      ASN  64  19.158 -15.432  -0.043
  549   HD22  ASN  64          HD22      ASN  64  19.024 -14.837   1.606
  550    H    ALA  65           H        ALA  65  16.346 -15.379  -3.020
  551    HA   ALA  65           HA       ALA  65  16.819 -12.610  -2.629
  552    HB1  ALA  65           HB1      ALA  65  15.912 -14.057  -5.176
  553    HB2  ALA  65           HB2      ALA  65  16.669 -12.460  -5.081
  554    HB3  ALA  65           HB3      ALA  65  17.596 -13.897  -4.630
  555    H    LEU  66           H        LEU  66  13.936 -14.330  -3.885
  556    HA   LEU  66           HA       LEU  66  12.252 -12.191  -4.375
  557    HG   LEU  66           HG       LEU  66  10.297 -13.339  -5.626
  558    HB2  LEU  66           HB2      LEU  66  12.019 -14.766  -4.745
  559    HB3  LEU  66           HB3      LEU  66  11.282 -14.812  -3.163
  560   HD11  LEU  66          HD11      LEU  66   8.438 -14.986  -5.491
  561   HD12  LEU  66          HD12      LEU  66  10.010 -15.762  -5.718
  562   HD13  LEU  66          HD13      LEU  66   9.253 -15.764  -4.118
  563   HD21  LEU  66          HD21      LEU  66   9.088 -13.458  -2.838
  564   HD22  LEU  66          HD22      LEU  66   9.604 -12.009  -3.705
  565   HD23  LEU  66          HD23      LEU  66   8.205 -12.910  -4.283
  566    H    ARG  67           H        ARG  67  12.352 -14.137  -1.318
  567    HA   ARG  67           HA       ARG  67  10.423 -12.443  -0.100
  568    HE   ARG  67           HE       ARG  67  12.309 -15.183   3.971
  569    HB2  ARG  67           HB2      ARG  67  11.135 -14.913   0.438
  570    HB3  ARG  67           HB3      ARG  67  12.376 -14.183   1.468
  571    HG2  ARG  67           HG2      ARG  67  10.469 -12.922   2.651
  572    HG3  ARG  67           HG3      ARG  67   9.346 -13.848   1.651
  573    HD2  ARG  67           HD2      ARG  67   9.400 -15.150   3.573
  574    HD3  ARG  67           HD3      ARG  67  10.604 -15.954   2.583
  575   HH11  ARG  67          HH11      ARG  67   9.166 -13.820   5.059
  576   HH12  ARG  67          HH12      ARG  67   9.836 -13.190   6.523
  577   HH21  ARG  67          HH21      ARG  67  13.129 -14.363   5.946
  578   HH22  ARG  67          HH22      ARG  67  12.105 -13.530   7.049
  579    H    THR  68           H        THR  68  14.029 -12.419   0.070
  580    HA   THR  68           HA       THR  68  14.173 -10.502   2.180
  581    HB   THR  68           HB       THR  68  16.178 -11.027  -0.060
  582    HG1  THR  68           HG1      THR  68  15.876 -12.911   0.902
  583   HG21  THR  68          HG21      THR  68  16.794  -9.020   1.191
  584   HG22  THR  68          HG22      THR  68  16.522  -9.853   2.739
  585   HG23  THR  68          HG23      THR  68  17.854 -10.348   1.672
  586    H    MET  69           H        MET  69  13.962 -10.146  -1.393
  587    HA   MET  69           HA       MET  69  14.303  -7.248  -1.152
  588    HB2  MET  69           HB2      MET  69  13.931  -9.049  -3.572
  589    HB3  MET  69           HB3      MET  69  14.296  -7.325  -3.618
  590    HG2  MET  69           HG2      MET  69  16.058  -9.523  -2.451
  591    HG3  MET  69           HG3      MET  69  16.340  -8.645  -3.934
  592    HE1  MET  69           HE1      MET  69  15.760  -5.639  -3.267
  593    HE2  MET  69           HE2      MET  69  17.314  -5.055  -2.623
  594    HE3  MET  69           HE3      MET  69  17.290  -6.106  -4.043
  595    H    GLN  70           H        GLN  70  11.587  -9.323  -1.015
  596    HA   GLN  70           HA       GLN  70   9.600  -7.829  -2.273
  597    HB2  GLN  70           HB2      GLN  70   9.296 -10.066  -1.169
  598    HB3  GLN  70           HB3      GLN  70   9.467  -9.294   0.407
  599    HG2  GLN  70           HG2      GLN  70   7.150  -9.658   0.068
  600    HG3  GLN  70           HG3      GLN  70   7.386  -7.927  -0.116
  601   HE21  GLN  70          HE22      GLN  70   5.982 -10.683  -1.544
  602   HE22  GLN  70          HE21      GLN  70   5.895 -10.145  -3.206
  603    H    GLY  71           H        GLY  71   8.792  -5.807  -1.988
  604    HA2  GLY  71           HA2      GLY  71   8.221  -3.828  -1.025
  605    HA3  GLY  71           HA3      GLY  71   8.518  -4.539   0.563
  606    H    PHE  72           H        PHE  72  11.404  -4.916  -1.224
  607    HA   PHE  72           HA       PHE  72  12.704  -3.026   0.505
  608    HD1  PHE  72           HD2      PHE  72  15.165  -4.232   1.533
  609    HD2  PHE  72           HD1      PHE  72  15.498  -2.960  -2.573
  610    HE1  PHE  72           HE2      PHE  72  17.374  -3.210   2.024
  611    HE2  PHE  72           HE1      PHE  72  17.702  -1.927  -2.075
  612    HZ   PHE  72           HZ       PHE  72  18.643  -2.054   0.224
  613    HB2  PHE  72           HB2      PHE  72  13.702  -5.164  -0.258
  614    HB3  PHE  72           HB3      PHE  72  13.780  -4.540  -1.907
  615    HA   PRO  73           HA       PRO  73  12.513   0.424  -2.464
  616    HB2  PRO  73           HB2      PRO  73  14.075   2.255  -1.227
  617    HB3  PRO  73           HB3      PRO  73  12.463   1.787  -0.610
  618    HG2  PRO  73           HG2      PRO  73  15.167   0.753   0.312
  619    HG3  PRO  73           HG3      PRO  73  13.806   1.345   1.316
  620    HD2  PRO  73           HD2      PRO  73  14.239  -1.317   0.794
  621    HD3  PRO  73           HD3      PRO  73  12.598  -0.641   1.016
  622    H    PHE  74           H        PHE  74  13.538  -1.080  -3.943
  623    HA   PHE  74           HA       PHE  74  16.346  -1.453  -4.302
  624    HD1  PHE  74           HD1      PHE  74  17.047  -3.545  -5.687
  625    HD2  PHE  74           HD2      PHE  74  14.605  -1.411  -8.524
  626    HE1  PHE  74           HE1      PHE  74  18.318  -4.573  -7.559
  627    HE2  PHE  74           HE2      PHE  74  15.871  -2.441 -10.388
  628    HZ   PHE  74           HZ       PHE  74  17.693  -4.058  -9.912
  629    HB2  PHE  74           HB2      PHE  74  14.552  -2.768  -5.309
  630    HB3  PHE  74           HB3      PHE  74  14.013  -1.386  -6.257
  631    H    TYR  75           H        TYR  75  14.100   1.052  -5.261
  632    HA   TYR  75           HA       TYR  75  16.136   3.078  -5.450
  633    HD1  TYR  75           HD1      TYR  75  17.524   4.372  -7.381
  634    HD2  TYR  75           HD2      TYR  75  15.911   0.617  -8.764
  635    HE1  TYR  75           HE1      TYR  75  19.748   3.751  -8.273
  636    HE2  TYR  75           HE2      TYR  75  18.130  -0.023  -9.643
  637    HH   TYR  75           HH       TYR  75  20.359   0.589  -9.872
  638    HB2  TYR  75           HB2      TYR  75  14.424   2.321  -7.859
  639    HB3  TYR  75           HB3      TYR  75  15.044   3.951  -7.644
  640    H    ASP  76           H        ASP  76  14.167   5.028  -6.355
  641    HA   ASP  76           HA       ASP  76  12.885   5.561  -3.907
  642    HB2  ASP  76           HB2      ASP  76  13.720   7.195  -5.615
  643    HB3  ASP  76           HB3      ASP  76  12.341   6.786  -6.635
  644    H    LYS  77           H        LYS  77  11.916   2.966  -5.260
  645    HA   LYS  77           HA       LYS  77   9.122   3.377  -4.602
  646    HB2  LYS  77           HB2      LYS  77   9.979   2.059  -7.226
  647    HB3  LYS  77           HB3      LYS  77   8.395   1.852  -6.478
  648    HG2  LYS  77           HG2      LYS  77   8.065   4.350  -6.583
  649    HG3  LYS  77           HG3      LYS  77   9.564   4.455  -7.530
  650    HD2  LYS  77           HD2      LYS  77   8.569   2.957  -9.250
  651    HD3  LYS  77           HD3      LYS  77   7.086   2.840  -8.288
  652    HE2  LYS  77           HE2      LYS  77   6.766   5.289  -8.443
  653    HE3  LYS  77           HE3      LYS  77   8.244   5.440  -9.402
  654    HZ1  LYS  77           HZ1      LYS  77   6.189   5.399 -10.728
  655    HZ2  LYS  77           HZ2      LYS  77   7.217   4.223 -11.175
  656    HZ3  LYS  77           HZ3      LYS  77   5.885   3.866 -10.265
  657    HA   PRO  78           HA       PRO  78  10.361  -0.477  -2.608
  658    HB2  PRO  78           HB2      PRO  78   7.951  -1.330  -1.631
  659    HB3  PRO  78           HB3      PRO  78   8.867   0.032  -0.914
  660    HG2  PRO  78           HG2      PRO  78   6.547   0.159  -2.860
  661    HG3  PRO  78           HG3      PRO  78   6.801   1.119  -1.370
  662    HD2  PRO  78           HD2      PRO  78   7.425   2.061  -3.870
  663    HD3  PRO  78           HD3      PRO  78   8.374   2.510  -2.421
  664    H    MET  79           H        MET  79  10.677  -2.428  -3.566
  665    HA   MET  79           HA       MET  79   9.513  -3.137  -6.080
  666    HB2  MET  79           HB2      MET  79  10.981  -4.785  -3.971
  667    HB3  MET  79           HB3      MET  79  10.619  -5.363  -5.603
  668    HG2  MET  79           HG2      MET  79  12.238  -2.857  -5.045
  669    HG3  MET  79           HG3      MET  79  12.948  -4.453  -5.214
  670    HE1  MET  79           HE1      MET  79  13.707  -4.770  -8.769
  671    HE2  MET  79           HE2      MET  79  14.282  -4.754  -7.088
  672    HE3  MET  79           HE3      MET  79  12.971  -5.853  -7.564
  673    H    GLN  80           H        GLN  80   8.041  -4.808  -6.597
  674    HA   GLN  80           HA       GLN  80   6.576  -6.149  -4.380
  675    HB2  GLN  80           HB2      GLN  80   5.415  -4.971  -6.948
  676    HB3  GLN  80           HB3      GLN  80   4.545  -6.057  -5.864
  677    HG2  GLN  80           HG2      GLN  80   5.621  -3.315  -5.039
  678    HG3  GLN  80           HG3      GLN  80   3.988  -3.618  -5.604
  679   HE21  GLN  80          HE22      GLN  80   6.278  -4.298  -2.922
  680   HE22  GLN  80          HE21      GLN  80   5.032  -4.718  -1.764
  681    H    ILE  81           H        ILE  81   6.804  -8.330  -4.657
  682    HA   ILE  81           HA       ILE  81   7.804  -9.304  -7.284
  683    HB   ILE  81           HB       ILE  81   8.980 -10.100  -4.609
  684   HG12  ILE  81          HG12      ILE  81   9.916  -7.803  -6.357
  685   HG13  ILE  81          HG13      ILE  81   9.468  -7.783  -4.639
  686   HG21  ILE  81          HG21      ILE  81  10.814 -10.982  -5.916
  687   HG22  ILE  81          HG22      ILE  81   9.340 -11.579  -6.652
  688   HG23  ILE  81          HG23      ILE  81  10.196 -10.234  -7.404
  689   HD11  ILE  81          HD11      ILE  81  11.464  -9.205  -4.145
  690   HD12  ILE  81          HD12      ILE  81  11.976  -8.985  -5.838
  691   HD13  ILE  81          HD13      ILE  81  11.829  -7.582  -4.777
  692    H    ALA  82           H        ALA  82   7.405 -11.514  -7.693
  693    HA   ALA  82           HA       ALA  82   6.062 -13.237  -5.763
  694    HB1  ALA  82           HB1      ALA  82   4.691 -12.454  -8.393
  695    HB2  ALA  82           HB2      ALA  82   4.126 -13.693  -7.254
  696    HB3  ALA  82           HB3      ALA  82   4.131 -11.992  -6.768
  697    H    TYR  83           H        TYR  83   5.589 -15.411  -7.133
  698    HA   TYR  83           HA       TYR  83   8.058 -16.183  -8.484
  699    HD1  TYR  83           HD1      TYR  83   4.663 -17.063  -6.143
  700    HD2  TYR  83           HD2      TYR  83   5.019 -18.707 -10.122
  701    HE1  TYR  83           HE1      TYR  83   2.217 -17.409  -6.210
  702    HE2  TYR  83           HE2      TYR  83   2.584 -19.113 -10.173
  703    HH   TYR  83           HH       TYR  83   0.413 -18.217  -7.445
  704    HB2  TYR  83           HB2      TYR  83   6.994 -18.343  -8.751
  705    HB3  TYR  83           HB3      TYR  83   6.874 -17.797  -7.092
  706    H    SER  84           H        SER  84   7.961 -17.091 -10.753
  707    HA   SER  84           HA       SER  84   7.384 -15.032 -12.444
  708    HG   SER  84           HG       SER  84   9.655 -15.881 -12.626
  709    HB2  SER  84           HB2      SER  84   7.801 -17.930 -13.247
  710    HB3  SER  84           HB3      SER  84   8.209 -16.482 -14.202
  711    H    LYS  85           H        LYS  85   5.946 -14.488 -13.940
  712    HA   LYS  85           HA       LYS  85   3.521 -16.095 -14.495
  713    HB2  LYS  85           HB2      LYS  85   3.599 -13.169 -13.605
  714    HB3  LYS  85           HB3      LYS  85   2.181 -13.943 -14.300
  715    HG2  LYS  85           HG2      LYS  85   3.480 -14.825 -11.697
  716    HG3  LYS  85           HG3      LYS  85   2.115 -13.721 -11.828
  717    HD2  LYS  85           HD2      LYS  85   0.749 -15.460 -12.912
  718    HD3  LYS  85           HD3      LYS  85   2.109 -16.604 -12.830
  719    HE2  LYS  85           HE2      LYS  85   2.134 -16.468 -10.389
  720    HE3  LYS  85           HE3      LYS  85   0.848 -15.257 -10.401
  721    HZ1  LYS  85           HZ1      LYS  85   0.490 -18.000 -11.463
  722    HZ2  LYS  85           HZ2      LYS  85   0.098 -17.560  -9.942
  723    HZ3  LYS  85           HZ3      LYS  85  -0.678 -16.882 -11.216
  724    H    SER  86           H        SER  86   5.841 -15.954 -16.041
  725    HA   SER  86           HA       SER  86   6.187 -13.904 -17.844
  726    HG   SER  86           HG       SER  86   8.506 -16.653 -17.458
  727    HB2  SER  86           HB2      SER  86   6.446 -16.862 -18.484
  728    HB3  SER  86           HB3      SER  86   7.412 -15.517 -19.119
  729    H    ASP  87           H        ASP  87   4.926 -13.057 -19.416
  730    HA   ASP  87           HA       ASP  87   2.260 -13.628 -19.648
  731    HB2  ASP  87           HB2      ASP  87   3.240 -11.525 -20.350
  732    HB3  ASP  87           HB3      ASP  87   4.059 -12.309 -21.704
  733    H    SER  88           H        SER  88   4.749 -14.646 -22.078
  734    HA   SER  88           HA       SER  88   2.978 -15.952 -23.793
  735    HG   SER  88           HG       SER  88   6.358 -15.131 -24.797
  736    HB2  SER  88           HB2      SER  88   5.859 -16.767 -23.251
  737    HB3  SER  88           HB3      SER  88   4.947 -16.941 -24.762
  738    H    ASP  89           H        ASP  89   4.467 -17.130 -20.773
  739    HA   ASP  89           HA       ASP  89   3.893 -19.935 -21.321
  740    HB2  ASP  89           HB2      ASP  89   5.816 -19.251 -19.929
  741    HB3  ASP  89           HB3      ASP  89   4.714 -18.536 -18.747
  742    H    ILE  90           H        ILE  90   2.503 -17.382 -19.206
  743    HA   ILE  90           HA       ILE  90   0.457 -19.145 -18.207
  744    HB   ILE  90           HB       ILE  90  -0.655 -17.222 -17.291
  745   HG12  ILE  90          HG12      ILE  90   1.362 -15.467 -18.735
  746   HG13  ILE  90          HG13      ILE  90  -0.359 -15.581 -19.119
  747   HG21  ILE  90          HG21      ILE  90   1.086 -16.579 -15.740
  748   HG22  ILE  90          HG22      ILE  90   1.359 -18.254 -16.220
  749   HG23  ILE  90          HG23      ILE  90   2.357 -16.961 -16.924
  750   HD11  ILE  90          HD11      ILE  90  -0.901 -14.725 -16.836
  751   HD12  ILE  90          HD12      ILE  90   0.839 -14.460 -16.563
  752   HD13  ILE  90          HD13      ILE  90   0.003 -13.582 -17.849
  753    H    VAL  91           H        VAL  91   0.562 -16.909 -21.021
  754    HA   VAL  91           HA       VAL  91  -2.143 -17.335 -21.754
  755    HB   VAL  91           HB       VAL  91   0.313 -16.535 -23.342
  756   HG11  VAL  91          HG11      VAL  91  -1.232 -15.862 -25.179
  757   HG12  VAL  91          HG12      VAL  91  -1.168 -17.613 -24.974
  758   HG13  VAL  91          HG13      VAL  91  -2.563 -16.703 -24.353
  759   HG21  VAL  91          HG21      VAL  91  -0.775 -14.332 -23.326
  760   HG22  VAL  91          HG22      VAL  91  -2.213 -15.003 -22.526
  761   HG23  VAL  91          HG23      VAL  91  -0.673 -14.913 -21.662
  762    H    ALA  92           H        ALA  92   0.892 -19.143 -22.654
  763    HA   ALA  92           HA       ALA  92  -0.419 -21.006 -24.303
  764    HB1  ALA  92           HB1      ALA  92   2.036 -20.716 -24.221
  765    HB2  ALA  92           HB2      ALA  92   2.069 -21.441 -22.594
  766    HB3  ALA  92           HB3      ALA  92   1.566 -22.405 -23.997
  767    H    LYS  93           H        LYS  93   0.008 -21.038 -20.724
  768    HA   LYS  93           HA       LYS  93  -1.105 -23.664 -20.400
  769    HB2  LYS  93           HB2      LYS  93  -0.889 -21.310 -18.480
  770    HB3  LYS  93           HB3      LYS  93  -1.661 -22.840 -18.054
  771    HG2  LYS  93           HG2      LYS  93   0.512 -23.993 -18.842
  772    HG3  LYS  93           HG3      LYS  93   1.265 -22.398 -18.762
  773    HD2  LYS  93           HD2      LYS  93  -0.189 -23.815 -16.484
  774    HD3  LYS  93           HD3      LYS  93   1.551 -23.848 -16.703
  775    HE2  LYS  93           HE2      LYS  93   0.167 -21.161 -16.505
  776    HE3  LYS  93           HE3      LYS  93   0.327 -22.139 -15.047
  777    HZ1  LYS  93           HZ1      LYS  93   2.710 -22.193 -15.373
  778    HZ2  LYS  93           HZ2      LYS  93   2.627 -21.281 -16.728
  779    HZ3  LYS  93           HZ3      LYS  93   2.196 -20.655 -15.279
  780    H    ILE  94           H        ILE  94  -2.765 -20.407 -20.266
  781    HA   ILE  94           HA       ILE  94  -5.269 -21.752 -19.796
  782    HB   ILE  94           HB       ILE  94  -6.370 -19.641 -20.069
  783   HG12  ILE  94          HG12      ILE  94  -3.712 -18.509 -20.981
  784   HG13  ILE  94          HG13      ILE  94  -5.140 -18.715 -21.992
  785   HG21  ILE  94          HG21      ILE  94  -5.369 -18.516 -18.182
  786   HG22  ILE  94          HG22      ILE  94  -5.142 -20.249 -17.961
  787   HG23  ILE  94          HG23      ILE  94  -3.783 -19.242 -18.504
  788   HD11  ILE  94          HD11      ILE  94  -4.840 -16.798 -19.652
  789   HD12  ILE  94          HD12      ILE  94  -4.982 -16.405 -21.372
  790   HD13  ILE  94          HD13      ILE  94  -6.370 -17.105 -20.515
  791    H    LYS  95           H        LYS  95  -3.651 -20.757 -22.795
  792    HA   LYS  95           HA       LYS  95  -5.920 -21.370 -24.499
  793    HB2  LYS  95           HB2      LYS  95  -2.922 -21.150 -25.028
  794    HB3  LYS  95           HB3      LYS  95  -4.101 -21.442 -26.300
  795    HG2  LYS  95           HG2      LYS  95  -4.120 -18.974 -24.503
  796    HG3  LYS  95           HG3      LYS  95  -3.374 -19.065 -26.100
  797    HD2  LYS  95           HD2      LYS  95  -5.598 -19.606 -27.096
  798    HD3  LYS  95           HD3      LYS  95  -6.341 -19.430 -25.489
  799    HE2  LYS  95           HE2      LYS  95  -5.522 -17.092 -25.362
  800    HE3  LYS  95           HE3      LYS  95  -4.779 -17.260 -26.957
  801    HZ1  LYS  95           HZ1      LYS  95  -7.687 -17.444 -26.407
  802    HZ2  LYS  95           HZ2      LYS  95  -6.928 -16.178 -27.095
  803    HZ3  LYS  95           HZ3      LYS  95  -6.997 -17.601 -27.883
  804    H    GLY  96           H        GLY  96  -3.303 -23.303 -23.090
  805    HA2  GLY  96           HA2      GLY  96  -3.531 -25.642 -22.736
  806    HA3  GLY  96           HA3      GLY  96  -4.534 -25.777 -24.189
  807    H    THR  97           H        THR  97  -2.326 -23.707 -25.356
  808    HA   THR  97           HA       THR  97  -0.916 -25.642 -26.876
  809    HB   THR  97           HB       THR  97   0.326 -23.506 -27.601
  810    HG1  THR  97           HG1      THR  97  -0.530 -21.600 -26.848
  811   HG21  THR  97          HG21      THR  97  -2.733 -23.420 -27.707
  812   HG22  THR  97          HG22      THR  97  -1.600 -22.644 -28.834
  813   HG23  THR  97          HG23      THR  97  -1.714 -24.407 -28.767
  814    H    PHE  98           H        PHE  98  -0.330 -24.528 -23.679
  815    HA   PHE  98           HA       PHE  98   2.480 -24.838 -23.447
  816    HD1  PHE  98           HD2      PHE  98   3.498 -23.865 -20.927
  817    HD2  PHE  98           HD1      PHE  98   0.919 -27.240 -20.158
  818    HE1  PHE  98           HE2      PHE  98   5.030 -24.634 -19.133
  819    HE2  PHE  98           HE1      PHE  98   2.455 -28.003 -18.366
  820    HZ   PHE  98           HZ       PHE  98   4.513 -26.702 -17.849
  821    HB2  PHE  98           HB2      PHE  98   1.090 -23.942 -21.679
  822    HB3  PHE  98           HB3      PHE  98   0.169 -25.436 -21.562
  823    H    LYS  99           H        LYS  99  -0.071 -27.218 -23.971
  824    HA   LYS  99           HA       LYS  99   1.925 -29.437 -23.835
  825    HB2  LYS  99           HB2      LYS  99   0.609 -29.297 -21.754
  826    HB3  LYS  99           HB3      LYS  99  -0.891 -29.438 -22.653
  827    HG2  LYS  99           HG2      LYS  99   1.286 -31.567 -22.814
  828    HG3  LYS  99           HG3      LYS  99   0.194 -31.505 -21.443
  829    HD2  LYS  99           HD2      LYS  99  -0.683 -31.942 -24.329
  830    HD3  LYS  99           HD3      LYS  99  -0.509 -33.167 -23.076
  831    HE2  LYS  99           HE2      LYS  99  -2.221 -31.950 -21.692
  832    HE3  LYS  99           HE3      LYS  99  -2.469 -30.828 -23.036
  833    HZ1  LYS  99           HZ1      LYS  99  -2.955 -33.750 -23.128
  834    HZ2  LYS  99           HZ2      LYS  99  -4.101 -32.599 -23.058
  835    HZ3  LYS  99           HZ3      LYS  99  -3.171 -32.734 -24.390
  836    H    GLU 100           H        GLU 100  -1.270 -28.299 -25.070
  837    HA   GLU 100           HA       GLU 100  -1.477 -30.350 -27.101
  838    HB2  GLU 100           HB2      GLU 100  -2.774 -27.595 -26.813
  839    HB3  GLU 100           HB3      GLU 100  -3.170 -28.773 -28.068
  840    HG2  GLU 100           HG2      GLU 100  -3.747 -30.435 -26.255
  841    HG3  GLU 100           HG3      GLU 100  -3.541 -29.145 -25.068
  842    H    ARG 101           H        ARG 101  -1.432 -29.773 -29.463
  843    HA   ARG 101           HA       ARG 101   1.060 -28.742 -30.348
  844    HE   ARG 101           HE       ARG 101  -0.956 -29.383 -34.184
  845    HB2  ARG 101           HB2      ARG 101  -1.635 -29.144 -31.717
  846    HB3  ARG 101           HB3      ARG 101  -0.221 -28.533 -32.577
  847    HG2  ARG 101           HG2      ARG 101   1.017 -30.552 -32.245
  848    HG3  ARG 101           HG3      ARG 101  -0.186 -31.201 -31.123
  849    HD2  ARG 101           HD2      ARG 101  -0.277 -32.180 -33.434
  850    HD3  ARG 101           HD3      ARG 101  -1.807 -31.505 -32.856
  851   HH11  ARG 101          HH11      ARG 101  -0.842 -32.758 -35.303
  852   HH12  ARG 101          HH12      ARG 101  -1.004 -32.332 -36.966
  853   HH21  ARG 101          HH22      ARG 101  -1.164 -28.832 -36.273
  854   HH22  ARG 101          HH21      ARG 101  -1.181 -30.008 -37.555
  855    HA   PRO 102           HA       PRO 102   0.241 -24.343 -30.266
  856    HB2  PRO 102           HB2      PRO 102   1.940 -23.391 -32.200
  857    HB3  PRO 102           HB3      PRO 102   2.496 -24.009 -30.615
  858    HG2  PRO 102           HG2      PRO 102   2.385 -25.495 -33.257
  859    HG3  PRO 102           HG3      PRO 102   3.744 -25.407 -32.091
  860    HD2  PRO 102           HD2      PRO 102   2.011 -27.511 -32.132
  861    HD3  PRO 102           HD3      PRO 102   2.676 -26.887 -30.594
  862    H    LYS 103           H        LYS 103  -0.176 -26.233 -33.221
  863    HA   LYS 103           HA       LYS 103  -2.501 -24.582 -33.943
  864    HB2  LYS 103           HB2      LYS 103  -0.589 -23.703 -35.298
  865    HB3  LYS 103           HB3      LYS 103  -0.294 -25.331 -35.926
  866    HG2  LYS 103           HG2      LYS 103  -2.547 -25.340 -36.970
  867    HG3  LYS 103           HG3      LYS 103  -2.874 -23.734 -36.287
  868    HD2  LYS 103           HD2      LYS 103  -0.985 -22.797 -37.596
  869    HD3  LYS 103           HD3      LYS 103  -0.654 -24.408 -38.272
  870    HE2  LYS 103           HE2      LYS 103  -2.936 -24.459 -39.260
  871    HE3  LYS 103           HE3      LYS 103  -3.266 -22.857 -38.587
  872    HZ1  LYS 103           HZ1      LYS 103  -1.484 -21.977 -39.980
  873    HZ2  LYS 103           HZ2      LYS 103  -1.179 -23.459 -40.603
  874    HZ3  LYS 103           HZ3      LYS 103  -2.601 -22.724 -40.899
  875    H    LYS 104           H        LYS 104  -4.175 -25.952 -34.462
  876    HA   LYS 104           HA       LYS 104  -3.839 -28.598 -35.520
  877    HB2  LYS 104           HB2      LYS 104  -5.080 -29.677 -33.609
  878    HB3  LYS 104           HB3      LYS 104  -3.400 -29.287 -33.278
  879    HG2  LYS 104           HG2      LYS 104  -4.062 -27.295 -31.985
  880    HG3  LYS 104           HG3      LYS 104  -5.767 -27.594 -32.344
  881    HD2  LYS 104           HD2      LYS 104  -3.969 -29.547 -30.838
  882    HD3  LYS 104           HD3      LYS 104  -4.963 -28.308 -30.057
  883    HE2  LYS 104           HE2      LYS 104  -7.007 -29.275 -31.032
  884    HE3  LYS 104           HE3      LYS 104  -6.058 -30.524 -31.850
  885    HZ1  LYS 104           HZ1      LYS 104  -6.163 -30.174 -28.900
  886    HZ2  LYS 104           HZ2      LYS 104  -7.054 -31.266 -29.742
  887    HZ3  LYS 104           HZ3      LYS 104  -5.430 -31.401 -29.710
  Start of MODEL   14
    1    HA   MET   1           HA       MET   1   1.774 -18.859   3.261
    2    H1   MET   1           H1       MET   1  -0.004 -16.855   2.054
    3    H2   MET   1           H2       MET   1  -0.432 -17.905   3.244
    4    H3   MET   1           H3       MET   1   0.693 -16.750   3.526
    5    HB2  MET   1           HB2      MET   1   0.457 -18.810   0.505
    6    HB3  MET   1           HB3      MET   1   1.802 -19.861   0.951
    7    HG2  MET   1           HG2      MET   1   0.435 -20.877   2.748
    8    HG3  MET   1           HG3      MET   1  -0.941 -19.877   2.260
    9    HE1  MET   1           HE1      MET   1  -2.030 -23.474   1.162
   10    HE2  MET   1           HE2      MET   1  -1.071 -23.036   2.593
   11    HE3  MET   1           HE3      MET   1  -2.456 -22.031   2.107
   12    H    GLU   2           H        GLU   2   3.949 -18.705   2.725
   13    HA   GLU   2           HA       GLU   2   4.960 -16.219   1.602
   14    HB2  GLU   2           HB2      GLU   2   6.374 -18.867   2.150
   15    HB3  GLU   2           HB3      GLU   2   7.150 -17.318   1.825
   16    HG2  GLU   2           HG2      GLU   2   5.471 -18.017   4.276
   17    HG3  GLU   2           HG3      GLU   2   7.218 -17.869   4.206
   18    H    MET   3           H        MET   3   6.276 -16.137  -0.413
   19    HA   MET   3           HA       MET   3   4.870 -17.276  -2.616
   20    HB2  MET   3           HB2      MET   3   7.541 -15.824  -2.393
   21    HB3  MET   3           HB3      MET   3   6.875 -16.384  -3.922
   22    HG2  MET   3           HG2      MET   3   6.294 -14.078  -3.689
   23    HG3  MET   3           HG3      MET   3   4.843 -15.051  -3.591
   24    HE1  MET   3           HE1      MET   3   7.273 -12.576  -1.676
   25    HE2  MET   3           HE2      MET   3   6.723 -12.767   0.004
   26    HE3  MET   3           HE3      MET   3   7.552 -14.105  -0.816
   27    H    LEU   4           H        LEU   4   5.278 -19.037  -3.920
   28    HA   LEU   4           HA       LEU   4   6.669 -21.219  -2.665
   29    HG   LEU   4           HG       LEU   4   4.775 -22.777  -2.906
   30    HB2  LEU   4           HB2      LEU   4   5.159 -20.882  -5.277
   31    HB3  LEU   4           HB3      LEU   4   6.083 -22.333  -4.947
   32   HD11  LEU   4          HD11      LEU   4   3.954 -20.576  -2.264
   33   HD12  LEU   4          HD12      LEU   4   3.063 -20.415  -3.798
   34   HD13  LEU   4          HD13      LEU   4   2.580 -21.625  -2.591
   35   HD21  LEU   4          HD21      LEU   4   2.743 -23.521  -4.091
   36   HD22  LEU   4          HD22      LEU   4   3.122 -22.434  -5.446
   37   HD23  LEU   4          HD23      LEU   4   4.187 -23.804  -5.071
   38    HA   PRO   5           HA       PRO   5  10.646 -20.942  -4.806
   39    HB2  PRO   5           HB2      PRO   5  10.369 -23.938  -4.994
   40    HB3  PRO   5           HB3      PRO   5  11.780 -22.955  -4.483
   41    HG2  PRO   5           HG2      PRO   5  10.247 -24.175  -2.626
   42    HG3  PRO   5           HG3      PRO   5  10.812 -22.489  -2.376
   43    HD2  PRO   5           HD2      PRO   5   8.096 -23.431  -3.343
   44    HD3  PRO   5           HD3      PRO   5   8.499 -22.175  -2.130
   45    H    ASN   6           H        ASN   6  11.090 -20.530  -6.836
   46    HA   ASN   6           HA       ASN   6  10.428 -22.235  -9.073
   47    HB2  ASN   6           HB2      ASN   6   8.428 -20.702  -8.998
   48    HB3  ASN   6           HB3      ASN   6   9.511 -19.308  -9.019
   49   HD21  ASN   6          HD22      ASN   6   7.395 -19.901 -11.033
   50   HD22  ASN   6          HD21      ASN   6   8.233 -20.221 -12.527
   51    H    GLN   7           H        GLN   7  12.261 -21.918 -10.527
   52    HA   GLN   7           HA       GLN   7  14.554 -20.637  -9.360
   53    HB2  GLN   7           HB2      GLN   7  14.496 -22.662 -10.929
   54    HB3  GLN   7           HB3      GLN   7  14.258 -21.521 -12.259
   55    HG2  GLN   7           HG2      GLN   7  16.409 -20.446 -11.750
   56    HG3  GLN   7           HG3      GLN   7  16.586 -21.411 -10.285
   57   HE21  GLN   7          HE21      GLN   7  18.719 -21.555 -11.683
   58   HE22  GLN   7          HE22      GLN   7  18.848 -23.024 -12.641
   59    H    THR   8           H        THR   8  11.910 -19.360 -11.162
   60    HA   THR   8           HA       THR   8  13.433 -16.890 -11.782
   61    HB   THR   8           HB       THR   8  10.942 -17.856 -13.217
   62    HG1  THR   8           HG1      THR   8  12.464 -19.410 -13.599
   63   HG21  THR   8          HG21      THR   8  11.766 -16.358 -15.022
   64   HG22  THR   8          HG22      THR   8  11.512 -15.458 -13.517
   65   HG23  THR   8          HG23      THR   8  13.141 -15.892 -13.995
   66    H    ILE   9           H        ILE   9  12.440 -14.946 -11.229
   67    HA   ILE   9           HA       ILE   9   9.869 -15.073  -9.751
   68    HB   ILE   9           HB       ILE   9  10.594 -13.699  -8.025
   69   HG12  ILE   9          HG12      ILE   9  13.036 -13.073  -9.681
   70   HG13  ILE   9          HG13      ILE   9  11.746 -11.976  -9.217
   71   HG21  ILE   9          HG21      ILE   9  12.428 -14.890  -6.943
   72   HG22  ILE   9          HG22      ILE   9  11.449 -16.048  -7.851
   73   HG23  ILE   9          HG23      ILE   9  13.018 -15.496  -8.484
   74   HD11  ILE   9          HD11      ILE   9  13.670 -11.452  -7.896
   75   HD12  ILE   9          HD12      ILE   9  12.441 -12.160  -6.829
   76   HD13  ILE   9          HD13      ILE   9  13.839 -13.119  -7.331
   77    H    TYR  10           H        TYR  10   8.838 -12.926  -9.671
   78    HA   TYR  10           HA       TYR  10   9.044 -11.508 -12.289
   79    HD1  TYR  10           HD1      TYR  10   7.308 -10.292 -13.562
   80    HD2  TYR  10           HD2      TYR  10   4.516 -12.282 -10.936
   81    HE1  TYR  10           HE1      TYR  10   5.446  -9.005 -14.552
   82    HE2  TYR  10           HE2      TYR  10   2.668 -10.961 -11.879
   83    HH   TYR  10           HH       TYR  10   2.022  -9.429 -13.495
   84    HB2  TYR  10           HB2      TYR  10   7.260 -13.125 -12.348
   85    HB3  TYR  10           HB3      TYR  10   6.766 -12.748 -10.712
   86    H    ILE  11           H        ILE  11   9.224  -9.347 -12.011
   87    HA   ILE  11           HA       ILE  11   8.884  -8.198  -9.276
   88    HB   ILE  11           HB       ILE  11  10.930  -7.706 -11.474
   89   HG12  ILE  11          HG12      ILE  11  11.273  -8.586  -8.571
   90   HG13  ILE  11          HG13      ILE  11  11.301  -9.675  -9.959
   91   HG21  ILE  11          HG21      ILE  11  11.919  -5.942 -10.086
   92   HG22  ILE  11          HG22      ILE  11  10.281  -5.512 -10.498
   93   HG23  ILE  11          HG23      ILE  11  10.631  -6.138  -8.872
   94   HD11  ILE  11          HD11      ILE  11  13.295  -8.458 -10.851
   95   HD12  ILE  11          HD12      ILE  11  13.341  -7.507  -9.347
   96   HD13  ILE  11          HD13      ILE  11  13.555  -9.255  -9.284
   97    H    ASN  12           H        ASN  12   7.880  -6.264  -9.127
   98    HA   ASN  12           HA       ASN  12   6.602  -4.965 -11.457
   99    HB2  ASN  12           HB2      ASN  12   5.217  -6.196  -9.012
  100    HB3  ASN  12           HB3      ASN  12   4.446  -5.060 -10.106
  101   HD21  ASN  12          HD22      ASN  12   5.592  -8.404  -9.780
  102   HD22  ASN  12          HD21      ASN  12   4.908  -8.965 -11.290
  103    H    ASN  13           H        ASN  13   5.505  -2.943 -10.629
  104    HA   ASN  13           HA       ASN  13   5.763  -0.875  -9.854
  105    HB2  ASN  13           HB2      ASN  13   4.792  -2.023  -7.802
  106    HB3  ASN  13           HB3      ASN  13   6.433  -2.066  -7.149
  107   HD21  ASN  13          HD22      ASN  13   6.643  -0.418  -5.631
  108   HD22  ASN  13          HD21      ASN  13   5.902   1.167  -5.780
  109    H    LEU  14           H        LEU  14   8.081  -2.152 -11.020
  110    HA   LEU  14           HA       LEU  14  10.521  -1.309  -9.694
  111    HG   LEU  14           HG       LEU  14  12.227  -2.888 -10.729
  112    HB2  LEU  14           HB2      LEU  14   9.933  -3.114 -11.581
  113    HB3  LEU  14           HB3      LEU  14  10.168  -1.756 -12.670
  114   HD11  LEU  14          HD11      LEU  14  11.954  -3.133 -13.759
  115   HD12  LEU  14          HD12      LEU  14  13.229  -3.844 -12.754
  116   HD13  LEU  14          HD13      LEU  14  11.572  -4.406 -12.579
  117   HD21  LEU  14          HD21      LEU  14  12.822  -0.571 -11.109
  118   HD22  LEU  14          HD22      LEU  14  13.872  -1.562 -12.111
  119   HD23  LEU  14          HD23      LEU  14  12.500  -0.717 -12.856
  120    H    ASN  15           H        ASN  15  11.554   0.772 -10.030
  121    HA   ASN  15           HA       ASN  15   9.887   2.925 -11.010
  122    HB2  ASN  15           HB2      ASN  15  11.625   3.208  -9.239
  123    HB3  ASN  15           HB3      ASN  15  12.881   2.999 -10.465
  124   HD21  ASN  15          HD22      ASN  15  12.039   5.416  -8.746
  125   HD22  ASN  15          HD21      ASN  15  11.740   6.683  -9.904
  126    H    GLU  16           H        GLU  16   9.388   3.143 -13.052
  127    HA   GLU  16           HA       GLU  16  10.695   1.721 -15.121
  128    HB2  GLU  16           HB2      GLU  16   9.067   2.852 -16.591
  129    HB3  GLU  16           HB3      GLU  16   8.328   2.064 -15.212
  130    HG2  GLU  16           HG2      GLU  16   8.972   5.017 -15.007
  131    HG3  GLU  16           HG3      GLU  16   7.627   4.510 -16.014
  132    H    LYS  17           H        LYS  17  11.706   4.761 -13.794
  133    HA   LYS  17           HA       LYS  17  12.677   5.847 -16.272
  134    HB2  LYS  17           HB2      LYS  17  13.784   7.465 -15.040
  135    HB3  LYS  17           HB3      LYS  17  12.335   7.102 -14.111
  136    HG2  LYS  17           HG2      LYS  17  13.885   5.517 -12.712
  137    HG3  LYS  17           HG3      LYS  17  15.222   6.343 -13.528
  138    HD2  LYS  17           HD2      LYS  17  14.344   8.537 -12.696
  139    HD3  LYS  17           HD3      LYS  17  13.020   7.680 -11.906
  140    HE2  LYS  17           HE2      LYS  17  14.557   8.073 -10.174
  141    HE3  LYS  17           HE3      LYS  17  14.755   6.368 -10.579
  142    HZ1  LYS  17           HZ1      LYS  17  16.527   8.586 -11.465
  143    HZ2  LYS  17           HZ2      LYS  17  16.886   7.497 -10.315
  144    HZ3  LYS  17           HZ3      LYS  17  16.750   7.018 -11.868
  145    H    ILE  18           H        ILE  18  13.849   3.361 -14.098
  146    HA   ILE  18           HA       ILE  18  16.632   3.545 -14.615
  147    HB   ILE  18           HB       ILE  18  14.895   1.198 -13.722
  148   HG12  ILE  18          HG12      ILE  18  14.547   3.054 -12.200
  149   HG13  ILE  18          HG13      ILE  18  15.523   1.839 -11.416
  150   HG21  ILE  18          HG21      ILE  18  17.883   1.599 -13.337
  151   HG22  ILE  18          HG22      ILE  18  16.906   0.303 -12.622
  152   HG23  ILE  18          HG23      ILE  18  17.096   0.389 -14.374
  153   HD11  ILE  18          HD11      ILE  18  16.302   4.095 -10.886
  154   HD12  ILE  18          HD12      ILE  18  17.555   3.260 -11.821
  155   HD13  ILE  18          HD13      ILE  18  16.521   4.476 -12.596
  156    H    LYS  19           H        LYS  19  17.850   2.922 -16.334
  157    HA   LYS  19           HA       LYS  19  16.590   1.912 -18.745
  158    HB2  LYS  19           HB2      LYS  19  18.549   3.506 -18.564
  159    HB3  LYS  19           HB3      LYS  19  19.544   2.160 -18.008
  160    HG2  LYS  19           HG2      LYS  19  19.244   1.026 -20.187
  161    HG3  LYS  19           HG3      LYS  19  18.155   2.326 -20.720
  162    HD2  LYS  19           HD2      LYS  19  20.011   3.958 -20.496
  163    HD3  LYS  19           HD3      LYS  19  21.090   2.661 -19.937
  164    HE2  LYS  19           HE2      LYS  19  20.775   1.474 -22.102
  165    HE3  LYS  19           HE3      LYS  19  19.702   2.766 -22.655
  166    HZ1  LYS  19           HZ1      LYS  19  21.576   4.301 -22.501
  167    HZ2  LYS  19           HZ2      LYS  19  22.570   3.108 -21.987
  168    HZ3  LYS  19           HZ3      LYS  19  21.945   3.062 -23.490
  169    H    LYS  20           H        LYS  20  17.255  -0.158 -19.827
  170    HA   LYS  20           HA       LYS  20  16.985  -2.463 -18.224
  171    HB2  LYS  20           HB2      LYS  20  16.626  -2.405 -20.694
  172    HB3  LYS  20           HB3      LYS  20  18.372  -2.205 -20.933
  173    HG2  LYS  20           HG2      LYS  20  18.717  -4.427 -19.752
  174    HG3  LYS  20           HG3      LYS  20  16.963  -4.615 -19.689
  175    HD2  LYS  20           HD2      LYS  20  16.886  -4.584 -22.174
  176    HD3  LYS  20           HD3      LYS  20  18.632  -4.267 -22.232
  177    HE2  LYS  20           HE2      LYS  20  19.052  -6.425 -21.056
  178    HE3  LYS  20           HE3      LYS  20  17.316  -6.753 -21.048
  179    HZ1  LYS  20           HZ1      LYS  20  18.429  -7.870 -22.877
  180    HZ2  LYS  20           HZ2      LYS  20  17.379  -6.779 -23.476
  181    HZ3  LYS  20           HZ3      LYS  20  18.986  -6.466 -23.483
  182    H    GLU  21           H        GLU  21  19.997  -0.933 -19.485
  183    HA   GLU  21           HA       GLU  21  21.779  -2.843 -18.406
  184    HB2  GLU  21           HB2      GLU  21  22.420  -1.288 -20.127
  185    HB3  GLU  21           HB3      GLU  21  22.114   0.107 -19.082
  186    HG2  GLU  21           HG2      GLU  21  23.954  -0.471 -17.623
  187    HG3  GLU  21           HG3      GLU  21  24.195  -2.028 -18.445
  188    H    GLU  22           H        GLU  22  20.297   0.061 -16.915
  189    HA   GLU  22           HA       GLU  22  21.993  -0.007 -14.580
  190    HB2  GLU  22           HB2      GLU  22  19.340   1.347 -15.153
  191    HB3  GLU  22           HB3      GLU  22  20.289   1.601 -13.678
  192    HG2  GLU  22           HG2      GLU  22  22.163   2.475 -14.977
  193    HG3  GLU  22           HG3      GLU  22  21.320   2.180 -16.492
  194    H    LEU  23           H        LEU  23  18.739  -1.235 -15.397
  195    HA   LEU  23           HA       LEU  23  18.073  -2.394 -12.874
  196    HG   LEU  23           HG       LEU  23  15.317  -4.126 -15.021
  197    HB2  LEU  23           HB2      LEU  23  16.411  -2.102 -14.573
  198    HB3  LEU  23           HB3      LEU  23  17.335  -2.954 -15.782
  199   HD11  LEU  23          HD11      LEU  23  16.142  -6.319 -14.974
  200   HD12  LEU  23          HD12      LEU  23  17.253  -5.384 -15.992
  201   HD13  LEU  23          HD13      LEU  23  17.708  -5.833 -14.336
  202   HD21  LEU  23          HD21      LEU  23  15.439  -3.436 -12.632
  203   HD22  LEU  23          HD22      LEU  23  15.219  -5.192 -12.831
  204   HD23  LEU  23          HD23      LEU  23  16.805  -4.529 -12.392
  205    H    LYS  24           H        LYS  24  19.721  -3.789 -15.741
  206    HA   LYS  24           HA       LYS  24  20.262  -6.329 -14.659
  207    HB2  LYS  24           HB2      LYS  24  20.418  -5.871 -17.003
  208    HB3  LYS  24           HB3      LYS  24  21.614  -4.600 -16.757
  209    HG2  LYS  24           HG2      LYS  24  23.314  -6.217 -16.128
  210    HG3  LYS  24           HG3      LYS  24  22.140  -7.551 -16.239
  211    HD2  LYS  24           HD2      LYS  24  21.919  -7.288 -18.619
  212    HD3  LYS  24           HD3      LYS  24  22.643  -5.682 -18.587
  213    HE2  LYS  24           HE2      LYS  24  24.247  -7.161 -19.541
  214    HE3  LYS  24           HE3      LYS  24  24.834  -6.606 -17.977
  215    HZ1  LYS  24           HZ1      LYS  24  24.178  -8.761 -17.046
  216    HZ2  LYS  24           HZ2      LYS  24  23.588  -9.256 -18.494
  217    HZ3  LYS  24           HZ3      LYS  24  25.181  -8.986 -18.305
  218    H    LYS  25           H        LYS  25  22.345  -3.389 -14.629
  219    HA   LYS  25           HA       LYS  25  24.461  -4.496 -13.129
  220    HB2  LYS  25           HB2      LYS  25  24.587  -2.356 -14.346
  221    HB3  LYS  25           HB3      LYS  25  23.387  -1.641 -13.276
  222    HG2  LYS  25           HG2      LYS  25  25.598  -0.848 -12.720
  223    HG3  LYS  25           HG3      LYS  25  24.939  -1.774 -11.372
  224    HD2  LYS  25           HD2      LYS  25  26.337  -3.720 -11.988
  225    HD3  LYS  25           HD3      LYS  25  26.926  -2.854 -13.428
  226    HE2  LYS  25           HE2      LYS  25  27.881  -1.089 -11.949
  227    HE3  LYS  25           HE3      LYS  25  27.312  -1.974 -10.528
  228    HZ1  LYS  25           HZ1      LYS  25  29.637  -2.425 -10.985
  229    HZ2  LYS  25           HZ2      LYS  25  28.785  -3.801 -11.161
  230    HZ3  LYS  25           HZ3      LYS  25  29.307  -2.980 -12.478
  231    H    SER  26           H        SER  26  21.484  -2.798 -11.975
  232    HA   SER  26           HA       SER  26  22.245  -2.862  -9.248
  233    HG   SER  26           HG       SER  26  20.694  -1.056 -11.271
  234    HB2  SER  26           HB2      SER  26  19.471  -2.670 -10.470
  235    HB3  SER  26           HB3      SER  26  19.926  -2.222  -8.808
  236    H    LEU  27           H        LEU  27  20.329  -5.169 -11.181
  237    HA   LEU  27           HA       LEU  27  19.644  -6.913  -9.001
  238    HG   LEU  27           HG       LEU  27  17.912  -6.140 -11.330
  239    HB2  LEU  27           HB2      LEU  27  19.993  -7.345 -11.984
  240    HB3  LEU  27           HB3      LEU  27  19.556  -8.662 -10.901
  241   HD11  LEU  27          HD11      LEU  27  17.366  -9.012 -12.177
  242   HD12  LEU  27          HD12      LEU  27  16.371  -7.584 -12.540
  243   HD13  LEU  27          HD13      LEU  27  17.988  -7.740 -13.241
  244   HD21  LEU  27          HD21      LEU  27  17.381  -8.640  -9.688
  245   HD22  LEU  27          HD22      LEU  27  17.443  -6.944  -9.123
  246   HD23  LEU  27          HD23      LEU  27  16.121  -7.474 -10.156
  247    H    TYR  28           H        TYR  28  22.439  -6.948 -11.321
  248    HA   TYR  28           HA       TYR  28  23.669  -9.206 -10.096
  249    HD1  TYR  28           HD1      TYR  28  24.946 -10.670 -11.907
  250    HD2  TYR  28           HD2      TYR  28  27.314  -7.189 -10.950
  251    HE1  TYR  28           HE1      TYR  28  26.973 -12.090 -11.778
  252    HE2  TYR  28           HE2      TYR  28  29.345  -8.595 -10.828
  253    HH   TYR  28           HH       TYR  28  30.223 -10.747 -11.011
  254    HB2  TYR  28           HB2      TYR  28  24.166  -8.266 -12.371
  255    HB3  TYR  28           HB3      TYR  28  25.011  -6.928 -11.601
  256    H    ALA  29           H        ALA  29  23.854  -5.720  -9.309
  257    HA   ALA  29           HA       ALA  29  26.008  -5.989  -7.445
  258    HB1  ALA  29           HB1      ALA  29  25.432  -3.858  -8.534
  259    HB2  ALA  29           HB2      ALA  29  23.863  -3.834  -7.697
  260    HB3  ALA  29           HB3      ALA  29  25.369  -3.704  -6.768
  261    H    ILE  30           H        ILE  30  22.440  -6.211  -7.036
  262    HA   ILE  30           HA       ILE  30  22.887  -6.501  -4.090
  263    HB   ILE  30           HB       ILE  30  20.364  -5.600  -5.500
  264   HG12  ILE  30          HG12      ILE  30  22.532  -3.895  -4.161
  265   HG13  ILE  30          HG13      ILE  30  22.209  -3.947  -5.891
  266   HG21  ILE  30          HG21      ILE  30  20.016  -6.576  -3.265
  267   HG22  ILE  30          HG22      ILE  30  21.205  -5.443  -2.578
  268   HG23  ILE  30          HG23      ILE  30  19.673  -4.858  -3.258
  269   HD11  ILE  30          HD11      ILE  30  21.244  -1.950  -5.059
  270   HD12  ILE  30          HD12      ILE  30  19.917  -3.045  -5.485
  271   HD13  ILE  30          HD13      ILE  30  20.369  -2.795  -3.778
  272    H    PHE  31           H        PHE  31  20.704  -7.781  -6.728
  273    HA   PHE  31           HA       PHE  31  19.526  -9.678  -4.908
  274    HD1  PHE  31           HD2      PHE  31  18.438  -7.010  -6.695
  275    HD2  PHE  31           HD1      PHE  31  16.583 -10.900  -6.601
  276    HE1  PHE  31           HE2      PHE  31  16.214  -5.958  -6.413
  277    HE2  PHE  31           HE1      PHE  31  14.368  -9.840  -6.306
  278    HZ   PHE  31           HZ       PHE  31  14.174  -7.367  -6.234
  279    HB2  PHE  31           HB2      PHE  31  19.416  -9.259  -7.891
  280    HB3  PHE  31           HB3      PHE  31  18.823 -10.745  -7.195
  281    H    SER  32           H        SER  32  22.420  -9.869  -7.060
  282    HA   SER  32           HA       SER  32  22.709 -12.661  -6.774
  283    HG   SER  32           HG       SER  32  24.832 -11.502  -9.160
  284    HB2  SER  32           HB2      SER  32  24.664 -10.450  -7.271
  285    HB3  SER  32           HB3      SER  32  25.294 -12.037  -6.827
  286    H    GLN  33           H        GLN  33  23.359 -10.099  -4.368
  287    HA   GLN  33           HA       GLN  33  24.920 -11.755  -2.604
  288    HB2  GLN  33           HB2      GLN  33  23.166  -9.368  -1.878
  289    HB3  GLN  33           HB3      GLN  33  24.448 -10.084  -0.913
  290    HG2  GLN  33           HG2      GLN  33  26.116  -9.429  -2.666
  291    HG3  GLN  33           HG3      GLN  33  24.819  -8.650  -3.575
  292   HE21  GLN  33          HE22      GLN  33  25.248  -6.444  -3.390
  293   HE22  GLN  33          HE21      GLN  33  25.494  -5.624  -1.861
  294    H    PHE  34           H        PHE  34  21.560 -11.772  -3.443
  295    HA   PHE  34           HA       PHE  34  20.843 -13.204  -0.938
  296    HD1  PHE  34           HD2      PHE  34  20.184 -11.805   0.880
  297    HD2  PHE  34           HD1      PHE  34  19.709  -9.117  -2.481
  298    HE1  PHE  34           HE2      PHE  34  20.928  -9.907   2.284
  299    HE2  PHE  34           HE1      PHE  34  20.435  -7.238  -1.051
  300    HZ   PHE  34           HZ       PHE  34  21.054  -7.616   1.320
  301    HB2  PHE  34           HB2      PHE  34  19.128 -11.449  -2.730
  302    HB3  PHE  34           HB3      PHE  34  18.604 -12.266  -1.258
  303    H    GLY  35           H        GLY  35  21.237 -13.741  -4.325
  304    HA2  GLY  35           HA2      GLY  35  20.342 -16.464  -3.847
  305    HA3  GLY  35           HA3      GLY  35  19.267 -15.575  -4.928
  306    H    GLN  36           H        GLN  36  22.500 -14.574  -5.362
  307    HA   GLN  36           HA       GLN  36  23.643 -14.409  -7.231
  308    HB2  GLN  36           HB2      GLN  36  24.376 -16.586  -5.963
  309    HB3  GLN  36           HB3      GLN  36  23.937 -17.354  -7.487
  310    HG2  GLN  36           HG2      GLN  36  25.861 -14.989  -7.151
  311    HG3  GLN  36           HG3      GLN  36  26.344 -16.670  -7.324
  312   HE21  GLN  36          HE22      GLN  36  25.211 -13.787  -9.116
  313   HE22  GLN  36          HE21      GLN  36  25.069 -14.600 -10.653
  314    H    ILE  37           H        ILE  37  22.780 -13.499  -8.898
  315    HA   ILE  37           HA       ILE  37  20.664 -14.246 -10.556
  316    HB   ILE  37           HB       ILE  37  23.228 -12.675 -11.073
  317   HG12  ILE  37          HG12      ILE  37  21.847 -11.720  -9.242
  318   HG13  ILE  37          HG13      ILE  37  21.998 -10.661 -10.631
  319   HG21  ILE  37          HG21      ILE  37  22.041 -11.562 -12.932
  320   HG22  ILE  37          HG22      ILE  37  22.354 -13.252 -13.244
  321   HG23  ILE  37          HG23      ILE  37  20.717 -12.755 -12.777
  322   HD11  ILE  37          HD11      ILE  37  19.572 -12.393 -10.022
  323   HD12  ILE  37          HD12      ILE  37  19.738 -10.672  -9.649
  324   HD13  ILE  37          HD13      ILE  37  19.737 -11.197 -11.335
  325    H    LEU  38           H        LEU  38  20.403 -15.694 -12.170
  326    HA   LEU  38           HA       LEU  38  22.794 -16.940 -13.422
  327    HG   LEU  38           HG       LEU  38  20.934 -18.804 -15.247
  328    HB2  LEU  38           HB2      LEU  38  21.350 -18.531 -12.233
  329    HB3  LEU  38           HB3      LEU  38  19.946 -17.964 -13.145
  330   HD11  LEU  38          HD11      LEU  38  23.338 -18.619 -14.784
  331   HD12  LEU  38          HD12      LEU  38  23.206 -19.794 -13.458
  332   HD13  LEU  38          HD13      LEU  38  22.941 -20.299 -15.143
  333   HD21  LEU  38          HD21      LEU  38  20.705 -21.202 -14.737
  334   HD22  LEU  38          HD22      LEU  38  20.889 -20.861 -12.999
  335   HD23  LEU  38          HD23      LEU  38  19.479 -20.252 -13.888
  336    H    ASP  39           H        ASP  39  19.579 -15.323 -13.993
  337    HA   ASP  39           HA       ASP  39  20.689 -14.143 -16.394
  338    HB2  ASP  39           HB2      ASP  39  19.951 -16.342 -17.319
  339    HB3  ASP  39           HB3      ASP  39  18.322 -16.034 -16.735
  340    H    ILE  40           H        ILE  40  19.027 -12.551 -17.366
  341    HA   ILE  40           HA       ILE  40  17.066 -11.538 -15.379
  342    HB   ILE  40           HB       ILE  40  19.505 -10.079 -16.478
  343   HG12  ILE  40          HG12      ILE  40  18.524 -10.381 -13.610
  344   HG13  ILE  40          HG13      ILE  40  19.723 -11.433 -14.336
  345   HG21  ILE  40          HG21      ILE  40  18.618  -8.001 -15.442
  346   HG22  ILE  40          HG22      ILE  40  17.609  -8.551 -16.750
  347   HG23  ILE  40          HG23      ILE  40  17.095  -8.851 -15.073
  348   HD11  ILE  40          HD11      ILE  40  20.749  -9.738 -12.898
  349   HD12  ILE  40          HD12      ILE  40  21.321  -9.646 -14.573
  350   HD13  ILE  40          HD13      ILE  40  20.149  -8.461 -13.949
  351    H    VAL  41           H        VAL  41  15.353 -10.456 -16.390
  352    HA   VAL  41           HA       VAL  41  15.462 -10.005 -19.318
  353    HB   VAL  41           HB       VAL  41  13.247 -11.506 -17.866
  354   HG11  VAL  41          HG11      VAL  41  13.632 -10.891 -20.832
  355   HG12  VAL  41          HG12      VAL  41  12.334 -11.884 -20.134
  356   HG13  VAL  41          HG13      VAL  41  12.410 -10.161 -19.766
  357   HG21  VAL  41          HG21      VAL  41  13.891 -13.463 -19.250
  358   HG22  VAL  41          HG22      VAL  41  15.331 -12.581 -19.803
  359   HG23  VAL  41          HG23      VAL  41  15.140 -13.023 -18.091
  360    H    ALA  42           H        ALA  42  15.383  -7.815 -19.233
  361    HA   ALA  42           HA       ALA  42  12.822  -6.607 -18.527
  362    HB1  ALA  42           HB1      ALA  42  15.504  -5.433 -17.645
  363    HB2  ALA  42           HB2      ALA  42  13.922  -4.639 -17.514
  364    HB3  ALA  42           HB3      ALA  42  14.256  -6.090 -16.555
  365    H    LEU  43           H        LEU  43  12.825  -4.374 -19.720
  366    HA   LEU  43           HA       LEU  43  14.640  -4.264 -22.055
  367    HG   LEU  43           HG       LEU  43  12.596  -6.646 -22.243
  368    HB2  LEU  43           HB2      LEU  43  11.608  -4.310 -22.271
  369    HB3  LEU  43           HB3      LEU  43  12.690  -3.913 -23.583
  370   HD11  LEU  43          HD11      LEU  43  11.425  -7.375 -24.279
  371   HD12  LEU  43          HD12      LEU  43  10.499  -6.133 -23.425
  372   HD13  LEU  43          HD13      LEU  43  11.409  -5.702 -24.886
  373   HD21  LEU  43          HD21      LEU  43  13.962  -5.695 -24.812
  374   HD22  LEU  43          HD22      LEU  43  14.786  -6.160 -23.309
  375   HD23  LEU  43          HD23      LEU  43  13.892  -7.372 -24.227
  376    H    LYS  44           H        LYS  44  14.294  -2.146 -23.225
  377    HA   LYS  44           HA       LYS  44  13.912  -0.027 -21.262
  378    HB2  LYS  44           HB2      LYS  44  14.700   1.474 -22.959
  379    HB3  LYS  44           HB3      LYS  44  15.734   0.045 -22.932
  380    HG2  LYS  44           HG2      LYS  44  14.382  -0.851 -24.913
  381    HG3  LYS  44           HG3      LYS  44  13.576   0.719 -24.987
  382    HD2  LYS  44           HD2      LYS  44  16.555   0.181 -25.341
  383    HD3  LYS  44           HD3      LYS  44  15.390   0.581 -26.612
  384    HE2  LYS  44           HE2      LYS  44  14.974   2.790 -25.468
  385    HE3  LYS  44           HE3      LYS  44  16.250   2.389 -24.307
  386    HZ1  LYS  44           HZ1      LYS  44  17.089   3.767 -26.101
  387    HZ2  LYS  44           HZ2      LYS  44  17.814   2.308 -26.172
  388    HZ3  LYS  44           HZ3      LYS  44  16.631   2.691 -27.232
  389    H    THR  45           H        THR  45  11.741  -1.695 -23.356
  390    HA   THR  45           HA       THR  45   9.906   0.449 -23.913
  391    HB   THR  45           HB       THR  45   8.386  -1.675 -24.208
  392    HG1  THR  45           HG1      THR  45   9.505  -3.579 -24.384
  393   HG21  THR  45          HG21      THR  45  10.911  -1.325 -25.899
  394   HG22  THR  45          HG22      THR  45   9.421  -2.157 -26.400
  395   HG23  THR  45          HG23      THR  45   9.395  -0.415 -26.089
  396    H    LEU  46           H        LEU  46   8.175   1.113 -22.703
  397    HA   LEU  46           HA       LEU  46   8.498   1.464 -20.077
  398    HG   LEU  46           HG       LEU  46   5.402   1.416 -19.126
  399    HB2  LEU  46           HB2      LEU  46   6.926   2.732 -21.430
  400    HB3  LEU  46           HB3      LEU  46   5.856   1.336 -21.571
  401   HD11  LEU  46          HD11      LEU  46   6.097   3.414 -17.817
  402   HD12  LEU  46          HD12      LEU  46   7.474   2.416 -18.278
  403   HD13  LEU  46          HD13      LEU  46   7.144   3.924 -19.161
  404   HD21  LEU  46          HD21      LEU  46   4.041   3.449 -19.149
  405   HD22  LEU  46          HD22      LEU  46   4.946   4.063 -20.552
  406   HD23  LEU  46          HD23      LEU  46   3.943   2.602 -20.698
  407    H    LYS  47           H        LYS  47   6.196  -1.137 -21.234
  408    HA   LYS  47           HA       LYS  47   5.518  -1.706 -18.539
  409    HB2  LYS  47           HB2      LYS  47   4.200  -2.322 -20.685
  410    HB3  LYS  47           HB3      LYS  47   5.209  -3.785 -20.734
  411    HG2  LYS  47           HG2      LYS  47   4.503  -4.260 -18.357
  412    HG3  LYS  47           HG3      LYS  47   3.474  -2.824 -18.407
  413    HD2  LYS  47           HD2      LYS  47   2.202  -3.881 -20.318
  414    HD3  LYS  47           HD3      LYS  47   3.167  -5.357 -20.068
  415    HE2  LYS  47           HE2      LYS  47   2.402  -5.415 -17.683
  416    HE3  LYS  47           HE3      LYS  47   1.419  -3.974 -17.976
  417    HZ1  LYS  47           HZ1      LYS  47   0.042  -5.884 -18.139
  418    HZ2  LYS  47           HZ2      LYS  47   0.200  -5.322 -19.662
  419    HZ3  LYS  47           HZ3      LYS  47   1.044  -6.654 -19.165
  420    H    MET  48           H        MET  48   7.932  -3.260 -20.684
  421    HA   MET  48           HA       MET  48   8.785  -5.091 -18.569
  422    HB2  MET  48           HB2      MET  48   9.474  -4.613 -21.458
  423    HB3  MET  48           HB3      MET  48  10.653  -5.464 -20.463
  424    HG2  MET  48           HG2      MET  48   7.824  -6.420 -20.273
  425    HG3  MET  48           HG3      MET  48   8.693  -6.715 -21.774
  426    HE1  MET  48           HE1      MET  48  10.251  -6.727 -18.037
  427    HE2  MET  48           HE2      MET  48   8.613  -7.419 -17.885
  428    HE3  MET  48           HE3      MET  48  10.044  -8.446 -17.672
  429    H    ARG  49           H        ARG  49   9.068  -1.935 -18.559
  430    HA   ARG  49           HA       ARG  49  11.778  -1.972 -17.329
  431    HE   ARG  49           HE       ARG  49  14.033   2.490 -17.904
  432    HB2  ARG  49           HB2      ARG  49  11.184  -0.506 -19.368
  433    HB3  ARG  49           HB3      ARG  49  10.203   0.456 -18.261
  434    HG2  ARG  49           HG2      ARG  49  12.219   1.037 -16.976
  435    HG3  ARG  49           HG3      ARG  49  13.198  -0.070 -17.980
  436    HD2  ARG  49           HD2      ARG  49  12.601   1.157 -19.998
  437    HD3  ARG  49           HD3      ARG  49  11.561   2.262 -19.085
  438   HH11  ARG  49          HH21      ARG  49  12.894   2.790 -21.268
  439   HH12  ARG  49          HH22      ARG  49  13.867   4.174 -21.626
  440   HH21  ARG  49          HH11      ARG  49  15.187   4.472 -18.331
  441   HH22  ARG  49          HH12      ARG  49  15.301   5.069 -19.948
  442    H    GLY  50           H        GLY  50   8.310  -1.232 -16.907
  443    HA2  GLY  50           HA2      GLY  50   8.614  -0.485 -14.084
  444    HA3  GLY  50           HA3      GLY  50   7.113  -0.695 -15.003
  445    H    GLN  51           H        GLN  51   8.489  -3.392 -15.928
  446    HA   GLN  51           HA       GLN  51   8.142  -5.042 -13.496
  447    HB2  GLN  51           HB2      GLN  51   7.263  -5.769 -16.334
  448    HB3  GLN  51           HB3      GLN  51   7.105  -6.772 -14.894
  449    HG2  GLN  51           HG2      GLN  51   5.532  -5.072 -13.929
  450    HG3  GLN  51           HG3      GLN  51   5.596  -4.184 -15.456
  451   HE21  GLN  51          HE22      GLN  51   3.837  -6.495 -13.778
  452   HE22  GLN  51          HE21      GLN  51   3.107  -7.344 -15.101
  453    H    ALA  52           H        ALA  52   9.347  -7.154 -13.784
  454    HA   ALA  52           HA       ALA  52  11.213  -7.454 -15.976
  455    HB1  ALA  52           HB1      ALA  52  12.537  -5.889 -14.593
  456    HB2  ALA  52           HB2      ALA  52  12.332  -6.945 -13.178
  457    HB3  ALA  52           HB3      ALA  52  13.259  -7.503 -14.585
  458    H    PHE  53           H        PHE  53  12.538  -9.528 -15.547
  459    HA   PHE  53           HA       PHE  53  11.414 -11.294 -13.479
  460    HD1  PHE  53           HD2      PHE  53  10.299 -10.714 -17.470
  461    HD2  PHE  53           HD1      PHE  53   9.029 -13.224 -14.203
  462    HE1  PHE  53           HE2      PHE  53   7.933 -10.328 -18.092
  463    HE2  PHE  53           HE1      PHE  53   6.660 -12.879 -14.865
  464    HZ   PHE  53           HZ       PHE  53   6.104 -11.414 -16.797
  465    HB2  PHE  53           HB2      PHE  53  11.861 -12.240 -16.337
  466    HB3  PHE  53           HB3      PHE  53  11.360 -13.214 -14.977
  467    H    VAL  54           H        VAL  54  13.028 -12.933 -12.885
  468    HA   VAL  54           HA       VAL  54  15.668 -12.765 -14.097
  469    HB   VAL  54           HB       VAL  54  15.965 -10.840 -12.885
  470   HG11  VAL  54          HG11      VAL  54  15.407 -10.370 -10.580
  471   HG12  VAL  54          HG12      VAL  54  13.936 -10.868 -11.408
  472   HG13  VAL  54          HG13      VAL  54  14.793 -12.009 -10.347
  473   HG21  VAL  54          HG21      VAL  54  17.832 -12.317 -12.470
  474   HG22  VAL  54          HG22      VAL  54  17.502 -11.309 -11.051
  475   HG23  VAL  54          HG23      VAL  54  17.029 -13.015 -11.056
  476    H    ILE  55           H        ILE  55  16.942 -14.456 -13.567
  477    HA   ILE  55           HA       ILE  55  15.543 -16.819 -12.450
  478    HB   ILE  55           HB       ILE  55  17.564 -16.644 -14.728
  479   HG12  ILE  55          HG12      ILE  55  15.793 -17.452 -16.267
  480   HG13  ILE  55          HG13      ILE  55  14.582 -17.184 -15.040
  481   HG21  ILE  55          HG21      ILE  55  17.638 -18.778 -13.514
  482   HG22  ILE  55          HG22      ILE  55  15.884 -18.982 -13.740
  483   HG23  ILE  55          HG23      ILE  55  16.990 -19.017 -15.128
  484   HD11  ILE  55          HD11      ILE  55  16.307 -14.951 -16.200
  485   HD12  ILE  55          HD12      ILE  55  14.767 -15.469 -16.903
  486   HD13  ILE  55          HD13      ILE  55  14.790 -14.780 -15.290
  487    H    PHE  56           H        PHE  56  16.871 -18.108 -11.101
  488    HA   PHE  56           HA       PHE  56  19.464 -16.878 -10.251
  489    HD1  PHE  56           HD1      PHE  56  19.509 -15.396  -7.802
  490    HD2  PHE  56           HD2      PHE  56  15.604 -16.361  -9.330
  491    HE1  PHE  56           HE1      PHE  56  18.829 -13.012  -7.548
  492    HE2  PHE  56           HE2      PHE  56  14.948 -13.994  -9.150
  493    HZ   PHE  56           HZ       PHE  56  16.542 -12.304  -8.269
  494    HB2  PHE  56           HB2      PHE  56  17.198 -18.128  -8.670
  495    HB3  PHE  56           HB3      PHE  56  18.743 -17.699  -7.962
  496    H    LYS  57           H        LYS  57  20.729 -18.287  -8.840
  497    HA   LYS  57           HA       LYS  57  21.787 -20.520 -10.036
  498    HB2  LYS  57           HB2      LYS  57  22.862 -19.232  -8.315
  499    HB3  LYS  57           HB3      LYS  57  21.609 -19.630  -7.127
  500    HG2  LYS  57           HG2      LYS  57  22.329 -21.910  -6.996
  501    HG3  LYS  57           HG3      LYS  57  23.401 -21.717  -8.393
  502    HD2  LYS  57           HD2      LYS  57  24.701 -21.741  -6.313
  503    HD3  LYS  57           HD3      LYS  57  24.850 -20.206  -7.152
  504    HE2  LYS  57           HE2      LYS  57  24.678 -19.790  -4.791
  505    HE3  LYS  57           HE3      LYS  57  23.233 -19.157  -5.580
  506    HZ1  LYS  57           HZ1      LYS  57  23.329 -21.789  -4.210
  507    HZ2  LYS  57           HZ2      LYS  57  22.834 -20.415  -3.494
  508    HZ3  LYS  57           HZ3      LYS  57  21.976 -21.003  -4.738
  509    H    GLU  58           H        GLU  58  19.137 -20.582  -7.542
  510    HA   GLU  58           HA       GLU  58  18.325 -23.239  -8.432
  511    HB2  GLU  58           HB2      GLU  58  20.274 -23.600  -6.842
  512    HB3  GLU  58           HB3      GLU  58  19.346 -22.789  -5.582
  513    HG2  GLU  58           HG2      GLU  58  17.648 -24.553  -5.643
  514    HG3  GLU  58           HG3      GLU  58  18.427 -25.298  -7.042
  515    H    ILE  59           H        ILE  59  16.239 -23.825  -7.307
  516    HA   ILE  59           HA       ILE  59  14.472 -21.646  -7.173
  517    HB   ILE  59           HB       ILE  59  12.789 -23.205  -6.528
  518   HG12  ILE  59          HG12      ILE  59  15.000 -25.188  -5.815
  519   HG13  ILE  59          HG13      ILE  59  13.874 -24.418  -4.694
  520   HG21  ILE  59          HG21      ILE  59  13.802 -23.297  -8.845
  521   HG22  ILE  59          HG22      ILE  59  14.659 -24.765  -8.346
  522   HG23  ILE  59          HG23      ILE  59  12.883 -24.714  -8.353
  523   HD11  ILE  59          HD11      ILE  59  13.128 -26.655  -5.052
  524   HD12  ILE  59          HD12      ILE  59  11.974 -25.575  -5.859
  525   HD13  ILE  59          HD13      ILE  59  13.177 -26.478  -6.812
  526    H    GLY  60           H        GLY  60  16.266 -23.205  -4.499
  527    HA2  GLY  60           HA2      GLY  60  14.797 -21.855  -2.403
  528    HA3  GLY  60           HA3      GLY  60  16.377 -22.651  -2.265
  529    H    SER  61           H        SER  61  17.705 -21.123  -4.350
  530    HA   SER  61           HA       SER  61  18.531 -18.815  -2.833
  531    HG   SER  61           HG       SER  61  19.995 -20.725  -3.461
  532    HB2  SER  61           HB2      SER  61  19.129 -19.341  -5.764
  533    HB3  SER  61           HB3      SER  61  20.119 -18.519  -4.548
  534    H    ALA  62           H        ALA  62  16.529 -19.359  -5.765
  535    HA   ALA  62           HA       ALA  62  15.825 -16.675  -6.312
  536    HB1  ALA  62           HB1      ALA  62  13.884 -17.644  -7.446
  537    HB2  ALA  62           HB2      ALA  62  15.293 -18.668  -7.774
  538    HB3  ALA  62           HB3      ALA  62  14.091 -19.173  -6.579
  539    H    SER  63           H        SER  63  14.219 -19.104  -4.165
  540    HA   SER  63           HA       SER  63  12.113 -17.459  -3.300
  541    HG   SER  63           HG       SER  63  12.862 -20.452  -3.677
  542    HB2  SER  63           HB2      SER  63  13.536 -19.617  -1.683
  543    HB3  SER  63           HB3      SER  63  11.901 -18.996  -1.416
  544    H    ASN  64           H        ASN  64  15.393 -17.829  -1.935
  545    HA   ASN  64           HA       ASN  64  14.932 -16.120   0.306
  546    HB2  ASN  64           HB2      ASN  64  16.832 -17.718   0.162
  547    HB3  ASN  64           HB3      ASN  64  17.575 -16.711  -1.086
  548   HD21  ASN  64          HD22      ASN  64  18.760 -14.891  -0.421
  549   HD22  ASN  64          HD21      ASN  64  18.850 -14.339   1.248
  550    H    ALA  65           H        ALA  65  16.356 -15.422  -2.926
  551    HA   ALA  65           HA       ALA  65  16.802 -12.668  -2.570
  552    HB1  ALA  65           HB1      ALA  65  15.915 -14.113  -5.122
  553    HB2  ALA  65           HB2      ALA  65  16.731 -12.544  -5.015
  554    HB3  ALA  65           HB3      ALA  65  17.590 -14.012  -4.526
  555    H    LEU  66           H        LEU  66  13.921 -14.358  -3.840
  556    HA   LEU  66           HA       LEU  66  12.263 -12.199  -4.383
  557    HG   LEU  66           HG       LEU  66  10.245 -13.308  -5.576
  558    HB2  LEU  66           HB2      LEU  66  12.015 -14.735  -4.803
  559    HB3  LEU  66           HB3      LEU  66  11.331 -14.856  -3.200
  560   HD11  LEU  66          HD11      LEU  66  10.023 -15.720  -5.789
  561   HD12  LEU  66          HD12      LEU  66   9.343 -15.848  -4.159
  562   HD13  LEU  66          HD13      LEU  66   8.438 -15.025  -5.444
  563   HD21  LEU  66          HD21      LEU  66   9.550 -12.093  -3.564
  564   HD22  LEU  66          HD22      LEU  66   8.182 -12.976  -4.212
  565   HD23  LEU  66          HD23      LEU  66   9.051 -13.615  -2.790
  566    H    ARG  67           H        ARG  67  12.306 -14.134  -1.312
  567    HA   ARG  67           HA       ARG  67  10.387 -12.384  -0.098
  568    HE   ARG  67           HE       ARG  67   8.703 -15.659   2.890
  569    HB2  ARG  67           HB2      ARG  67  12.258 -14.509   1.043
  570    HB3  ARG  67           HB3      ARG  67  11.070 -13.636   2.024
  571    HG2  ARG  67           HG2      ARG  67   9.230 -14.424   0.623
  572    HG3  ARG  67           HG3      ARG  67  10.354 -15.237  -0.476
  573    HD2  ARG  67           HD2      ARG  67   9.417 -16.909   0.955
  574    HD3  ARG  67           HD3      ARG  67  11.106 -16.705   1.407
  575   HH11  ARG  67          HH11      ARG  67  12.150 -16.581   3.063
  576   HH12  ARG  67          HH12      ARG  67  12.226 -16.352   4.770
  577   HH21  ARG  67          HH21      ARG  67   8.785 -15.398   4.979
  578   HH22  ARG  67          HH22      ARG  67  10.230 -15.650   5.941
  579    H    THR  68           H        THR  68  13.994 -12.406   0.021
  580    HA   THR  68           HA       THR  68  14.143 -10.492   2.151
  581    HB   THR  68           HB       THR  68  16.168 -11.030  -0.067
  582    HG1  THR  68           HG1      THR  68  15.810 -12.916   0.903
  583   HG21  THR  68          HG21      THR  68  16.455  -9.847   2.736
  584   HG22  THR  68          HG22      THR  68  17.813 -10.367   1.718
  585   HG23  THR  68          HG23      THR  68  16.783  -9.033   1.189
  586    H    MET  69           H        MET  69  13.950 -10.162  -1.425
  587    HA   MET  69           HA       MET  69  14.280  -7.259  -1.209
  588    HB2  MET  69           HB2      MET  69  13.936  -9.088  -3.611
  589    HB3  MET  69           HB3      MET  69  14.294  -7.364  -3.674
  590    HG2  MET  69           HG2      MET  69  16.060  -9.538  -2.458
  591    HG3  MET  69           HG3      MET  69  16.349  -8.691  -3.957
  592    HE1  MET  69           HE1      MET  69  17.261  -6.184  -4.144
  593    HE2  MET  69           HE2      MET  69  15.750  -5.668  -3.356
  594    HE3  MET  69           HE3      MET  69  17.319  -5.080  -2.760
  595    H    GLN  70           H        GLN  70  11.600  -9.374  -1.105
  596    HA   GLN  70           HA       GLN  70   9.586  -7.913  -2.358
  597    HB2  GLN  70           HB2      GLN  70   9.351 -10.181  -1.344
  598    HB3  GLN  70           HB3      GLN  70   9.536  -9.485   0.263
  599    HG2  GLN  70           HG2      GLN  70   7.258 -10.008  -0.073
  600    HG3  GLN  70           HG3      GLN  70   7.375  -8.247  -0.067
  601   HE21  GLN  70          HE22      GLN  70   5.889 -10.801  -1.651
  602   HE22  GLN  70          HE21      GLN  70   5.776 -10.159  -3.273
  603    H    GLY  71           H        GLY  71   8.800  -5.890  -2.066
  604    HA2  GLY  71           HA2      GLY  71   8.163  -3.948  -1.060
  605    HA3  GLY  71           HA3      GLY  71   8.491  -4.664   0.519
  606    H    PHE  72           H        PHE  72  11.363  -4.982  -1.301
  607    HA   PHE  72           HA       PHE  72  12.632  -3.086   0.450
  608    HD1  PHE  72           HD2      PHE  72  15.052  -4.277   1.537
  609    HD2  PHE  72           HD1      PHE  72  15.502  -3.039  -2.567
  610    HE1  PHE  72           HE2      PHE  72  17.251  -3.261   2.082
  611    HE2  PHE  72           HE1      PHE  72  17.698  -2.012  -2.017
  612    HZ   PHE  72           HZ       PHE  72  18.575  -2.123   0.307
  613    HB2  PHE  72           HB2      PHE  72  13.643  -5.225  -0.292
  614    HB3  PHE  72           HB3      PHE  72  13.756  -4.600  -1.937
  615    HA   PRO  73           HA       PRO  73  12.493   0.363  -2.525
  616    HB2  PRO  73           HB2      PRO  73  14.011   2.205  -1.249
  617    HB3  PRO  73           HB3      PRO  73  12.393   1.718  -0.663
  618    HG2  PRO  73           HG2      PRO  73  15.091   0.701   0.299
  619    HG3  PRO  73           HG3      PRO  73  13.712   1.283   1.284
  620    HD2  PRO  73           HD2      PRO  73  14.164  -1.375   0.764
  621    HD3  PRO  73           HD3      PRO  73  12.517  -0.708   0.956
  622    H    PHE  74           H        PHE  74  13.576  -1.156  -3.971
  623    HA   PHE  74           HA       PHE  74  16.431  -1.437  -4.212
  624    HD1  PHE  74           HD1      PHE  74  17.387  -3.475  -5.463
  625    HD2  PHE  74           HD2      PHE  74  14.743  -1.812  -8.443
  626    HE1  PHE  74           HE1      PHE  74  18.741  -4.524  -7.262
  627    HE2  PHE  74           HE2      PHE  74  16.091  -2.870 -10.229
  628    HZ   PHE  74           HZ       PHE  74  18.051  -4.276  -9.643
  629    HB2  PHE  74           HB2      PHE  74  14.747  -2.946  -5.162
  630    HB3  PHE  74           HB3      PHE  74  14.147  -1.660  -6.204
  631    H    TYR  75           H        TYR  75  14.099   0.921  -5.256
  632    HA   TYR  75           HA       TYR  75  16.075   2.964  -5.714
  633    HD1  TYR  75           HD2      TYR  75  17.010   4.498  -7.699
  634    HD2  TYR  75           HD1      TYR  75  16.060   0.483  -8.972
  635    HE1  TYR  75           HE2      TYR  75  19.207   4.344  -8.816
  636    HE2  TYR  75           HE1      TYR  75  18.260   0.322 -10.103
  637    HH   TYR  75           HH       TYR  75  20.628   3.039 -10.100
  638    HB2  TYR  75           HB2      TYR  75  14.341   1.875  -7.955
  639    HB3  TYR  75           HB3      TYR  75  14.622   3.600  -7.881
  640    H    ASP  76           H        ASP  76  14.111   4.878  -6.525
  641    HA   ASP  76           HA       ASP  76  12.894   5.450  -4.047
  642    HB2  ASP  76           HB2      ASP  76  13.731   7.067  -5.768
  643    HB3  ASP  76           HB3      ASP  76  12.336   6.673  -6.773
  644    H    LYS  77           H        LYS  77  11.872   2.861  -5.351
  645    HA   LYS  77           HA       LYS  77   9.091   3.310  -4.672
  646    HB2  LYS  77           HB2      LYS  77   9.905   1.984  -7.307
  647    HB3  LYS  77           HB3      LYS  77   8.333   1.771  -6.537
  648    HG2  LYS  77           HG2      LYS  77   7.996   4.268  -6.632
  649    HG3  LYS  77           HG3      LYS  77   9.480   4.380  -7.600
  650    HD2  LYS  77           HD2      LYS  77   8.468   2.892  -9.314
  651    HD3  LYS  77           HD3      LYS  77   6.998   2.761  -8.331
  652    HE2  LYS  77           HE2      LYS  77   6.672   5.213  -8.458
  653    HE3  LYS  77           HE3      LYS  77   8.128   5.373  -9.447
  654    HZ1  LYS  77           HZ1      LYS  77   6.037   5.339 -10.723
  655    HZ2  LYS  77           HZ2      LYS  77   7.063   4.180 -11.214
  656    HZ3  LYS  77           HZ3      LYS  77   5.759   3.798 -10.275
  657    HA   PRO  78           HA       PRO  78  10.320  -0.543  -2.674
  658    HB2  PRO  78           HB2      PRO  78   7.899  -1.428  -1.749
  659    HB3  PRO  78           HB3      PRO  78   8.793  -0.068  -1.002
  660    HG2  PRO  78           HG2      PRO  78   6.503   0.066  -2.980
  661    HG3  PRO  78           HG3      PRO  78   6.731   1.014  -1.478
  662    HD2  PRO  78           HD2      PRO  78   7.383   1.984  -3.959
  663    HD3  PRO  78           HD3      PRO  78   8.312   2.424  -2.496
  664    H    MET  79           H        MET  79  10.695  -2.458  -3.670
  665    HA   MET  79           HA       MET  79   9.541  -3.204  -6.181
  666    HB2  MET  79           HB2      MET  79  11.017  -4.821  -4.054
  667    HB3  MET  79           HB3      MET  79  10.671  -5.409  -5.684
  668    HG2  MET  79           HG2      MET  79  12.274  -2.891  -5.120
  669    HG3  MET  79           HG3      MET  79  12.994  -4.483  -5.284
  670    HE1  MET  79           HE1      MET  79  13.672  -4.904  -8.852
  671    HE2  MET  79           HE2      MET  79  14.306  -4.850  -7.194
  672    HE3  MET  79           HE3      MET  79  12.941  -5.920  -7.585
  673    H    GLN  80           H        GLN  80   7.973  -4.792  -6.667
  674    HA   GLN  80           HA       GLN  80   6.569  -6.127  -4.399
  675    HB2  GLN  80           HB2      GLN  80   5.343  -4.906  -6.918
  676    HB3  GLN  80           HB3      GLN  80   4.489  -5.980  -5.808
  677    HG2  GLN  80           HG2      GLN  80   5.660  -3.270  -5.010
  678    HG3  GLN  80           HG3      GLN  80   4.000  -3.531  -5.513
  679   HE21  GLN  80          HE22      GLN  80   6.378  -4.291  -2.928
  680   HE22  GLN  80          HE21      GLN  80   5.166  -4.684  -1.723
  681    H    ILE  81           H        ILE  81   6.814  -8.292  -4.657
  682    HA   ILE  81           HA       ILE  81   7.719  -9.260  -7.323
  683    HB   ILE  81           HB       ILE  81   8.906 -10.149  -4.682
  684   HG12  ILE  81          HG12      ILE  81   9.858  -7.846  -6.425
  685   HG13  ILE  81          HG13      ILE  81   9.437  -7.821  -4.706
  686   HG21  ILE  81          HG21      ILE  81   9.207 -11.621  -6.709
  687   HG22  ILE  81          HG22      ILE  81  10.015 -10.278  -7.524
  688   HG23  ILE  81          HG23      ILE  81  10.712 -11.013  -6.064
  689   HD11  ILE  81          HD11      ILE  81  11.413  -9.297  -4.248
  690   HD12  ILE  81          HD12      ILE  81  11.905  -9.064  -5.946
  691   HD13  ILE  81          HD13      ILE  81  11.798  -7.674  -4.864
  692    H    ALA  82           H        ALA  82   7.299 -11.438  -7.768
  693    HA   ALA  82           HA       ALA  82   5.839 -13.108  -5.854
  694    HB1  ALA  82           HB1      ALA  82   4.759 -12.484  -8.644
  695    HB2  ALA  82           HB2      ALA  82   4.111 -13.713  -7.539
  696    HB3  ALA  82           HB3      ALA  82   4.007 -11.996  -7.109
  697    H    TYR  83           H        TYR  83   5.716 -15.404  -6.922
  698    HA   TYR  83           HA       TYR  83   8.319 -15.987  -8.190
  699    HD1  TYR  83           HD1      TYR  83   5.164 -16.826  -5.590
  700    HD2  TYR  83           HD2      TYR  83   6.028 -19.683  -8.709
  701    HE1  TYR  83           HE1      TYR  83   2.946 -17.854  -5.250
  702    HE2  TYR  83           HE2      TYR  83   3.826 -20.750  -8.341
  703    HH   TYR  83           HH       TYR  83   1.463 -19.531  -5.921
  704    HB2  TYR  83           HB2      TYR  83   7.764 -18.293  -7.880
  705    HB3  TYR  83           HB3      TYR  83   7.576 -17.425  -6.379
  706    H    SER  84           H        SER  84   8.478 -16.773 -10.382
  707    HA   SER  84           HA       SER  84   6.551 -15.665 -12.142
  708    HG   SER  84           HG       SER  84   9.506 -15.437 -13.542
  709    HB2  SER  84           HB2      SER  84   8.824 -17.633 -12.627
  710    HB3  SER  84           HB3      SER  84   7.897 -16.813 -13.903
  711    H    LYS  85           H        LYS  85   5.583 -16.940 -13.971
  712    HA   LYS  85           HA       LYS  85   4.091 -19.333 -12.978
  713    HB2  LYS  85           HB2      LYS  85   3.158 -17.013 -14.730
  714    HB3  LYS  85           HB3      LYS  85   2.187 -18.418 -14.342
  715    HG2  LYS  85           HG2      LYS  85   3.170 -16.411 -12.254
  716    HG3  LYS  85           HG3      LYS  85   1.635 -16.335 -13.088
  717    HD2  LYS  85           HD2      LYS  85   0.947 -17.357 -11.174
  718    HD3  LYS  85           HD3      LYS  85   1.218 -18.748 -12.202
  719    HE2  LYS  85           HE2      LYS  85   2.100 -19.295 -10.074
  720    HE3  LYS  85           HE3      LYS  85   3.504 -19.020 -11.103
  721    HZ1  LYS  85           HZ1      LYS  85   2.389 -17.016  -9.216
  722    HZ2  LYS  85           HZ2      LYS  85   3.681 -17.976  -8.916
  723    HZ3  LYS  85           HZ3      LYS  85   3.791 -16.856 -10.072
  724    H    SER  86           H        SER  86   2.957 -20.266 -15.170
  725    HA   SER  86           HA       SER  86   4.905 -21.499 -16.721
  726    HG   SER  86           HG       SER  86   1.537 -22.789 -16.430
  727    HB2  SER  86           HB2      SER  86   2.055 -20.846 -17.568
  728    HB3  SER  86           HB3      SER  86   3.040 -22.232 -18.072
  729    H    ASP  87           H        ASP  87   5.601 -21.196 -18.898
  730    HA   ASP  87           HA       ASP  87   6.518 -18.665 -19.533
  731    HB2  ASP  87           HB2      ASP  87   7.491 -20.690 -20.437
  732    HB3  ASP  87           HB3      ASP  87   6.029 -21.030 -21.367
  733    H    SER  88           H        SER  88   3.632 -20.305 -20.977
  734    HA   SER  88           HA       SER  88   2.929 -18.230 -22.727
  735    HG   SER  88           HG       SER  88   1.518 -21.572 -22.986
  736    HB2  SER  88           HB2      SER  88   0.967 -20.073 -21.320
  737    HB3  SER  88           HB3      SER  88   0.855 -19.373 -22.948
  738    H    ASP  89           H        ASP  89   2.275 -18.586 -19.219
  739    HA   ASP  89           HA       ASP  89   0.173 -16.572 -19.295
  740    HB2  ASP  89           HB2      ASP  89   0.054 -18.434 -17.691
  741    HB3  ASP  89           HB3      ASP  89   1.579 -17.929 -16.957
  742    H    ILE  90           H        ILE  90   3.644 -16.684 -18.395
  743    HA   ILE  90           HA       ILE  90   3.626 -13.888 -17.576
  744    HB   ILE  90           HB       ILE  90   6.026 -13.900 -17.699
  745   HG12  ILE  90          HG12      ILE  90   5.878 -16.785 -18.619
  746   HG13  ILE  90          HG13      ILE  90   6.348 -15.422 -19.649
  747   HG21  ILE  90          HG21      ILE  90   4.979 -16.404 -16.329
  748   HG22  ILE  90          HG22      ILE  90   6.366 -15.401 -15.835
  749   HG23  ILE  90          HG23      ILE  90   4.728 -14.746 -15.729
  750   HD11  ILE  90          HD11      ILE  90   8.344 -16.535 -18.913
  751   HD12  ILE  90          HD12      ILE  90   8.262 -14.962 -18.096
  752   HD13  ILE  90          HD13      ILE  90   7.853 -16.457 -17.216
  753    H    VAL  91           H        VAL  91   3.932 -15.575 -20.708
  754    HA   VAL  91           HA       VAL  91   4.530 -13.202 -22.143
  755    HB   VAL  91           HB       VAL  91   3.399 -15.884 -22.912
  756   HG11  VAL  91          HG11      VAL  91   2.205 -14.428 -24.432
  757   HG12  VAL  91          HG12      VAL  91   3.692 -13.515 -24.798
  758   HG13  VAL  91          HG13      VAL  91   3.523 -15.212 -25.303
  759   HG21  VAL  91          HG21      VAL  91   5.846 -15.570 -22.472
  760   HG22  VAL  91          HG22      VAL  91   5.497 -16.046 -24.137
  761   HG23  VAL  91          HG23      VAL  91   5.895 -14.354 -23.761
  762    H    ALA  92           H        ALA  92   1.342 -14.618 -21.109
  763    HA   ALA  92           HA       ALA  92  -0.272 -12.570 -22.235
  764    HB1  ALA  92           HB1      ALA  92  -1.623 -14.174 -21.324
  765    HB2  ALA  92           HB2      ALA  92  -0.620 -14.416 -19.882
  766    HB3  ALA  92           HB3      ALA  92  -1.678 -13.009 -20.017
  767    H    LYS  93           H        LYS  93   1.465 -12.652 -19.076
  768    HA   LYS  93           HA       LYS  93   0.476 -10.182 -18.120
  769    HB2  LYS  93           HB2      LYS  93   3.019 -11.731 -17.520
  770    HB3  LYS  93           HB3      LYS  93   2.649 -10.208 -16.716
  771    HG2  LYS  93           HG2      LYS  93   0.676 -11.030 -15.716
  772    HG3  LYS  93           HG3      LYS  93   0.615 -12.466 -16.749
  773    HD2  LYS  93           HD2      LYS  93   2.431 -13.515 -15.626
  774    HD3  LYS  93           HD3      LYS  93   2.932 -12.014 -14.848
  775    HE2  LYS  93           HE2      LYS  93   1.855 -13.483 -13.229
  776    HE3  LYS  93           HE3      LYS  93   0.917 -12.003 -13.448
  777    HZ1  LYS  93           HZ1      LYS  93  -0.468 -14.003 -13.403
  778    HZ2  LYS  93           HZ2      LYS  93  -0.619 -13.242 -14.838
  779    HZ3  LYS  93           HZ3      LYS  93   0.285 -14.607 -14.729
  780    H    ILE  94           H        ILE  94   3.538 -10.738 -20.034
  781    HA   ILE  94           HA       ILE  94   4.003  -7.880 -20.089
  782    HB   ILE  94           HB       ILE  94   5.741  -8.282 -21.694
  783   HG12  ILE  94          HG12      ILE  94   4.798 -11.161 -21.789
  784   HG13  ILE  94          HG13      ILE  94   4.683 -10.000 -23.109
  785   HG21  ILE  94          HG21      ILE  94   7.180  -9.599 -20.267
  786   HG22  ILE  94          HG22      ILE  94   6.065  -8.695 -19.241
  787   HG23  ILE  94          HG23      ILE  94   5.799 -10.430 -19.529
  788   HD11  ILE  94          HD11      ILE  94   7.189  -9.849 -23.138
  789   HD12  ILE  94          HD12      ILE  94   7.234 -11.175 -21.948
  790   HD13  ILE  94          HD13      ILE  94   6.538 -11.449 -23.550
  791    H    LYS  95           H        LYS  95   2.222 -10.061 -22.139
  792    HA   LYS  95           HA       LYS  95   0.132  -9.159 -23.006
  793    HB2  LYS  95           HB2      LYS  95   0.796  -6.817 -23.342
  794    HB3  LYS  95           HB3      LYS  95   1.925  -7.309 -24.627
  795    HG2  LYS  95           HG2      LYS  95   0.026  -8.118 -25.989
  796    HG3  LYS  95           HG3      LYS  95  -1.091  -7.770 -24.662
  797    HD2  LYS  95           HD2      LYS  95  -1.255  -6.030 -26.328
  798    HD3  LYS  95           HD3      LYS  95  -0.566  -5.353 -24.846
  799    HE2  LYS  95           HE2      LYS  95   1.711  -5.501 -25.836
  800    HE3  LYS  95           HE3      LYS  95   1.035  -6.227 -27.300
  801    HZ1  LYS  95           HZ1      LYS  95  -0.179  -4.161 -27.683
  802    HZ2  LYS  95           HZ2      LYS  95   0.441  -3.490 -26.327
  803    HZ3  LYS  95           HZ3      LYS  95   1.417  -3.862 -27.576
  804    H    GLY  96           H        GLY  96  -0.523 -10.825 -24.315
  805    HA2  GLY  96           HA2      GLY  96   0.677 -11.541 -26.762
  806    HA3  GLY  96           HA3      GLY  96   1.286 -12.625 -25.504
  807    H    THR  97           H        THR  97  -0.043 -14.006 -27.261
  808    HA   THR  97           HA       THR  97  -2.827 -13.804 -27.414
  809    HB   THR  97           HB       THR  97  -2.510 -16.252 -28.285
  810    HG1  THR  97           HG1      THR  97  -0.389 -16.815 -28.655
  811   HG21  THR  97          HG21      THR  97  -1.508 -15.412 -30.382
  812   HG22  THR  97          HG22      THR  97  -2.704 -14.271 -29.752
  813   HG23  THR  97          HG23      THR  97  -0.972 -13.931 -29.552
  814    H    PHE  98           H        PHE  98  -0.949 -15.320 -24.843
  815    HA   PHE  98           HA       PHE  98  -3.009 -17.077 -23.954
  816    HD1  PHE  98           HD2      PHE  98  -1.628 -19.403 -23.355
  817    HD2  PHE  98           HD1      PHE  98  -1.960 -16.593 -20.099
  818    HE1  PHE  98           HE2      PHE  98  -2.279 -21.246 -21.827
  819    HE2  PHE  98           HE1      PHE  98  -2.598 -18.440 -18.573
  820    HZ   PHE  98           HZ       PHE  98  -2.759 -20.771 -19.432
  821    HB2  PHE  98           HB2      PHE  98  -0.552 -17.153 -23.436
  822    HB3  PHE  98           HB3      PHE  98  -0.856 -15.944 -22.213
  823    H    LYS  99           H        LYS  99  -3.072 -13.646 -23.925
  824    HA   LYS  99           HA       LYS  99  -5.340 -13.808 -21.986
  825    HB2  LYS  99           HB2      LYS  99  -5.059 -11.431 -21.484
  826    HB3  LYS  99           HB3      LYS  99  -3.753 -12.449 -20.959
  827    HG2  LYS  99           HG2      LYS  99  -2.838 -10.388 -21.718
  828    HG3  LYS  99           HG3      LYS  99  -2.315 -11.667 -22.786
  829    HD2  LYS  99           HD2      LYS  99  -2.801  -9.679 -24.069
  830    HD3  LYS  99           HD3      LYS  99  -3.989 -10.909 -24.490
  831    HE2  LYS  99           HE2      LYS  99  -5.605  -9.831 -22.875
  832    HE3  LYS  99           HE3      LYS  99  -4.393  -8.594 -22.525
  833    HZ1  LYS  99           HZ1      LYS  99  -5.655  -9.064 -25.167
  834    HZ2  LYS  99           HZ2      LYS  99  -5.987  -7.832 -24.157
  835    HZ3  LYS  99           HZ3      LYS  99  -4.523  -7.918 -24.863
  836    H    GLU 100           H        GLU 100  -5.158 -14.359 -24.957
  837    HA   GLU 100           HA       GLU 100  -7.499 -12.654 -25.704
  838    HB2  GLU 100           HB2      GLU 100  -5.375 -11.947 -26.884
  839    HB3  GLU 100           HB3      GLU 100  -5.251 -13.579 -27.540
  840    HG2  GLU 100           HG2      GLU 100  -7.719 -13.096 -28.420
  841    HG3  GLU 100           HG3      GLU 100  -7.277 -11.417 -28.157
  842    H    ARG 101           H        ARG 101  -5.607 -15.618 -26.522
  843    HA   ARG 101           HA       ARG 101  -8.060 -17.269 -26.593
  844    HE   ARG 101           HE       ARG 101  -9.988 -16.774 -31.556
  845    HB2  ARG 101           HB2      ARG 101  -6.083 -16.915 -28.899
  846    HB3  ARG 101           HB3      ARG 101  -7.204 -18.275 -28.771
  847    HG2  ARG 101           HG2      ARG 101  -9.131 -16.788 -28.872
  848    HG3  ARG 101           HG3      ARG 101  -8.077 -15.363 -28.957
  849    HD2  ARG 101           HD2      ARG 101  -7.179 -16.032 -31.094
  850    HD3  ARG 101           HD3      ARG 101  -7.940 -17.619 -30.980
  851   HH11  ARG 101          HH11      ARG 101  -7.723 -13.999 -31.221
  852   HH12  ARG 101          HH12      ARG 101  -8.783 -12.925 -32.064
  853   HH21  ARG 101          HH21      ARG 101 -11.348 -15.294 -32.619
  854   HH22  ARG 101          HH22      ARG 101 -10.872 -13.656 -32.843
  855    HA   PRO 102           HA       PRO 102  -4.397 -19.240 -24.595
  856    HB2  PRO 102           HB2      PRO 102  -5.570 -19.864 -22.154
  857    HB3  PRO 102           HB3      PRO 102  -4.644 -18.376 -22.481
  858    HG2  PRO 102           HG2      PRO 102  -7.644 -18.752 -22.515
  859    HG3  PRO 102           HG3      PRO 102  -6.701 -17.405 -21.810
  860    HD2  PRO 102           HD2      PRO 102  -7.904 -17.229 -24.263
  861    HD3  PRO 102           HD3      PRO 102  -6.345 -16.427 -23.913
  862    H    LYS 103           H        LYS 103  -7.879 -19.968 -24.558
  863    HA   LYS 103           HA       LYS 103  -7.420 -22.883 -24.862
  864    HB2  LYS 103           HB2      LYS 103  -9.928 -21.179 -24.530
  865    HB3  LYS 103           HB3      LYS 103  -9.984 -22.865 -25.031
  866    HG2  LYS 103           HG2      LYS 103 -10.410 -22.829 -22.725
  867    HG3  LYS 103           HG3      LYS 103  -8.838 -23.581 -22.979
  868    HD2  LYS 103           HD2      LYS 103  -7.697 -21.560 -22.181
  869    HD3  LYS 103           HD3      LYS 103  -9.254 -20.694 -22.081
  870    HE2  LYS 103           HE2      LYS 103 -10.043 -22.358 -20.406
  871    HE3  LYS 103           HE3      LYS 103  -8.494 -23.202 -20.509
  872    HZ1  LYS 103           HZ1      LYS 103  -8.859 -20.421 -19.547
  873    HZ2  LYS 103           HZ2      LYS 103  -8.579 -21.720 -18.610
  874    HZ3  LYS 103           HZ3      LYS 103  -7.423 -21.207 -19.633
  875    H    LYS 104           H        LYS 104  -6.067 -21.863 -26.785
  876    HA   LYS 104           HA       LYS 104  -7.352 -21.086 -29.201
  877    HB2  LYS 104           HB2      LYS 104  -4.905 -20.899 -28.709
  878    HB3  LYS 104           HB3      LYS 104  -4.762 -22.660 -28.840
  879    HG2  LYS 104           HG2      LYS 104  -5.580 -22.529 -31.197
  880    HG3  LYS 104           HG3      LYS 104  -5.683 -20.769 -31.060
  881    HD2  LYS 104           HD2      LYS 104  -3.137 -22.432 -30.783
  882    HD3  LYS 104           HD3      LYS 104  -3.647 -21.569 -32.241
  883    HE2  LYS 104           HE2      LYS 104  -3.566 -19.413 -30.994
  884    HE3  LYS 104           HE3      LYS 104  -3.010 -20.273 -29.552
  885    HZ1  LYS 104           HZ1      LYS 104  -1.035 -20.945 -30.794
  886    HZ2  LYS 104           HZ2      LYS 104  -1.546 -20.147 -32.126
  887    HZ3  LYS 104           HZ3      LYS 104  -1.163 -19.321 -30.775
  Start of MODEL   15
    1    HA   MET   1           HA       MET   1   0.763 -14.463  -1.005
    2    H1   MET   1           H1       MET   1  -0.168 -13.988   1.139
    3    H2   MET   1           H2       MET   1   0.713 -12.623   1.288
    4    H3   MET   1           H3       MET   1  -0.455 -12.727   0.136
    5    HB2  MET   1           HB2      MET   1   2.327 -11.891  -0.494
    6    HB3  MET   1           HB3      MET   1   2.834 -13.127  -1.642
    7    HG2  MET   1           HG2      MET   1   0.749 -12.861  -2.920
    8    HG3  MET   1           HG3      MET   1   0.190 -11.643  -1.774
    9    HE1  MET   1           HE1      MET   1   3.622 -11.029  -4.847
   10    HE2  MET   1           HE2      MET   1   3.857 -12.105  -3.457
   11    HE3  MET   1           HE3      MET   1   2.645 -12.505  -4.700
   12    H    GLU   2           H        GLU   2   2.361 -16.035  -0.987
   13    HA   GLU   2           HA       GLU   2   4.615 -15.811   0.809
   14    HB2  GLU   2           HB2      GLU   2   2.943 -17.019   2.223
   15    HB3  GLU   2           HB3      GLU   2   2.729 -18.217   0.944
   16    HG2  GLU   2           HG2      GLU   2   4.206 -19.042   2.731
   17    HG3  GLU   2           HG3      GLU   2   5.059 -18.956   1.196
   18    H    MET   3           H        MET   3   6.386 -16.896  -0.137
   19    HA   MET   3           HA       MET   3   6.065 -17.146  -2.975
   20    HB2  MET   3           HB2      MET   3   8.575 -17.720  -1.350
   21    HB3  MET   3           HB3      MET   3   8.456 -17.202  -3.031
   22    HG2  MET   3           HG2      MET   3   7.938 -15.628  -0.499
   23    HG3  MET   3           HG3      MET   3   9.086 -15.261  -1.774
   24    HE1  MET   3           HE1      MET   3   6.630 -13.598  -0.096
   25    HE2  MET   3           HE2      MET   3   7.855 -12.716  -1.038
   26    HE3  MET   3           HE3      MET   3   6.127 -12.438  -1.341
   27    H    LEU   4           H        LEU   4   6.739 -18.782  -4.370
   28    HA   LEU   4           HA       LEU   4   6.505 -21.575  -3.359
   29    HG   LEU   4           HG       LEU   4   3.248 -21.416  -5.206
   30    HB2  LEU   4           HB2      LEU   4   5.170 -20.130  -5.649
   31    HB3  LEU   4           HB3      LEU   4   5.568 -21.817  -5.830
   32   HD11  LEU   4          HD11      LEU   4   4.771 -22.989  -3.080
   33   HD12  LEU   4          HD12      LEU   4   3.071 -23.199  -3.543
   34   HD13  LEU   4          HD13      LEU   4   4.351 -23.579  -4.703
   35   HD21  LEU   4          HD21      LEU   4   3.568 -19.497  -3.650
   36   HD22  LEU   4          HD22      LEU   4   2.501 -20.770  -3.043
   37   HD23  LEU   4          HD23      LEU   4   4.153 -20.644  -2.423
   38    HA   PRO   5           HA       PRO   5  10.623 -21.366  -5.181
   39    HB2  PRO   5           HB2      PRO   5  10.359 -24.368  -5.018
   40    HB3  PRO   5           HB3      PRO   5  11.751 -23.324  -4.583
   41    HG2  PRO   5           HG2      PRO   5  10.127 -24.261  -2.647
   42    HG3  PRO   5           HG3      PRO   5  10.682 -22.554  -2.616
   43    HD2  PRO   5           HD2      PRO   5   8.013 -23.644  -3.537
   44    HD3  PRO   5           HD3      PRO   5   8.378 -22.197  -2.546
   45    H    ASN   6           H        ASN   6  11.133 -20.983  -7.165
   46    HA   ASN   6           HA       ASN   6  11.092 -22.908  -9.281
   47    HB2  ASN   6           HB2      ASN   6   8.817 -21.926  -9.691
   48    HB3  ASN   6           HB3      ASN   6   9.519 -20.304  -9.633
   49   HD21  ASN   6          HD22      ASN   6   9.647 -23.421 -11.490
   50   HD22  ASN   6          HD21      ASN   6  10.279 -22.698 -12.952
   51    H    GLN   7           H        GLN   7  12.734 -22.054 -10.926
   52    HA   GLN   7           HA       GLN   7  14.738 -20.493  -9.586
   53    HB2  GLN   7           HB2      GLN   7  14.472 -21.403 -12.483
   54    HB3  GLN   7           HB3      GLN   7  15.839 -20.467 -11.876
   55    HG2  GLN   7           HG2      GLN   7  16.283 -22.234 -10.161
   56    HG3  GLN   7           HG3      GLN   7  15.015 -23.225 -10.903
   57   HE21  GLN   7          HE22      GLN   7  18.079 -21.458 -11.726
   58   HE22  GLN   7          HE21      GLN   7  18.598 -22.622 -12.931
   59    H    THR   8           H        THR   8  11.954 -19.437 -11.440
   60    HA   THR   8           HA       THR   8  13.284 -16.871 -12.088
   61    HB   THR   8           HB       THR   8  10.674 -18.003 -13.145
   62    HG1  THR   8           HG1      THR   8  12.225 -19.399 -13.769
   63   HG21  THR   8          HG21      THR   8  10.941 -15.566 -13.490
   64   HG22  THR   8          HG22      THR   8  12.547 -15.828 -14.195
   65   HG23  THR   8          HG23      THR   8  11.091 -16.432 -15.018
   66    H    ILE   9           H        ILE   9  12.460 -14.950 -11.391
   67    HA   ILE   9           HA       ILE   9  10.023 -14.902  -9.724
   68    HB   ILE   9           HB       ILE   9  11.030 -13.581  -8.028
   69   HG12  ILE   9          HG12      ILE   9  13.686 -13.663  -9.498
   70   HG13  ILE   9          HG13      ILE   9  12.596 -12.269  -9.471
   71   HG21  ILE   9          HG21      ILE   9  12.699 -15.128  -7.019
   72   HG22  ILE   9          HG22      ILE   9  11.379 -16.035  -7.781
   73   HG23  ILE   9          HG23      ILE   9  12.965 -15.887  -8.571
   74   HD11  ILE   9          HD11      ILE   9  14.302 -11.838  -7.877
   75   HD12  ILE   9          HD12      ILE   9  12.819 -12.185  -6.970
   76   HD13  ILE   9          HD13      ILE   9  14.107 -13.412  -7.099
   77    H    TYR  10           H        TYR  10   9.244 -12.611  -9.526
   78    HA   TYR  10           HA       TYR  10   9.694 -11.029 -12.024
   79    HD1  TYR  10           HD1      TYR  10   8.060 -10.215 -13.891
   80    HD2  TYR  10           HD2      TYR  10   5.572 -10.238 -10.365
   81    HE1  TYR  10           HE1      TYR  10   6.761  -8.328 -14.808
   82    HE2  TYR  10           HE2      TYR  10   4.265  -8.339 -11.272
   83    HH   TYR  10           HH       TYR  10   4.921  -6.910 -14.494
   84    HB2  TYR  10           HB2      TYR  10   7.681 -12.333 -12.301
   85    HB3  TYR  10           HB3      TYR  10   7.141 -11.961 -10.671
   86    H    ILE  11           H        ILE  11   9.715  -8.855 -11.712
   87    HA   ILE  11           HA       ILE  11   9.384  -7.767  -8.957
   88    HB   ILE  11           HB       ILE  11  11.620  -7.270 -10.974
   89   HG12  ILE  11          HG12      ILE  11  11.861  -8.383  -8.151
   90   HG13  ILE  11          HG13      ILE  11  11.842  -9.393  -9.602
   91   HG21  ILE  11          HG21      ILE  11  10.972  -5.167  -9.814
   92   HG22  ILE  11          HG22      ILE  11  11.200  -5.961  -8.244
   93   HG23  ILE  11          HG23      ILE  11  12.569  -5.688  -9.353
   94   HD11  ILE  11          HD11      ILE  11  14.107  -9.121  -8.940
   95   HD12  ILE  11          HD12      ILE  11  13.869  -8.186 -10.430
   96   HD13  ILE  11          HD13      ILE  11  13.965  -7.363  -8.851
   97    H    ASN  12           H        ASN  12   8.354  -5.782  -8.980
   98    HA   ASN  12           HA       ASN  12   8.133  -4.186 -11.396
   99    HB2  ASN  12           HB2      ASN  12   5.714  -4.048 -11.416
  100    HB3  ASN  12           HB3      ASN  12   6.198  -5.716 -11.643
  101   HD21  ASN  12          HD22      ASN  12   5.994  -7.215  -9.763
  102   HD22  ASN  12          HD21      ASN  12   4.778  -6.874  -8.556
  103    H    ASN  13           H        ASN  13   6.658  -2.184 -10.672
  104    HA   ASN  13           HA       ASN  13   6.747  -0.251  -9.563
  105    HB2  ASN  13           HB2      ASN  13   5.564  -1.599  -7.769
  106    HB3  ASN  13           HB3      ASN  13   7.127  -1.754  -6.960
  107   HD21  ASN  13          HD21      ASN  13   7.224  -0.276  -5.252
  108   HD22  ASN  13          HD22      ASN  13   6.537   1.334  -5.313
  109    H    LEU  14           H        LEU  14   9.130  -1.370 -10.719
  110    HA   LEU  14           HA       LEU  14  11.458  -0.591  -9.149
  111    HG   LEU  14           HG       LEU  14  11.718  -2.910 -10.274
  112    HB2  LEU  14           HB2      LEU  14  10.850  -1.113 -12.073
  113    HB3  LEU  14           HB3      LEU  14  12.331  -0.283 -11.660
  114   HD11  LEU  14          HD11      LEU  14  11.418  -3.354 -12.683
  115   HD12  LEU  14          HD12      LEU  14  13.005  -2.630 -13.020
  116   HD13  LEU  14          HD13      LEU  14  12.877  -4.121 -12.053
  117   HD21  LEU  14          HD21      LEU  14  13.578  -1.541  -9.464
  118   HD22  LEU  14          HD22      LEU  14  14.147  -3.055 -10.174
  119   HD23  LEU  14          HD23      LEU  14  14.306  -1.535 -11.086
  120    H    ASN  15           H        ASN  15  12.544   1.400  -9.222
  121    HA   ASN  15           HA       ASN  15  10.876   3.742  -9.562
  122    HB2  ASN  15           HB2      ASN  15  12.792   3.569  -7.942
  123    HB3  ASN  15           HB3      ASN  15  13.911   3.629  -9.300
  124   HD21  ASN  15          HD22      ASN  15  13.478   5.565  -7.032
  125   HD22  ASN  15          HD21      ASN  15  13.168   7.104  -7.820
  126    H    GLU  16           H        GLU  16  10.270   4.373 -11.516
  127    HA   GLU  16           HA       GLU  16  11.134   3.496 -13.943
  128    HB2  GLU  16           HB2      GLU  16   9.029   4.715 -13.371
  129    HB3  GLU  16           HB3      GLU  16   9.930   6.235 -13.371
  130    HG2  GLU  16           HG2      GLU  16  10.461   5.929 -15.766
  131    HG3  GLU  16           HG3      GLU  16   9.668   4.349 -15.757
  132    H    LYS  17           H        LYS  17  12.740   6.089 -12.094
  133    HA   LYS  17           HA       LYS  17  14.098   7.266 -14.293
  134    HB2  LYS  17           HB2      LYS  17  15.463   8.376 -12.706
  135    HB3  LYS  17           HB3      LYS  17  13.852   8.260 -12.034
  136    HG2  LYS  17           HG2      LYS  17  14.916   7.631 -10.159
  137    HG3  LYS  17           HG3      LYS  17  14.954   6.026 -10.893
  138    HD2  LYS  17           HD2      LYS  17  17.256   6.455 -11.716
  139    HD3  LYS  17           HD3      LYS  17  17.178   8.108 -11.070
  140    HE2  LYS  17           HE2      LYS  17  16.821   7.166  -8.774
  141    HE3  LYS  17           HE3      LYS  17  17.006   5.537  -9.427
  142    HZ1  LYS  17           HZ1      LYS  17  19.281   6.159 -10.097
  143    HZ2  LYS  17           HZ2      LYS  17  19.085   7.657  -9.473
  144    HZ3  LYS  17           HZ3      LYS  17  19.080   6.362  -8.490
  145    H    ILE  18           H        ILE  18  14.617   4.176 -12.798
  146    HA   ILE  18           HA       ILE  18  17.434   3.906 -13.343
  147    HB   ILE  18           HB       ILE  18  15.163   1.966 -12.741
  148   HG12  ILE  18          HG12      ILE  18  15.720   3.449 -10.872
  149   HG13  ILE  18          HG13      ILE  18  16.172   1.793 -10.516
  150   HG21  ILE  18          HG21      ILE  18  16.758   0.624 -13.908
  151   HG22  ILE  18          HG22      ILE  18  18.094   1.248 -12.915
  152   HG23  ILE  18          HG23      ILE  18  16.831   0.240 -12.192
  153   HD11  ILE  18          HD11      ILE  18  17.860   3.436  -9.742
  154   HD12  ILE  18          HD12      ILE  18  18.557   2.326 -10.929
  155   HD13  ILE  18          HD13      ILE  18  18.125   3.993 -11.379
  156    H    LYS  19           H        LYS  19  18.414   3.648 -15.200
  157    HA   LYS  19           HA       LYS  19  17.073   3.214 -17.732
  158    HB2  LYS  19           HB2      LYS  19  19.277   4.394 -17.351
  159    HB3  LYS  19           HB3      LYS  19  19.984   2.847 -16.885
  160    HG2  LYS  19           HG2      LYS  19  19.522   1.983 -19.200
  161    HG3  LYS  19           HG3      LYS  19  18.906   3.592 -19.634
  162    HD2  LYS  19           HD2      LYS  19  21.125   4.574 -19.063
  163    HD3  LYS  19           HD3      LYS  19  21.715   2.968 -18.597
  164    HE2  LYS  19           HE2      LYS  19  21.172   2.194 -20.969
  165    HE3  LYS  19           HE3      LYS  19  20.852   3.887 -21.373
  166    HZ1  LYS  19           HZ1      LYS  19  23.172   4.357 -20.686
  167    HZ2  LYS  19           HZ2      LYS  19  23.427   2.746 -20.429
  168    HZ3  LYS  19           HZ3      LYS  19  23.105   3.307 -21.932
  169    H    LYS  20           H        LYS  20  17.147   1.157 -18.985
  170    HA   LYS  20           HA       LYS  20  16.623  -1.100 -17.373
  171    HB2  LYS  20           HB2      LYS  20  16.088  -0.501 -19.940
  172    HB3  LYS  20           HB3      LYS  20  17.573  -1.396 -20.242
  173    HG2  LYS  20           HG2      LYS  20  15.506  -2.762 -20.457
  174    HG3  LYS  20           HG3      LYS  20  16.610  -3.408 -19.248
  175    HD2  LYS  20           HD2      LYS  20  14.146  -3.436 -18.672
  176    HD3  LYS  20           HD3      LYS  20  15.225  -2.795 -17.445
  177    HE2  LYS  20           HE2      LYS  20  14.559  -0.480 -18.097
  178    HE3  LYS  20           HE3      LYS  20  13.506  -1.141 -19.358
  179    HZ1  LYS  20           HZ1      LYS  20  12.355  -0.588 -17.230
  180    HZ2  LYS  20           HZ2      LYS  20  12.129  -2.139 -17.704
  181    HZ3  LYS  20           HZ3      LYS  20  13.172  -1.781 -16.479
  182    H    GLU  21           H        GLU  21  19.622  -0.119 -18.959
  183    HA   GLU  21           HA       GLU  21  21.211  -2.381 -18.292
  184    HB2  GLU  21           HB2      GLU  21  21.865  -0.792 -19.932
  185    HB3  GLU  21           HB3      GLU  21  21.739   0.559 -18.805
  186    HG2  GLU  21           HG2      GLU  21  23.691  -0.199 -17.556
  187    HG3  GLU  21           HG3      GLU  21  23.787  -1.674 -18.536
  188    H    GLU  22           H        GLU  22  20.212   0.476 -16.349
  189    HA   GLU  22           HA       GLU  22  22.060  -0.115 -14.182
  190    HB2  GLU  22           HB2      GLU  22  19.665   1.720 -14.423
  191    HB3  GLU  22           HB3      GLU  22  20.590   1.529 -12.931
  192    HG2  GLU  22           HG2      GLU  22  22.620   2.303 -14.015
  193    HG3  GLU  22           HG3      GLU  22  21.808   2.425 -15.574
  194    H    LEU  23           H        LEU  23  18.652  -0.968 -14.977
  195    HA   LEU  23           HA       LEU  23  18.088  -2.316 -12.501
  196    HG   LEU  23           HG       LEU  23  15.241  -3.966 -14.832
  197    HB2  LEU  23           HB2      LEU  23  16.213  -2.001 -13.858
  198    HB3  LEU  23           HB3      LEU  23  17.030  -2.456 -15.330
  199   HD11  LEU  23          HD11      LEU  23  17.685  -5.650 -14.418
  200   HD12  LEU  23          HD12      LEU  23  16.146  -6.062 -15.146
  201   HD13  LEU  23          HD13      LEU  23  17.220  -4.920 -15.973
  202   HD21  LEU  23          HD21      LEU  23  15.266  -3.668 -12.361
  203   HD22  LEU  23          HD22      LEU  23  15.172  -5.373 -12.839
  204   HD23  LEU  23          HD23      LEU  23  16.705  -4.685 -12.261
  205    H    LYS  24           H        LYS  24  19.628  -3.488 -15.536
  206    HA   LYS  24           HA       LYS  24  20.106  -6.112 -14.575
  207    HB2  LYS  24           HB2      LYS  24  20.254  -5.300 -16.963
  208    HB3  LYS  24           HB3      LYS  24  21.803  -4.546 -16.574
  209    HG2  LYS  24           HG2      LYS  24  22.712  -6.799 -15.943
  210    HG3  LYS  24           HG3      LYS  24  21.135  -7.513 -16.306
  211    HD2  LYS  24           HD2      LYS  24  22.606  -7.931 -18.153
  212    HD3  LYS  24           HD3      LYS  24  21.360  -6.791 -18.678
  213    HE2  LYS  24           HE2      LYS  24  22.962  -4.907 -18.385
  214    HE3  LYS  24           HE3      LYS  24  24.191  -6.038 -17.804
  215    HZ1  LYS  24           HZ1      LYS  24  23.016  -6.057 -20.526
  216    HZ2  LYS  24           HZ2      LYS  24  24.503  -5.516 -20.137
  217    HZ3  LYS  24           HZ3      LYS  24  24.155  -7.098 -19.985
  218    H    LYS  25           H        LYS  25  22.257  -3.239 -14.527
  219    HA   LYS  25           HA       LYS  25  24.440  -4.414 -13.197
  220    HB2  LYS  25           HB2      LYS  25  24.439  -2.210 -14.335
  221    HB3  LYS  25           HB3      LYS  25  23.410  -1.543 -13.059
  222    HG2  LYS  25           HG2      LYS  25  25.179  -1.906 -11.392
  223    HG3  LYS  25           HG3      LYS  25  26.204  -2.679 -12.623
  224    HD2  LYS  25           HD2      LYS  25  26.250  -0.555 -13.908
  225    HD3  LYS  25           HD3      LYS  25  25.216   0.211 -12.681
  226    HE2  LYS  25           HE2      LYS  25  26.952  -0.223 -10.955
  227    HE3  LYS  25           HE3      LYS  25  27.979  -0.989 -12.173
  228    HZ1  LYS  25           HZ1      LYS  25  28.616   1.305 -11.795
  229    HZ2  LYS  25           HZ2      LYS  25  28.087   1.145 -13.327
  230    HZ3  LYS  25           HZ3      LYS  25  27.139   1.855 -12.198
  231    H    SER  26           H        SER  26  21.569  -2.742 -11.771
  232    HA   SER  26           HA       SER  26  22.502  -2.912  -9.110
  233    HG   SER  26           HG       SER  26  20.801  -1.045 -10.964
  234    HB2  SER  26           HB2      SER  26  19.650  -2.679 -10.111
  235    HB3  SER  26           HB3      SER  26  20.240  -2.277  -8.480
  236    H    LEU  27           H        LEU  27  20.375  -5.064 -10.994
  237    HA   LEU  27           HA       LEU  27  19.773  -6.900  -8.905
  238    HG   LEU  27           HG       LEU  27  17.859  -6.102 -10.936
  239    HB2  LEU  27           HB2      LEU  27  19.944  -7.082 -11.923
  240    HB3  LEU  27           HB3      LEU  27  19.677  -8.534 -10.981
  241   HD11  LEU  27          HD11      LEU  27  16.304  -7.549 -12.197
  242   HD12  LEU  27          HD12      LEU  27  17.833  -7.369 -13.067
  243   HD13  LEU  27          HD13      LEU  27  17.497  -8.869 -12.184
  244   HD21  LEU  27          HD21      LEU  27  17.614  -8.842  -9.631
  245   HD22  LEU  27          HD22      LEU  27  17.657  -7.248  -8.824
  246   HD23  LEU  27          HD23      LEU  27  16.275  -7.689  -9.807
  247    H    TYR  28           H        TYR  28  22.435  -6.968 -11.361
  248    HA   TYR  28           HA       TYR  28  23.686  -9.275 -10.298
  249    HD1  TYR  28           HD2      TYR  28  25.154 -10.603 -12.237
  250    HD2  TYR  28           HD1      TYR  28  27.216  -6.990 -11.082
  251    HE1  TYR  28           HE2      TYR  28  27.299 -11.837 -12.233
  252    HE2  TYR  28           HE1      TYR  28  29.368  -8.217 -11.073
  253    HH   TYR  28           HH       TYR  28  29.600 -11.716 -11.878
  254    HB2  TYR  28           HB2      TYR  28  24.138  -8.285 -12.522
  255    HB3  TYR  28           HB3      TYR  28  24.908  -6.899 -11.761
  256    H    ALA  29           H        ALA  29  24.043  -5.820  -9.405
  257    HA   ALA  29           HA       ALA  29  26.317  -6.131  -7.768
  258    HB1  ALA  29           HB1      ALA  29  24.127  -4.012  -7.634
  259    HB2  ALA  29           HB2      ALA  29  25.742  -3.898  -6.911
  260    HB3  ALA  29           HB3      ALA  29  25.572  -3.964  -8.674
  261    H    ILE  30           H        ILE  30  22.805  -6.245  -6.873
  262    HA   ILE  30           HA       ILE  30  23.707  -7.113  -4.150
  263    HB   ILE  30           HB       ILE  30  21.638  -5.931  -3.317
  264   HG12  ILE  30          HG12      ILE  30  21.986  -4.174  -5.768
  265   HG13  ILE  30          HG13      ILE  30  20.683  -5.359  -5.585
  266   HG21  ILE  30          HG21      ILE  30  22.965  -3.916  -2.876
  267   HG22  ILE  30          HG22      ILE  30  24.027  -5.316  -2.873
  268   HG23  ILE  30          HG23      ILE  30  23.992  -4.242  -4.289
  269   HD11  ILE  30          HD11      ILE  30  19.866  -4.173  -3.575
  270   HD12  ILE  30          HD12      ILE  30  21.164  -2.965  -3.753
  271   HD13  ILE  30          HD13      ILE  30  19.924  -3.103  -4.992
  272    H    PHE  31           H        PHE  31  20.999  -7.548  -6.496
  273    HA   PHE  31           HA       PHE  31  19.578  -9.329  -4.757
  274    HD1  PHE  31           HD1      PHE  31  18.507  -6.755  -6.064
  275    HD2  PHE  31           HD2      PHE  31  16.688 -10.598  -6.798
  276    HE1  PHE  31           HE1      PHE  31  16.277  -5.806  -5.555
  277    HE2  PHE  31           HE2      PHE  31  14.464  -9.644  -6.280
  278    HZ   PHE  31           HZ       PHE  31  14.251  -7.242  -5.673
  279    HB2  PHE  31           HB2      PHE  31  19.504  -8.742  -7.672
  280    HB3  PHE  31           HB3      PHE  31  18.958 -10.321  -7.206
  281    H    SER  32           H        SER  32  22.262 -10.003  -7.090
  282    HA   SER  32           HA       SER  32  22.311 -12.776  -6.757
  283    HG   SER  32           HG       SER  32  24.274 -11.439  -9.297
  284    HB2  SER  32           HB2      SER  32  24.576 -10.796  -7.174
  285    HB3  SER  32           HB3      SER  32  24.773 -12.557  -7.278
  286    H    GLN  33           H        GLN  33  23.244 -10.350  -4.318
  287    HA   GLN  33           HA       GLN  33  24.973 -12.118  -2.835
  288    HB2  GLN  33           HB2      GLN  33  23.439  -9.677  -1.847
  289    HB3  GLN  33           HB3      GLN  33  24.800 -10.452  -1.051
  290    HG2  GLN  33           HG2      GLN  33  24.919  -9.023  -3.746
  291    HG3  GLN  33           HG3      GLN  33  25.479  -8.388  -2.206
  292   HE21  GLN  33          HE22      GLN  33  27.345  -9.514  -1.132
  293   HE22  GLN  33          HE21      GLN  33  28.488 -10.376  -2.127
  294    H    PHE  34           H        PHE  34  21.600 -12.234  -3.324
  295    HA   PHE  34           HA       PHE  34  21.157 -13.681  -0.759
  296    HD1  PHE  34           HD2      PHE  34  19.575 -12.171   1.122
  297    HD2  PHE  34           HD1      PHE  34  20.132 -10.047  -2.588
  298    HE1  PHE  34           HE2      PHE  34  20.043 -10.083   2.382
  299    HE2  PHE  34           HE1      PHE  34  20.612  -7.969  -1.330
  300    HZ   PHE  34           HZ       PHE  34  20.566  -7.978   1.161
  301    HB2  PHE  34           HB2      PHE  34  19.172 -12.286  -2.586
  302    HB3  PHE  34           HB3      PHE  34  18.794 -13.100  -1.073
  303    H    GLY  35           H        GLY  35  22.107 -14.591  -3.736
  304    HA2  GLY  35           HA2      GLY  35  21.390 -17.215  -3.380
  305    HA3  GLY  35           HA3      GLY  35  20.040 -16.568  -4.321
  306    H    GLN  36           H        GLN  36  22.824 -14.982  -5.332
  307    HA   GLN  36           HA       GLN  36  23.796 -14.799  -7.261
  308    HB2  GLN  36           HB2      GLN  36  25.137 -16.653  -6.440
  309    HB3  GLN  36           HB3      GLN  36  24.060 -17.815  -7.220
  310    HG2  GLN  36           HG2      GLN  36  26.133 -17.400  -8.522
  311    HG3  GLN  36           HG3      GLN  36  24.679 -17.023  -9.425
  312   HE21  GLN  36          HE22      GLN  36  24.669 -15.040 -10.485
  313   HE22  GLN  36          HE21      GLN  36  25.675 -13.671 -10.053
  314    H    ILE  37           H        ILE  37  22.761 -13.936  -8.873
  315    HA   ILE  37           HA       ILE  37  20.447 -15.035 -10.166
  316    HB   ILE  37           HB       ILE  37  22.409 -12.792 -10.736
  317   HG12  ILE  37          HG12      ILE  37  19.459 -12.916  -9.941
  318   HG13  ILE  37          HG13      ILE  37  20.793 -12.603  -8.832
  319   HG21  ILE  37          HG21      ILE  37  21.002 -11.990 -12.542
  320   HG22  ILE  37          HG22      ILE  37  21.680 -13.533 -12.957
  321   HG23  ILE  37          HG23      ILE  37  19.975 -13.438 -12.439
  322   HD11  ILE  37          HD11      ILE  37  21.334 -10.528 -10.087
  323   HD12  ILE  37          HD12      ILE  37  19.877 -10.800 -11.079
  324   HD13  ILE  37          HD13      ILE  37  19.714 -10.540  -9.347
  325    H    LEU  38           H        LEU  38  20.308 -15.824 -12.262
  326    HA   LEU  38           HA       LEU  38  22.701 -17.166 -13.401
  327    HG   LEU  38           HG       LEU  38  20.772 -20.343 -13.842
  328    HB2  LEU  38           HB2      LEU  38  21.113 -18.690 -12.292
  329    HB3  LEU  38           HB3      LEU  38  19.799 -18.104 -13.292
  330   HD11  LEU  38          HD11      LEU  38  19.403 -19.064 -15.469
  331   HD12  LEU  38          HD12      LEU  38  20.898 -18.450 -16.211
  332   HD13  LEU  38          HD13      LEU  38  20.558 -20.183 -16.202
  333   HD21  LEU  38          HD21      LEU  38  23.168 -19.782 -13.535
  334   HD22  LEU  38          HD22      LEU  38  22.827 -20.560 -15.088
  335   HD23  LEU  38          HD23      LEU  38  23.119 -18.814 -15.026
  336    H    ASP  39           H        ASP  39  19.545 -15.434 -14.056
  337    HA   ASP  39           HA       ASP  39  20.814 -14.156 -16.325
  338    HB2  ASP  39           HB2      ASP  39  20.060 -16.288 -17.376
  339    HB3  ASP  39           HB3      ASP  39  18.410 -15.943 -16.866
  340    H    ILE  40           H        ILE  40  19.264 -12.473 -17.325
  341    HA   ILE  40           HA       ILE  40  17.197 -11.519 -15.414
  342    HB   ILE  40           HB       ILE  40  19.549  -9.885 -16.468
  343   HG12  ILE  40          HG12      ILE  40  18.820 -10.557 -13.583
  344   HG13  ILE  40          HG13      ILE  40  20.083 -11.366 -14.509
  345   HG21  ILE  40          HG21      ILE  40  18.572  -7.986 -15.206
  346   HG22  ILE  40          HG22      ILE  40  17.486  -8.530 -16.456
  347   HG23  ILE  40          HG23      ILE  40  17.171  -8.998 -14.771
  348   HD11  ILE  40          HD11      ILE  40  21.359  -9.286 -14.699
  349   HD12  ILE  40          HD12      ILE  40  20.130  -8.440 -13.724
  350   HD13  ILE  40          HD13      ILE  40  21.078  -9.746 -13.014
  351    H    VAL  41           H        VAL  41  15.476 -10.557 -16.496
  352    HA   VAL  41           HA       VAL  41  15.683 -10.070 -19.410
  353    HB   VAL  41           HB       VAL  41  13.557 -11.827 -18.116
  354   HG11  VAL  41          HG11      VAL  41  14.112 -11.161 -21.047
  355   HG12  VAL  41          HG12      VAL  41  12.874 -12.291 -20.452
  356   HG13  VAL  41          HG13      VAL  41  12.737 -10.571 -20.089
  357   HG21  VAL  41          HG21      VAL  41  14.510 -13.694 -19.444
  358   HG22  VAL  41          HG22      VAL  41  15.885 -12.663 -19.888
  359   HG23  VAL  41          HG23      VAL  41  15.613 -13.134 -18.195
  360    H    ALA  42           H        ALA  42  15.504  -7.813 -19.018
  361    HA   ALA  42           HA       ALA  42  12.715  -6.989 -18.614
  362    HB1  ALA  42           HB1      ALA  42  15.104  -5.470 -17.476
  363    HB2  ALA  42           HB2      ALA  42  13.369  -5.095 -17.266
  364    HB3  ALA  42           HB3      ALA  42  14.069  -6.532 -16.509
  365    H    LEU  43           H        LEU  43  12.342  -4.927 -19.865
  366    HA   LEU  43           HA       LEU  43  14.293  -4.438 -22.044
  367    HG   LEU  43           HG       LEU  43  13.062  -7.239 -22.307
  368    HB2  LEU  43           HB2      LEU  43  11.404  -5.352 -22.384
  369    HB3  LEU  43           HB3      LEU  43  12.336  -4.616 -23.674
  370   HD11  LEU  43          HD11      LEU  43  12.281  -8.286 -24.393
  371   HD12  LEU  43          HD12      LEU  43  10.974  -7.398 -23.598
  372   HD13  LEU  43          HD13      LEU  43  11.778  -6.697 -25.017
  373   HD21  LEU  43          HD21      LEU  43  14.218  -5.875 -24.788
  374   HD22  LEU  43          HD22      LEU  43  15.062  -6.140 -23.245
  375   HD23  LEU  43          HD23      LEU  43  14.606  -7.521 -24.240
  376    H    LYS  44           H        LYS  44  13.621  -2.542 -23.354
  377    HA   LYS  44           HA       LYS  44  12.654  -0.378 -21.619
  378    HB2  LYS  44           HB2      LYS  44  13.575  -0.409 -24.533
  379    HB3  LYS  44           HB3      LYS  44  13.235   1.042 -23.587
  380    HG2  LYS  44           HG2      LYS  44  15.068   0.513 -22.031
  381    HG3  LYS  44           HG3      LYS  44  15.430  -0.974 -22.932
  382    HD2  LYS  44           HD2      LYS  44  15.873   0.380 -24.975
  383    HD3  LYS  44           HD3      LYS  44  15.574   1.863 -24.045
  384    HE2  LYS  44           HE2      LYS  44  17.450   1.301 -22.530
  385    HE3  LYS  44           HE3      LYS  44  17.726  -0.208 -23.412
  386    HZ1  LYS  44           HZ1      LYS  44  18.265   1.116 -25.375
  387    HZ2  LYS  44           HZ2      LYS  44  18.022   2.510 -24.557
  388    HZ3  LYS  44           HZ3      LYS  44  19.245   1.517 -24.141
  389    H    THR  45           H        THR  45  11.025  -2.638 -23.563
  390    HA   THR  45           HA       THR  45   9.128  -1.011 -24.939
  391    HB   THR  45           HB       THR  45   7.841  -3.259 -24.806
  392    HG1  THR  45           HG1      THR  45   9.021  -4.993 -24.050
  393   HG21  THR  45          HG21      THR  45   9.342  -4.366 -26.411
  394   HG22  THR  45          HG22      THR  45   9.261  -2.630 -26.748
  395   HG23  THR  45          HG23      THR  45  10.685  -3.308 -25.929
  396    H    LEU  46           H        LEU  46   6.936  -0.496 -24.272
  397    HA   LEU  46           HA       LEU  46   6.725   0.386 -21.629
  398    HG   LEU  46           HG       LEU  46   3.445  -0.960 -22.827
  399    HB2  LEU  46           HB2      LEU  46   4.598   1.111 -22.067
  400    HB3  LEU  46           HB3      LEU  46   5.435   1.241 -23.600
  401   HD11  LEU  46          HD11      LEU  46   1.904   0.182 -24.361
  402   HD12  LEU  46          HD12      LEU  46   2.396   1.256 -23.045
  403   HD13  LEU  46          HD13      LEU  46   3.114   1.451 -24.659
  404   HD21  LEU  46          HD21      LEU  46   4.981  -1.823 -24.549
  405   HD22  LEU  46          HD22      LEU  46   3.410  -1.490 -25.262
  406   HD23  LEU  46          HD23      LEU  46   4.747  -0.352 -25.524
  407    H    LYS  47           H        LYS  47   5.983  -2.796 -22.873
  408    HA   LYS  47           HA       LYS  47   4.353  -3.764 -20.743
  409    HB2  LYS  47           HB2      LYS  47   4.691  -4.826 -22.982
  410    HB3  LYS  47           HB3      LYS  47   6.345  -5.253 -22.517
  411    HG2  LYS  47           HG2      LYS  47   5.484  -6.707 -20.722
  412    HG3  LYS  47           HG3      LYS  47   3.821  -6.200 -21.084
  413    HD2  LYS  47           HD2      LYS  47   4.055  -7.154 -23.374
  414    HD3  LYS  47           HD3      LYS  47   5.688  -7.704 -22.986
  415    HE2  LYS  47           HE2      LYS  47   3.136  -8.561 -21.535
  416    HE3  LYS  47           HE3      LYS  47   3.912  -9.476 -22.827
  417    HZ1  LYS  47           HZ1      LYS  47   5.145  -8.882 -20.200
  418    HZ2  LYS  47           HZ2      LYS  47   4.554 -10.321 -20.682
  419    HZ3  LYS  47           HZ3      LYS  47   5.871  -9.709 -21.417
  420    H    MET  48           H        MET  48   7.814  -3.097 -20.915
  421    HA   MET  48           HA       MET  48   8.276  -4.450 -18.309
  422    HB2  MET  48           HB2      MET  48   9.972  -4.509 -20.804
  423    HB3  MET  48           HB3      MET  48  10.497  -5.104 -19.225
  424    HG2  MET  48           HG2      MET  48   8.114  -6.138 -20.795
  425    HG3  MET  48           HG3      MET  48   9.686  -6.922 -20.698
  426    HE1  MET  48           HE1      MET  48   9.772  -8.275 -17.046
  427    HE2  MET  48           HE2      MET  48  10.515  -8.382 -18.659
  428    HE3  MET  48           HE3      MET  48  10.553  -6.850 -17.756
  429    H    ARG  49           H        ARG  49   7.939  -1.484 -19.443
  430    HA   ARG  49           HA       ARG  49  10.409  -0.245 -19.152
  431    HE   ARG  49           HE       ARG  49  11.114   4.527 -19.855
  432    HB2  ARG  49           HB2      ARG  49   8.483   0.796 -20.235
  433    HB3  ARG  49           HB3      ARG  49   7.619   0.894 -18.697
  434    HG2  ARG  49           HG2      ARG  49   8.539   3.071 -19.367
  435    HG3  ARG  49           HG3      ARG  49   9.240   2.527 -17.849
  436    HD2  ARG  49           HD2      ARG  49  11.269   1.707 -19.188
  437    HD3  ARG  49           HD3      ARG  49  10.532   2.438 -20.613
  438   HH11  ARG  49          HH11      ARG  49  11.579   2.240 -17.110
  439   HH12  ARG  49          HH12      ARG  49  12.519   3.409 -16.217
  440   HH21  ARG  49          HH21      ARG  49  12.303   6.009 -18.519
  441   HH22  ARG  49          HH22      ARG  49  12.789   5.504 -16.924
  442    H    GLY  50           H        GLY  50   8.186  -1.241 -16.578
  443    HA2  GLY  50           HA2      GLY  50  10.138  -0.270 -14.539
  444    HA3  GLY  50           HA3      GLY  50   8.413   0.101 -14.390
  445    H    GLN  51           H        GLN  51   9.476  -2.991 -15.761
  446    HA   GLN  51           HA       GLN  51   9.275  -4.421 -13.243
  447    HB2  GLN  51           HB2      GLN  51   7.593  -6.024 -14.112
  448    HB3  GLN  51           HB3      GLN  51   6.939  -4.442 -13.746
  449    HG2  GLN  51           HG2      GLN  51   7.672  -5.257 -16.579
  450    HG3  GLN  51           HG3      GLN  51   6.141  -5.682 -15.868
  451   HE21  GLN  51          HE22      GLN  51   4.582  -3.998 -15.258
  452   HE22  GLN  51          HE21      GLN  51   4.703  -2.412 -15.974
  453    H    ALA  52           H        ALA  52   9.893  -6.740 -13.569
  454    HA   ALA  52           HA       ALA  52  11.660  -7.265 -15.874
  455    HB1  ALA  52           HB1      ALA  52  13.008  -5.773 -14.416
  456    HB2  ALA  52           HB2      ALA  52  12.664  -6.814 -13.019
  457    HB3  ALA  52           HB3      ALA  52  13.637  -7.434 -14.362
  458    H    PHE  53           H        PHE  53  12.567  -9.416 -15.755
  459    HA   PHE  53           HA       PHE  53  11.503 -11.217 -13.634
  460    HD1  PHE  53           HD2      PHE  53   9.548 -13.388 -14.176
  461    HD2  PHE  53           HD1      PHE  53   9.956 -10.570 -17.418
  462    HE1  PHE  53           HE2      PHE  53   7.086 -13.374 -14.480
  463    HE2  PHE  53           HE1      PHE  53   7.486 -10.516 -17.682
  464    HZ   PHE  53           HZ       PHE  53   6.047 -11.930 -16.220
  465    HB2  PHE  53           HB2      PHE  53  11.882 -11.804 -16.599
  466    HB3  PHE  53           HB3      PHE  53  11.705 -13.041 -15.371
  467    H    VAL  54           H        VAL  54  13.101 -12.765 -12.959
  468    HA   VAL  54           HA       VAL  54  15.751 -12.666 -14.170
  469    HB   VAL  54           HB       VAL  54  16.128 -10.800 -12.882
  470   HG11  VAL  54          HG11      VAL  54  14.091 -10.733 -11.461
  471   HG12  VAL  54          HG12      VAL  54  14.808 -12.004 -10.443
  472   HG13  VAL  54          HG13      VAL  54  15.563 -10.409 -10.549
  473   HG21  VAL  54          HG21      VAL  54  17.899 -12.416 -12.480
  474   HG22  VAL  54          HG22      VAL  54  17.645 -11.396 -11.064
  475   HG23  VAL  54          HG23      VAL  54  17.041 -13.061 -11.071
  476    H    ILE  55           H        ILE  55  16.952 -14.439 -13.671
  477    HA   ILE  55           HA       ILE  55  15.436 -16.728 -12.559
  478    HB   ILE  55           HB       ILE  55  17.440 -16.709 -14.859
  479   HG12  ILE  55          HG12      ILE  55  15.526 -17.509 -16.287
  480   HG13  ILE  55          HG13      ILE  55  14.410 -17.054 -15.010
  481   HG21  ILE  55          HG21      ILE  55  15.646 -18.930 -13.783
  482   HG22  ILE  55          HG22      ILE  55  16.753 -19.066 -15.161
  483   HG23  ILE  55          HG23      ILE  55  17.407 -18.824 -13.548
  484   HD11  ILE  55          HD11      ILE  55  14.788 -14.717 -15.429
  485   HD12  ILE  55          HD12      ILE  55  16.262 -15.055 -16.372
  486   HD13  ILE  55          HD13      ILE  55  14.663 -15.486 -17.005
  487    H    PHE  56           H        PHE  56  16.621 -17.951 -11.104
  488    HA   PHE  56           HA       PHE  56  19.292 -16.919 -10.254
  489    HD1  PHE  56           HD2      PHE  56  16.462 -14.966  -9.458
  490    HD2  PHE  56           HD1      PHE  56  19.612 -16.485  -6.940
  491    HE1  PHE  56           HE2      PHE  56  16.776 -12.710  -8.481
  492    HE2  PHE  56           HE1      PHE  56  19.949 -14.208  -5.990
  493    HZ   PHE  56           HZ       PHE  56  18.510 -12.347  -6.728
  494    HB2  PHE  56           HB2      PHE  56  16.712 -17.458  -8.853
  495    HB3  PHE  56           HB3      PHE  56  18.147 -17.991  -8.015
  496    H    LYS  57           H        LYS  57  20.550 -18.449  -8.977
  497    HA   LYS  57           HA       LYS  57  21.294 -20.622 -10.477
  498    HB2  LYS  57           HB2      LYS  57  22.625 -19.403  -8.773
  499    HB3  LYS  57           HB3      LYS  57  21.683 -20.182  -7.488
  500    HG2  LYS  57           HG2      LYS  57  22.580 -22.379  -8.122
  501    HG3  LYS  57           HG3      LYS  57  23.376 -21.676  -9.538
  502    HD2  LYS  57           HD2      LYS  57  24.991 -22.069  -7.764
  503    HD3  LYS  57           HD3      LYS  57  24.844 -20.335  -8.080
  504    HE2  LYS  57           HE2      LYS  57  23.395 -20.068  -6.096
  505    HE3  LYS  57           HE3      LYS  57  23.421 -21.816  -5.818
  506    HZ1  LYS  57           HZ1      LYS  57  24.995 -20.669  -4.393
  507    HZ2  LYS  57           HZ2      LYS  57  25.801 -21.659  -5.401
  508    HZ3  LYS  57           HZ3      LYS  57  25.796 -20.045  -5.668
  509    H    GLU  58           H        GLU  58  18.941 -20.712  -7.751
  510    HA   GLU  58           HA       GLU  58  18.166 -23.435  -8.456
  511    HB2  GLU  58           HB2      GLU  58  20.168 -23.751  -7.006
  512    HB3  GLU  58           HB3      GLU  58  19.452 -22.720  -5.776
  513    HG2  GLU  58           HG2      GLU  58  19.293 -25.073  -5.177
  514    HG3  GLU  58           HG3      GLU  58  17.695 -24.367  -5.349
  515    H    ILE  59           H        ILE  59  16.165 -24.015  -7.309
  516    HA   ILE  59           HA       ILE  59  14.357 -21.844  -7.277
  517    HB   ILE  59           HB       ILE  59  12.682 -23.447  -6.651
  518   HG12  ILE  59          HG12      ILE  59  14.935 -25.377  -5.938
  519   HG13  ILE  59          HG13      ILE  59  13.758 -24.673  -4.830
  520   HG21  ILE  59          HG21      ILE  59  14.610 -24.910  -8.479
  521   HG22  ILE  59          HG22      ILE  59  12.835 -24.914  -8.505
  522   HG23  ILE  59          HG23      ILE  59  13.717 -23.458  -8.959
  523   HD11  ILE  59          HD11      ILE  59  11.929 -25.871  -6.077
  524   HD12  ILE  59          HD12      ILE  59  13.194 -26.712  -7.007
  525   HD13  ILE  59          HD13      ILE  59  13.096 -26.924  -5.253
  526    H    GLY  60           H        GLY  60  16.020 -23.407  -4.525
  527    HA2  GLY  60           HA2      GLY  60  14.457 -22.076  -2.493
  528    HA3  GLY  60           HA3      GLY  60  16.033 -22.867  -2.284
  529    H    SER  61           H        SER  61  17.584 -21.398  -4.135
  530    HA   SER  61           HA       SER  61  18.262 -19.060  -2.677
  531    HG   SER  61           HG       SER  61  20.783 -20.830  -4.472
  532    HB2  SER  61           HB2      SER  61  18.985 -19.785  -5.547
  533    HB3  SER  61           HB3      SER  61  19.885 -18.757  -4.423
  534    H    ALA  62           H        ALA  62  16.414 -19.568  -5.719
  535    HA   ALA  62           HA       ALA  62  15.871 -16.868  -6.357
  536    HB1  ALA  62           HB1      ALA  62  14.051 -19.297  -6.710
  537    HB2  ALA  62           HB2      ALA  62  14.016 -17.799  -7.652
  538    HB3  ALA  62           HB3      ALA  62  15.395 -18.909  -7.790
  539    H    SER  63           H        SER  63  14.004 -19.212  -4.343
  540    HA   SER  63           HA       SER  63  11.951 -17.435  -3.580
  541    HG   SER  63           HG       SER  63  12.551 -20.504  -3.972
  542    HB2  SER  63           HB2      SER  63  13.095 -19.739  -1.945
  543    HB3  SER  63           HB3      SER  63  11.485 -19.015  -1.790
  544    H    ASN  64           H        ASN  64  15.111 -18.067  -2.046
  545    HA   ASN  64           HA       ASN  64  14.684 -16.459   0.256
  546    HB2  ASN  64           HB2      ASN  64  16.517 -18.108   0.079
  547    HB3  ASN  64           HB3      ASN  64  17.302 -17.123  -1.159
  548   HD21  ASN  64          HD22      ASN  64  18.767 -15.572  -0.447
  549   HD22  ASN  64          HD21      ASN  64  18.874 -15.017   1.215
  550    H    ALA  65           H        ALA  65  16.262 -15.645  -2.863
  551    HA   ALA  65           HA       ALA  65  16.854 -12.948  -2.350
  552    HB1  ALA  65           HB1      ALA  65  17.635 -14.235  -4.336
  553    HB2  ALA  65           HB2      ALA  65  15.977 -14.242  -4.991
  554    HB3  ALA  65           HB3      ALA  65  16.850 -12.711  -4.800
  555    H    LEU  66           H        LEU  66  13.968 -14.356  -3.915
  556    HA   LEU  66           HA       LEU  66  12.478 -12.050  -4.363
  557    HG   LEU  66           HG       LEU  66  10.292 -13.157  -5.740
  558    HB2  LEU  66           HB2      LEU  66  12.115 -14.456  -5.086
  559    HB3  LEU  66           HB3      LEU  66  11.479 -14.795  -3.499
  560   HD11  LEU  66          HD11      LEU  66   8.391 -14.798  -5.226
  561   HD12  LEU  66          HD12      LEU  66   9.884 -15.496  -5.890
  562   HD13  LEU  66          HD13      LEU  66   9.518 -15.628  -4.165
  563   HD21  LEU  66          HD21      LEU  66   9.296 -13.210  -2.870
  564   HD22  LEU  66          HD22      LEU  66   9.779 -11.787  -3.798
  565   HD23  LEU  66          HD23      LEU  66   8.329 -12.666  -4.261
  566    H    ARG  67           H        ARG  67  12.182 -14.281  -1.530
  567    HA   ARG  67           HA       ARG  67  10.177 -12.700  -0.320
  568    HE   ARG  67           HE       ARG  67   7.903 -16.266   2.872
  569    HB2  ARG  67           HB2      ARG  67  10.773 -15.186  -0.010
  570    HB3  ARG  67           HB3      ARG  67  12.030 -14.664   1.118
  571    HG2  ARG  67           HG2      ARG  67  10.255 -13.593   2.533
  572    HG3  ARG  67           HG3      ARG  67   9.033 -14.105   1.349
  573    HD2  ARG  67           HD2      ARG  67   9.830 -16.496   1.704
  574    HD3  ARG  67           HD3      ARG  67  10.811 -15.916   3.052
  575   HH11  ARG  67          HH21      ARG  67  10.479 -14.695   4.780
  576   HH12  ARG  67          HH22      ARG  67   9.536 -14.599   6.219
  577   HH21  ARG  67          HH11      ARG  67   6.717 -16.238   4.763
  578   HH22  ARG  67          HH12      ARG  67   7.313 -15.469   6.212
  579    H    THR  68           H        THR  68  13.761 -12.718   0.124
  580    HA   THR  68           HA       THR  68  13.718 -10.976   2.412
  581    HB   THR  68           HB       THR  68  15.974 -11.455   0.416
  582    HG1  THR  68           HG1      THR  68  15.459 -13.392   1.150
  583   HG21  THR  68          HG21      THR  68  16.495  -9.597   1.922
  584   HG22  THR  68          HG22      THR  68  15.983 -10.548   3.334
  585   HG23  THR  68          HG23      THR  68  17.426 -11.018   2.410
  586    H    MET  69           H        MET  69  14.058 -10.397  -1.133
  587    HA   MET  69           HA       MET  69  14.489  -7.546  -0.701
  588    HB2  MET  69           HB2      MET  69  14.121  -9.187  -3.240
  589    HB3  MET  69           HB3      MET  69  14.549  -7.478  -3.183
  590    HG2  MET  69           HG2      MET  69  16.205  -9.786  -2.079
  591    HG3  MET  69           HG3      MET  69  16.547  -8.859  -3.524
  592    HE1  MET  69           HE1      MET  69  16.090  -5.866  -2.788
  593    HE2  MET  69           HE2      MET  69  17.642  -5.366  -2.074
  594    HE3  MET  69           HE3      MET  69  17.626  -6.389  -3.518
  595    H    GLN  70           H        GLN  70  11.658  -9.463  -0.888
  596    HA   GLN  70           HA       GLN  70   9.817  -7.777  -2.095
  597    HB2  GLN  70           HB2      GLN  70   9.354 -10.056  -1.156
  598    HB3  GLN  70           HB3      GLN  70   9.501  -9.399   0.473
  599    HG2  GLN  70           HG2      GLN  70   7.195  -9.640   0.035
  600    HG3  GLN  70           HG3      GLN  70   7.509  -7.910  -0.008
  601   HE21  GLN  70          HE22      GLN  70   5.964 -10.437  -1.642
  602   HE22  GLN  70          HE21      GLN  70   5.966  -9.793  -3.272
  603    H    GLY  71           H        GLY  71   9.117  -5.737  -1.735
  604    HA2  GLY  71           HA2      GLY  71   8.565  -3.813  -0.687
  605    HA3  GLY  71           HA3      GLY  71   8.815  -4.590   0.880
  606    H    PHE  72           H        PHE  72  11.716  -4.986  -0.885
  607    HA   PHE  72           HA       PHE  72  13.100  -3.237   0.894
  608    HD1  PHE  72           HD2      PHE  72  15.619  -4.399   1.686
  609    HD2  PHE  72           HD1      PHE  72  15.731  -2.975  -2.382
  610    HE1  PHE  72           HE2      PHE  72  17.865  -3.422   2.088
  611    HE2  PHE  72           HE1      PHE  72  17.985  -1.999  -1.974
  612    HZ   PHE  72           HZ       PHE  72  19.049  -2.220   0.259
  613    HB2  PHE  72           HB2      PHE  72  14.073  -5.281  -0.079
  614    HB3  PHE  72           HB3      PHE  72  14.035  -4.552  -1.684
  615    HA   PRO  73           HA       PRO  73  12.646   0.460  -1.689
  616    HB2  PRO  73           HB2      PRO  73  14.089   2.263  -0.286
  617    HB3  PRO  73           HB3      PRO  73  12.532   1.600   0.294
  618    HG2  PRO  73           HG2      PRO  73  15.329   0.701   1.071
  619    HG3  PRO  73           HG3      PRO  73  13.943   1.058   2.147
  620    HD2  PRO  73           HD2      PRO  73  14.590  -1.487   1.311
  621    HD3  PRO  73           HD3      PRO  73  12.907  -0.982   1.644
  622    H    PHE  74           H        PHE  74  13.725  -0.637  -3.428
  623    HA   PHE  74           HA       PHE  74  16.533  -1.079  -3.575
  624    HD1  PHE  74           HD1      PHE  74  17.285  -3.157  -4.809
  625    HD2  PHE  74           HD2      PHE  74  15.197  -1.064  -7.950
  626    HE1  PHE  74           HE1      PHE  74  18.586  -4.399  -6.523
  627    HE2  PHE  74           HE2      PHE  74  16.538  -2.272  -9.646
  628    HZ   PHE  74           HZ       PHE  74  18.181  -3.995  -8.934
  629    HB2  PHE  74           HB2      PHE  74  14.760  -2.266  -4.754
  630    HB3  PHE  74           HB3      PHE  74  14.423  -0.862  -5.756
  631    H    TYR  75           H        TYR  75  14.489   1.516  -4.887
  632    HA   TYR  75           HA       TYR  75  16.671   3.439  -4.697
  633    HD1  TYR  75           HD2      TYR  75  18.614   4.305  -6.341
  634    HD2  TYR  75           HD1      TYR  75  16.602   0.915  -8.092
  635    HE1  TYR  75           HE2      TYR  75  20.802   3.366  -7.029
  636    HE2  TYR  75           HE1      TYR  75  18.773  -0.034  -8.780
  637    HH   TYR  75           HH       TYR  75  21.061   0.302  -8.893
  638    HB2  TYR  75           HB2      TYR  75  15.325   2.802  -7.355
  639    HB3  TYR  75           HB3      TYR  75  16.136   4.326  -7.023
  640    H    ASP  76           H        ASP  76  15.203   3.783  -2.943
  641    HA   ASP  76           HA       ASP  76  13.641   4.852  -1.767
  642    HB2  ASP  76           HB2      ASP  76  14.081   6.843  -3.023
  643    HB3  ASP  76           HB3      ASP  76  13.038   6.327  -4.344
  644    H    LYS  77           H        LYS  77  12.376   3.485  -4.816
  645    HA   LYS  77           HA       LYS  77   9.694   3.302  -3.715
  646    HB2  LYS  77           HB2      LYS  77  10.798   2.025  -6.254
  647    HB3  LYS  77           HB3      LYS  77   9.099   2.252  -5.841
  648    HG2  LYS  77           HG2      LYS  77  11.145   4.399  -6.505
  649    HG3  LYS  77           HG3      LYS  77   9.753   3.919  -7.474
  650    HD2  LYS  77           HD2      LYS  77   8.213   4.885  -5.847
  651    HD3  LYS  77           HD3      LYS  77   9.543   5.191  -4.713
  652    HE2  LYS  77           HE2      LYS  77  10.602   6.569  -6.662
  653    HE3  LYS  77           HE3      LYS  77   8.956   6.608  -7.314
  654    HZ1  LYS  77           HZ1      LYS  77   8.260   7.603  -5.186
  655    HZ2  LYS  77           HZ2      LYS  77   9.806   7.527  -4.617
  656    HZ3  LYS  77           HZ3      LYS  77   9.428   8.511  -5.876
  657    HA   PRO  78           HA       PRO  78  10.501  -0.701  -1.849
  658    HB2  PRO  78           HB2      PRO  78   7.939  -1.486  -1.264
  659    HB3  PRO  78           HB3      PRO  78   8.830  -0.250  -0.323
  660    HG2  PRO  78           HG2      PRO  78   6.781   0.184  -2.509
  661    HG3  PRO  78           HG3      PRO  78   6.912   1.012  -0.926
  662    HD2  PRO  78           HD2      PRO  78   7.883   2.091  -3.253
  663    HD3  PRO  78           HD3      PRO  78   8.681   2.366  -1.674
  664    H    MET  79           H        MET  79  11.042  -2.400  -3.096
  665    HA   MET  79           HA       MET  79  10.022  -2.960  -5.690
  666    HB2  MET  79           HB2      MET  79  11.416  -4.731  -3.627
  667    HB3  MET  79           HB3      MET  79  11.138  -5.202  -5.312
  668    HG2  MET  79           HG2      MET  79  12.618  -2.670  -4.552
  669    HG3  MET  79           HG3      MET  79  13.427  -4.218  -4.720
  670    HE1  MET  79           HE1      MET  79  14.320  -4.482  -8.253
  671    HE2  MET  79           HE2      MET  79  14.849  -4.450  -6.560
  672    HE3  MET  79           HE3      MET  79  13.576  -5.580  -7.068
  673    H    GLN  80           H        GLN  80   8.364  -4.276  -6.401
  674    HA   GLN  80           HA       GLN  80   6.785  -5.771  -4.342
  675    HB2  GLN  80           HB2      GLN  80   5.866  -4.381  -6.894
  676    HB3  GLN  80           HB3      GLN  80   4.892  -5.545  -5.976
  677    HG2  GLN  80           HG2      GLN  80   5.023  -4.072  -3.972
  678    HG3  GLN  80           HG3      GLN  80   6.009  -2.924  -4.875
  679   HE21  GLN  80          HE22      GLN  80   4.657  -1.120  -4.980
  680   HE22  GLN  80          HE21      GLN  80   3.054  -1.151  -5.669
  681    H    ILE  81           H        ILE  81   7.108  -7.899  -4.602
  682    HA   ILE  81           HA       ILE  81   8.195  -8.865  -7.190
  683    HB   ILE  81           HB       ILE  81   9.166  -9.757  -4.464
  684   HG12  ILE  81          HG12      ILE  81  10.258  -7.447  -6.107
  685   HG13  ILE  81          HG13      ILE  81   9.748  -7.483  -4.403
  686   HG21  ILE  81          HG21      ILE  81   9.604 -11.214  -6.516
  687   HG22  ILE  81          HG22      ILE  81  10.576  -9.898  -7.162
  688   HG23  ILE  81          HG23      ILE  81  11.051 -10.711  -5.661
  689   HD11  ILE  81          HD11      ILE  81  12.260  -8.706  -5.566
  690   HD12  ILE  81          HD12      ILE  81  12.116  -7.358  -4.434
  691   HD13  ILE  81          HD13      ILE  81  11.679  -9.000  -3.909
  692    H    ALA  82           H        ALA  82   7.783 -11.097  -7.614
  693    HA   ALA  82           HA       ALA  82   6.139 -12.673  -5.777
  694    HB1  ALA  82           HB1      ALA  82   4.425 -11.460  -7.159
  695    HB2  ALA  82           HB2      ALA  82   5.205 -12.076  -8.634
  696    HB3  ALA  82           HB3      ALA  82   4.439 -13.200  -7.494
  697    H    TYR  83           H        TYR  83   5.933 -14.939  -6.808
  698    HA   TYR  83           HA       TYR  83   8.520 -15.720  -7.999
  699    HD1  TYR  83           HD2      TYR  83   5.633 -16.405  -5.063
  700    HD2  TYR  83           HD1      TYR  83   5.507 -18.702  -8.718
  701    HE1  TYR  83           HE2      TYR  83   3.263 -16.960  -4.626
  702    HE2  TYR  83           HE1      TYR  83   3.129 -19.241  -8.302
  703    HH   TYR  83           HH       TYR  83   1.308 -18.983  -6.867
  704    HB2  TYR  83           HB2      TYR  83   7.653 -18.014  -7.720
  705    HB3  TYR  83           HB3      TYR  83   7.710 -17.124  -6.217
  706    H    SER  84           H        SER  84   8.334 -17.306  -9.866
  707    HA   SER  84           HA       SER  84   6.116 -16.718 -11.749
  708    HG   SER  84           HG       SER  84   7.370 -14.552 -12.038
  709    HB2  SER  84           HB2      SER  84   9.052 -16.784 -12.514
  710    HB3  SER  84           HB3      SER  84   7.682 -16.330 -13.537
  711    H    LYS  85           H        LYS  85   6.837 -18.349 -13.790
  712    HA   LYS  85           HA       LYS  85   7.716 -20.940 -12.683
  713    HB2  LYS  85           HB2      LYS  85   5.182 -20.489 -14.322
  714    HB3  LYS  85           HB3      LYS  85   5.974 -22.060 -14.143
  715    HG2  LYS  85           HG2      LYS  85   5.711 -21.942 -11.685
  716    HG3  LYS  85           HG3      LYS  85   4.878 -20.384 -11.842
  717    HD2  LYS  85           HD2      LYS  85   3.104 -21.430 -13.184
  718    HD3  LYS  85           HD3      LYS  85   3.899 -23.005 -13.072
  719    HE2  LYS  85           HE2      LYS  85   2.957 -21.376 -10.664
  720    HE3  LYS  85           HE3      LYS  85   1.966 -22.600 -11.463
  721    HZ1  LYS  85           HZ1      LYS  85   3.645 -24.253 -10.901
  722    HZ2  LYS  85           HZ2      LYS  85   4.559 -23.131 -10.134
  723    HZ3  LYS  85           HZ3      LYS  85   3.087 -23.524  -9.559
  724    H    SER  86           H        SER  86   8.633 -22.283 -14.355
  725    HA   SER  86           HA       SER  86  10.261 -20.915 -16.190
  726    HG   SER  86           HG       SER  86  11.171 -24.122 -14.813
  727    HB2  SER  86           HB2      SER  86   9.424 -23.833 -16.322
  728    HB3  SER  86           HB3      SER  86  10.960 -23.111 -16.836
  729    H    ASP  87           H        ASP  87  10.145 -20.773 -18.519
  730    HA   ASP  87           HA       ASP  87   7.663 -21.532 -19.903
  731    HB2  ASP  87           HB2      ASP  87   7.108 -19.287 -19.100
  732    HB3  ASP  87           HB3      ASP  87   8.663 -18.660 -19.645
  733    H    SER  88           H        SER  88   8.065 -21.810 -22.130
  734    HA   SER  88           HA       SER  88  10.499 -22.787 -22.810
  735    HG   SER  88           HG       SER  88   7.443 -23.617 -24.557
  736    HB2  SER  88           HB2      SER  88   8.539 -21.605 -24.798
  737    HB3  SER  88           HB3      SER  88   9.616 -22.999 -25.010
  738    H    ASP  89           H        ASP  89   9.549 -19.326 -23.125
  739    HA   ASP  89           HA       ASP  89  11.672 -18.724 -25.015
  740    HB2  ASP  89           HB2      ASP  89   9.687 -17.300 -24.859
  741    HB3  ASP  89           HB3      ASP  89  10.067 -16.914 -23.173
  742    H    ILE  90           H        ILE  90  11.320 -18.346 -21.469
  743    HA   ILE  90           HA       ILE  90  14.024 -17.271 -21.239
  744    HB   ILE  90           HB       ILE  90  13.749 -17.440 -18.826
  745   HG12  ILE  90          HG12      ILE  90  10.957 -18.535 -19.367
  746   HG13  ILE  90          HG13      ILE  90  12.303 -19.460 -18.684
  747   HG21  ILE  90          HG21      ILE  90  11.336 -16.157 -20.168
  748   HG22  ILE  90          HG22      ILE  90  12.145 -15.641 -18.669
  749   HG23  ILE  90          HG23      ILE  90  12.985 -15.499 -20.215
  750   HD11  ILE  90          HD11      ILE  90  12.376 -17.841 -16.768
  751   HD12  ILE  90          HD12      ILE  90  10.887 -17.096 -17.405
  752   HD13  ILE  90          HD13      ILE  90  10.876 -18.784 -16.880
  753    H    VAL  91           H        VAL  91  12.527 -20.503 -21.008
  754    HA   VAL  91           HA       VAL  91  14.877 -21.800 -20.084
  755    HB   VAL  91           HB       VAL  91  12.502 -22.759 -21.710
  756   HG11  VAL  91          HG11      VAL  91  14.779 -24.453 -20.590
  757   HG12  VAL  91          HG12      VAL  91  13.233 -25.085 -21.201
  758   HG13  VAL  91          HG13      VAL  91  14.343 -24.267 -22.303
  759   HG21  VAL  91          HG21      VAL  91  11.847 -23.840 -19.611
  760   HG22  VAL  91          HG22      VAL  91  13.357 -23.323 -18.829
  761   HG23  VAL  91          HG23      VAL  91  12.140 -22.128 -19.288
  762    H    ALA  92           H        ALA  92  13.734 -20.999 -23.450
  763    HA   ALA  92           HA       ALA  92  15.931 -22.120 -24.789
  764    HB1  ALA  92           HB1      ALA  92  14.415 -19.592 -25.581
  765    HB2  ALA  92           HB2      ALA  92  15.351 -20.652 -26.644
  766    HB3  ALA  92           HB3      ALA  92  13.855 -21.244 -25.893
  767    H    LYS  93           H        LYS  93  15.550 -18.803 -23.423
  768    HA   LYS  93           HA       LYS  93  18.058 -17.795 -24.241
  769    HB2  LYS  93           HB2      LYS  93  16.315 -17.161 -21.829
  770    HB3  LYS  93           HB3      LYS  93  17.832 -16.321 -22.140
  771    HG2  LYS  93           HG2      LYS  93  17.061 -15.502 -24.277
  772    HG3  LYS  93           HG3      LYS  93  15.563 -16.441 -24.167
  773    HD2  LYS  93           HD2      LYS  93  14.784 -15.122 -22.276
  774    HD3  LYS  93           HD3      LYS  93  16.354 -14.324 -22.123
  775    HE2  LYS  93           HE2      LYS  93  14.785 -12.800 -23.151
  776    HE3  LYS  93           HE3      LYS  93  16.061 -13.217 -24.299
  777    HZ1  LYS  93           HZ1      LYS  93  13.852 -13.244 -25.302
  778    HZ2  LYS  93           HZ2      LYS  93  14.509 -14.733 -25.374
  779    HZ3  LYS  93           HZ3      LYS  93  13.336 -14.410 -24.273
  780    H    ILE  94           H        ILE  94  17.298 -19.482 -21.097
  781    HA   ILE  94           HA       ILE  94  20.077 -19.216 -20.351
  782    HB   ILE  94           HB       ILE  94  19.538 -20.351 -18.328
  783   HG12  ILE  94          HG12      ILE  94  16.865 -21.058 -19.573
  784   HG13  ILE  94          HG13      ILE  94  18.128 -22.168 -19.053
  785   HG21  ILE  94          HG21      ILE  94  17.251 -18.457 -19.015
  786   HG22  ILE  94          HG22      ILE  94  17.994 -18.730 -17.431
  787   HG23  ILE  94          HG23      ILE  94  18.921 -17.948 -18.711
  788   HD11  ILE  94          HD11      ILE  94  16.382 -22.210 -17.415
  789   HD12  ILE  94          HD12      ILE  94  17.779 -21.389 -16.688
  790   HD13  ILE  94          HD13      ILE  94  16.376 -20.448 -17.263
  791    H    LYS  95           H        LYS  95  18.208 -21.880 -21.778
  792    HA   LYS  95           HA       LYS  95  20.315 -23.822 -21.324
  793    HB2  LYS  95           HB2      LYS  95  17.706 -24.143 -21.654
  794    HB3  LYS  95           HB3      LYS  95  18.088 -24.096 -23.375
  795    HG2  LYS  95           HG2      LYS  95  18.071 -26.373 -22.817
  796    HG3  LYS  95           HG3      LYS  95  19.800 -25.962 -22.841
  797    HD2  LYS  95           HD2      LYS  95  19.829 -25.794 -20.395
  798    HD3  LYS  95           HD3      LYS  95  18.091 -26.071 -20.307
  799    HE2  LYS  95           HE2      LYS  95  20.104 -28.083 -21.422
  800    HE3  LYS  95           HE3      LYS  95  19.564 -28.039 -19.744
  801    HZ1  LYS  95           HZ1      LYS  95  17.257 -28.350 -20.616
  802    HZ2  LYS  95           HZ2      LYS  95  17.887 -28.683 -22.107
  803    HZ3  LYS  95           HZ3      LYS  95  18.250 -29.618 -20.838
  804    H    GLY  96           H        GLY  96  19.368 -21.717 -24.003
  805    HA2  GLY  96           HA2      GLY  96  21.311 -20.647 -25.073
  806    HA3  GLY  96           HA3      GLY  96  21.979 -22.258 -25.359
  807    H    THR  97           H        THR  97  19.162 -23.301 -25.914
  808    HA   THR  97           HA       THR  97  18.351 -22.041 -28.411
  809    HB   THR  97           HB       THR  97  18.483 -24.373 -29.514
  810    HG1  THR  97           HG1      THR  97  19.056 -25.738 -28.031
  811   HG21  THR  97          HG21      THR  97  21.194 -23.113 -28.955
  812   HG22  THR  97          HG22      THR  97  20.726 -24.127 -30.331
  813   HG23  THR  97          HG23      THR  97  20.025 -22.509 -30.153
  814    H    PHE  98           H        PHE  98  16.212 -23.136 -29.082
  815    HA   PHE  98           HA       PHE  98  14.433 -23.080 -26.942
  816    HD1  PHE  98           HD2      PHE  98  12.215 -21.618 -27.992
  817    HD2  PHE  98           HD1      PHE  98  12.062 -25.825 -28.955
  818    HE1  PHE  98           HE2      PHE  98   9.805 -21.668 -27.405
  819    HE2  PHE  98           HE1      PHE  98   9.655 -25.870 -28.355
  820    HZ   PHE  98           HZ       PHE  98   8.520 -23.793 -27.584
  821    HB2  PHE  98           HB2      PHE  98  13.967 -22.726 -29.392
  822    HB3  PHE  98           HB3      PHE  98  13.992 -24.471 -29.605
  823    H    LYS  99           H        LYS  99  16.122 -25.820 -28.284
  824    HA   LYS  99           HA       LYS  99  15.467 -27.474 -25.954
  825    HB2  LYS  99           HB2      LYS  99  14.122 -28.246 -28.055
  826    HB3  LYS  99           HB3      LYS  99  15.673 -28.515 -28.826
  827    HG2  LYS  99           HG2      LYS  99  15.039 -30.617 -28.123
  828    HG3  LYS  99           HG3      LYS  99  16.208 -30.156 -26.895
  829    HD2  LYS  99           HD2      LYS  99  13.246 -29.632 -26.456
  830    HD3  LYS  99           HD3      LYS  99  13.832 -31.274 -26.319
  831    HE2  LYS  99           HE2      LYS  99  15.090 -29.010 -24.719
  832    HE3  LYS  99           HE3      LYS  99  13.641 -29.860 -24.180
  833    HZ1  LYS  99           HZ1      LYS  99  14.929 -31.945 -24.270
  834    HZ2  LYS  99           HZ2      LYS  99  16.300 -31.088 -24.645
  835    HZ3  LYS  99           HZ3      LYS  99  15.575 -30.850 -23.236
  836    H    GLU 100           H        GLU 100  17.588 -28.352 -25.257
  837    HA   GLU 100           HA       GLU 100  19.766 -26.822 -26.152
  838    HB2  GLU 100           HB2      GLU 100  21.179 -28.124 -24.766
  839    HB3  GLU 100           HB3      GLU 100  19.673 -27.770 -23.961
  840    HG2  GLU 100           HG2      GLU 100  20.487 -30.472 -25.109
  841    HG3  GLU 100           HG3      GLU 100  20.404 -30.020 -23.414
  842    H    ARG 101           H        ARG 101  20.822 -26.864 -27.952
  843    HA   ARG 101           HA       ARG 101  21.516 -27.399 -30.034
  844    HE   ARG 101           HE       ARG 101  25.129 -25.546 -27.059
  845    HB2  ARG 101           HB2      ARG 101  22.898 -29.722 -28.694
  846    HB3  ARG 101           HB3      ARG 101  23.459 -28.722 -30.033
  847    HG2  ARG 101           HG2      ARG 101  23.219 -28.005 -27.089
  848    HG3  ARG 101           HG3      ARG 101  24.690 -28.159 -28.028
  849    HD2  ARG 101           HD2      ARG 101  24.291 -26.095 -29.195
  850    HD3  ARG 101           HD3      ARG 101  22.637 -25.969 -28.604
  851   HH11  ARG 101          HH21      ARG 101  21.553 -25.031 -27.134
  852   HH12  ARG 101          HH22      ARG 101  21.524 -24.693 -25.427
  853   HH21  ARG 101          HH11      ARG 101  24.941 -24.810 -24.871
  854   HH22  ARG 101          HH12      ARG 101  23.378 -24.402 -24.234
  855    HA   PRO 102           HA       PRO 102  17.942 -30.153 -30.554
  856    HB2  PRO 102           HB2      PRO 102  17.929 -28.725 -33.221
  857    HB3  PRO 102           HB3      PRO 102  16.537 -29.203 -32.197
  858    HG2  PRO 102           HG2      PRO 102  17.442 -26.655 -32.132
  859    HG3  PRO 102           HG3      PRO 102  17.033 -27.491 -30.598
  860    HD2  PRO 102           HD2      PRO 102  19.756 -27.060 -31.840
  861    HD3  PRO 102           HD3      PRO 102  19.251 -26.877 -30.140
  862    H    LYS 103           H        LYS 103  20.743 -30.053 -32.698
  863    HA   LYS 103           HA       LYS 103  19.950 -32.693 -33.828
  864    HB2  LYS 103           HB2      LYS 103  21.747 -30.564 -35.072
  865    HB3  LYS 103           HB3      LYS 103  21.315 -32.101 -35.813
  866    HG2  LYS 103           HG2      LYS 103  19.373 -29.830 -35.207
  867    HG3  LYS 103           HG3      LYS 103  20.067 -30.231 -36.777
  868    HD2  LYS 103           HD2      LYS 103  18.960 -32.461 -36.706
  869    HD3  LYS 103           HD3      LYS 103  18.205 -32.025 -35.156
  870    HE2  LYS 103           HE2      LYS 103  17.102 -30.082 -36.236
  871    HE3  LYS 103           HE3      LYS 103  17.848 -30.511 -37.779
  872    HZ1  LYS 103           HZ1      LYS 103  16.604 -32.595 -37.728
  873    HZ2  LYS 103           HZ2      LYS 103  15.912 -32.199 -36.298
  874    HZ3  LYS 103           HZ3      LYS 103  15.585 -31.329 -37.635
  875    H    LYS 104           H        LYS 104  21.353 -32.107 -31.308
  876    HA   LYS 104           HA       LYS 104  24.044 -33.108 -31.534
  877    HB2  LYS 104           HB2      LYS 104  23.924 -33.556 -29.172
  878    HB3  LYS 104           HB3      LYS 104  23.266 -31.962 -29.524
  879    HG2  LYS 104           HG2      LYS 104  20.931 -32.995 -29.355
  880    HG3  LYS 104           HG3      LYS 104  21.711 -34.487 -28.800
  881    HD2  LYS 104           HD2      LYS 104  22.759 -33.256 -26.928
  882    HD3  LYS 104           HD3      LYS 104  22.004 -31.754 -27.464
  883    HE2  LYS 104           HE2      LYS 104  20.500 -34.245 -26.522
  884    HE3  LYS 104           HE3      LYS 104  20.860 -32.820 -25.542
  885    HZ1  LYS 104           HZ1      LYS 104  18.762 -32.373 -26.259
  886    HZ2  LYS 104           HZ2      LYS 104  19.623 -31.548 -27.348
  887    HZ3  LYS 104           HZ3      LYS 104  18.974 -33.004 -27.779
  Start of MODEL   16
    1    HA   MET   1           HA       MET   1   4.071 -15.381   4.683
    2    H1   MET   1           H1       MET   1   4.481 -16.203   6.884
    3    H2   MET   1           H2       MET   1   5.181 -17.211   5.776
    4    H3   MET   1           H3       MET   1   6.109 -16.181   6.644
    5    HB2  MET   1           HB2      MET   1   6.063 -13.710   6.284
    6    HB3  MET   1           HB3      MET   1   5.274 -13.149   4.812
    7    HG2  MET   1           HG2      MET   1   4.047 -12.277   6.632
    8    HG3  MET   1           HG3      MET   1   3.050 -13.494   5.848
    9    HE1  MET   1           HE1      MET   1   1.377 -13.412   7.888
   10    HE2  MET   1           HE2      MET   1   1.870 -13.601   9.586
   11    HE3  MET   1           HE3      MET   1   2.395 -12.176   8.662
   12    H    GLU   2           H        GLU   2   4.691 -16.143   2.710
   13    HA   GLU   2           HA       GLU   2   7.384 -15.822   1.734
   14    HB2  GLU   2           HB2      GLU   2   7.877 -18.185   1.458
   15    HB3  GLU   2           HB3      GLU   2   7.694 -17.829   3.159
   16    HG2  GLU   2           HG2      GLU   2   5.646 -19.211   1.372
   17    HG3  GLU   2           HG3      GLU   2   6.721 -19.996   2.514
   18    H    MET   3           H        MET   3   7.548 -16.760  -0.494
   19    HA   MET   3           HA       MET   3   4.943 -16.886  -1.935
   20    HB2  MET   3           HB2      MET   3   7.477 -15.319  -2.567
   21    HB3  MET   3           HB3      MET   3   6.395 -15.856  -3.839
   22    HG2  MET   3           HG2      MET   3   5.927 -13.562  -3.284
   23    HG3  MET   3           HG3      MET   3   4.550 -14.594  -2.962
   24    HE1  MET   3           HE1      MET   3   7.109 -12.756   0.482
   25    HE2  MET   3           HE2      MET   3   7.691 -14.081  -0.545
   26    HE3  MET   3           HE3      MET   3   7.482 -12.453  -1.226
   27    H    LEU   4           H        LEU   4   5.006 -18.352  -3.725
   28    HA   LEU   4           HA       LEU   4   6.243 -20.755  -3.011
   29    HG   LEU   4           HG       LEU   4   3.351 -19.727  -3.991
   30    HB2  LEU   4           HB2      LEU   4   5.082 -20.020  -5.724
   31    HB3  LEU   4           HB3      LEU   4   5.412 -21.647  -5.152
   32   HD11  LEU   4          HD11      LEU   4   3.020 -22.315  -5.565
   33   HD12  LEU   4          HD12      LEU   4   1.712 -21.308  -4.903
   34   HD13  LEU   4          HD13      LEU   4   2.750 -20.673  -6.187
   35   HD21  LEU   4          HD21      LEU   4   4.030 -22.586  -3.171
   36   HD22  LEU   4          HD22      LEU   4   4.192 -21.121  -2.172
   37   HD23  LEU   4          HD23      LEU   4   2.591 -21.687  -2.643
   38    HA   PRO   5           HA       PRO   5  10.330 -20.522  -5.005
   39    HB2  PRO   5           HB2      PRO   5   9.923 -23.507  -5.088
   40    HB3  PRO   5           HB3      PRO   5  11.370 -22.570  -4.596
   41    HG2  PRO   5           HG2      PRO   5   9.761 -23.666  -2.719
   42    HG3  PRO   5           HG3      PRO   5  10.400 -22.002  -2.508
   43    HD2  PRO   5           HD2      PRO   5   7.654 -22.846  -3.470
   44    HD3  PRO   5           HD3      PRO   5   8.109 -21.562  -2.305
   45    H    ASN   6           H        ASN   6  10.917 -20.377  -7.072
   46    HA   ASN   6           HA       ASN   6  10.065 -22.143  -9.179
   47    HB2  ASN   6           HB2      ASN   6   8.203 -20.468  -9.294
   48    HB3  ASN   6           HB3      ASN   6   9.382 -19.157  -9.301
   49   HD21  ASN   6          HD21      ASN   6   9.678 -18.329 -11.381
   50   HD22  ASN   6          HD22      ASN   6   9.557 -19.293 -12.842
   51    H    GLN   7           H        GLN   7  11.736 -21.806 -10.980
   52    HA   GLN   7           HA       GLN   7  14.213 -20.956  -9.801
   53    HB2  GLN   7           HB2      GLN   7  13.643 -22.763 -11.705
   54    HB3  GLN   7           HB3      GLN   7  13.999 -21.394 -12.768
   55    HG2  GLN   7           HG2      GLN   7  16.168 -21.135 -11.352
   56    HG3  GLN   7           HG3      GLN   7  15.803 -22.719 -10.690
   57   HE21  GLN   7          HE22      GLN   7  17.830 -21.372 -12.766
   58   HE22  GLN   7          HE21      GLN   7  17.918 -22.589 -14.033
   59    H    THR   8           H        THR   8  11.807 -19.018 -11.014
   60    HA   THR   8           HA       THR   8  13.606 -16.800 -11.711
   61    HB   THR   8           HB       THR   8  11.153 -17.615 -13.335
   62    HG1  THR   8           HG1      THR   8  12.637 -19.157 -13.744
   63   HG21  THR   8          HG21      THR   8  11.958 -16.079 -15.042
   64   HG22  THR   8          HG22      THR   8  11.796 -15.188 -13.525
   65   HG23  THR   8          HG23      THR   8  13.389 -15.693 -14.070
   66    H    ILE   9           H        ILE   9  12.535 -14.733 -11.286
   67    HA   ILE   9           HA       ILE   9   9.929 -14.899  -9.885
   68    HB   ILE   9           HB       ILE   9  10.556 -13.624  -8.046
   69   HG12  ILE   9          HG12      ILE   9  13.031 -12.883  -9.574
   70   HG13  ILE   9          HG13      ILE   9  11.770 -11.837  -8.958
   71   HG21  ILE   9          HG21      ILE   9  12.281 -14.911  -6.919
   72   HG22  ILE   9          HG22      ILE   9  11.323 -15.986  -7.938
   73   HG23  ILE   9          HG23      ILE   9  12.944 -15.460  -8.449
   74   HD11  ILE   9          HD11      ILE   9  13.883 -13.247  -7.284
   75   HD12  ILE   9          HD12      ILE   9  13.726 -11.519  -7.615
   76   HD13  ILE   9          HD13      ILE   9  12.512 -12.350  -6.618
   77    H    TYR  10           H        TYR  10   9.117 -12.564  -9.574
   78    HA   TYR  10           HA       TYR  10   9.272 -11.019 -12.133
   79    HD1  TYR  10           HD1      TYR  10   7.325  -9.854 -13.448
   80    HD2  TYR  10           HD2      TYR  10   5.013 -11.584 -10.246
   81    HE1  TYR  10           HE1      TYR  10   5.425  -8.374 -14.018
   82    HE2  TYR  10           HE2      TYR  10   3.131 -10.069 -10.763
   83    HH   TYR  10           HH       TYR  10   3.185  -7.814 -13.544
   84    HB2  TYR  10           HB2      TYR  10   7.469 -12.497 -12.349
   85    HB3  TYR  10           HB3      TYR  10   7.054 -12.427 -10.656
   86    H    ILE  11           H        ILE  11   9.899  -9.082 -11.577
   87    HA   ILE  11           HA       ILE  11   9.393  -7.957  -8.864
   88    HB   ILE  11           HB       ILE  11  11.459  -7.436 -11.043
   89   HG12  ILE  11          HG12      ILE  11  11.905  -8.221  -8.132
   90   HG13  ILE  11          HG13      ILE  11  11.718  -9.410  -9.412
   91   HG21  ILE  11          HG21      ILE  11  12.452  -5.684  -9.593
   92   HG22  ILE  11          HG22      ILE  11  10.860  -5.226 -10.135
   93   HG23  ILE  11          HG23      ILE  11  11.068  -5.828  -8.475
   94   HD11  ILE  11          HD11      ILE  11  13.683  -8.409 -10.609
   95   HD12  ILE  11          HD12      ILE  11  13.968  -7.389  -9.176
   96   HD13  ILE  11          HD13      ILE  11  14.047  -9.158  -9.047
   97    H    ASN  12           H        ASN  12   8.264  -6.040  -8.762
   98    HA   ASN  12           HA       ASN  12   7.278  -4.739 -11.219
   99    HB2  ASN  12           HB2      ASN  12   5.788  -6.755 -10.121
  100    HB3  ASN  12           HB3      ASN  12   5.251  -5.425  -9.103
  101   HD21  ASN  12          HD22      ASN  12   5.286  -6.818 -12.297
  102   HD22  ASN  12          HD21      ASN  12   4.154  -5.710 -13.040
  103    H    ASN  13           H        ASN  13   5.682  -2.907 -10.335
  104    HA   ASN  13           HA       ASN  13   5.738  -0.801  -9.594
  105    HB2  ASN  13           HB2      ASN  13   5.066  -2.009  -7.475
  106    HB3  ASN  13           HB3      ASN  13   6.747  -1.890  -6.946
  107   HD21  ASN  13          HD22      ASN  13   6.849  -0.276  -5.389
  108   HD22  ASN  13          HD21      ASN  13   5.967   1.239  -5.477
  109    H    LEU  14           H        LEU  14   8.063  -1.793 -10.971
  110    HA   LEU  14           HA       LEU  14  10.494  -0.685  -9.790
  111    HG   LEU  14           HG       LEU  14  12.193  -2.419 -10.715
  112    HB2  LEU  14           HB2      LEU  14   9.956  -2.653 -11.610
  113    HB3  LEU  14           HB3      LEU  14  10.184  -1.312 -12.723
  114   HD11  LEU  14          HD11      LEU  14  13.383  -3.133 -12.757
  115   HD12  LEU  14          HD12      LEU  14  11.774  -3.850 -12.657
  116   HD13  LEU  14          HD13      LEU  14  12.071  -2.490 -13.763
  117   HD21  LEU  14          HD21      LEU  14  12.465  -0.106 -12.706
  118   HD22  LEU  14          HD22      LEU  14  12.662  -0.024 -10.938
  119   HD23  LEU  14          HD23      LEU  14  13.833  -0.906 -11.915
  120    H    ASN  15           H        ASN  15  11.176   1.498 -10.110
  121    HA   ASN  15           HA       ASN  15   9.302   3.339 -11.348
  122    HB2  ASN  15           HB2      ASN  15  10.797   4.058  -9.496
  123    HB3  ASN  15           HB3      ASN  15  12.196   3.877 -10.563
  124   HD21  ASN  15          HD22      ASN  15  10.282   6.327  -9.306
  125   HD22  ASN  15          HD21      ASN  15  10.263   7.367 -10.703
  126    H    GLU  16           H        GLU  16   9.066   3.627 -13.450
  127    HA   GLU  16           HA       GLU  16  10.391   2.168 -15.356
  128    HB2  GLU  16           HB2      GLU  16   9.084   3.317 -16.956
  129    HB3  GLU  16           HB3      GLU  16   8.109   3.166 -15.511
  130    HG2  GLU  16           HG2      GLU  16   8.553   5.545 -14.967
  131    HG3  GLU  16           HG3      GLU  16   9.604   5.689 -16.378
  132    H    LYS  17           H        LYS  17  11.622   5.147 -14.027
  133    HA   LYS  17           HA       LYS  17  13.025   6.045 -16.318
  134    HB2  LYS  17           HB2      LYS  17  14.146   7.542 -14.963
  135    HB3  LYS  17           HB3      LYS  17  12.549   7.357 -14.249
  136    HG2  LYS  17           HG2      LYS  17  13.631   5.729 -12.564
  137    HG3  LYS  17           HG3      LYS  17  15.196   6.205 -13.250
  138    HD2  LYS  17           HD2      LYS  17  14.699   8.575 -12.761
  139    HD3  LYS  17           HD3      LYS  17  13.147   8.099 -12.039
  140    HE2  LYS  17           HE2      LYS  17  14.332   6.756 -10.329
  141    HE3  LYS  17           HE3      LYS  17  15.888   7.150 -11.073
  142    HZ1  LYS  17           HZ1      LYS  17  15.503   9.475 -10.514
  143    HZ2  LYS  17           HZ2      LYS  17  14.061   9.129  -9.831
  144    HZ3  LYS  17           HZ3      LYS  17  15.440   8.565  -9.168
  145    H    ILE  18           H        ILE  18  13.804   3.526 -13.972
  146    HA   ILE  18           HA       ILE  18  16.615   3.495 -14.265
  147    HB   ILE  18           HB       ILE  18  14.724   1.204 -13.587
  148   HG12  ILE  18          HG12      ILE  18  14.327   3.060 -12.041
  149   HG13  ILE  18          HG13      ILE  18  15.104   1.719 -11.231
  150   HG21  ILE  18          HG21      ILE  18  17.702   1.529 -13.032
  151   HG22  ILE  18          HG22      ILE  18  16.672   0.258 -12.348
  152   HG23  ILE  18          HG23      ILE  18  16.932   0.331 -14.089
  153   HD11  ILE  18          HD11      ILE  18  16.500   4.283 -12.127
  154   HD12  ILE  18          HD12      ILE  18  15.989   3.882 -10.481
  155   HD13  ILE  18          HD13      ILE  18  17.268   2.935 -11.252
  156    H    LYS  19           H        LYS  19  17.919   2.885 -15.907
  157    HA   LYS  19           HA       LYS  19  16.754   1.877 -18.374
  158    HB2  LYS  19           HB2      LYS  19  18.718   3.537 -18.043
  159    HB3  LYS  19           HB3      LYS  19  19.721   2.114 -17.739
  160    HG2  LYS  19           HG2      LYS  19  19.193   1.251 -19.997
  161    HG3  LYS  19           HG3      LYS  19  18.050   2.585 -20.252
  162    HD2  LYS  19           HD2      LYS  19  19.942   4.206 -20.038
  163    HD3  LYS  19           HD3      LYS  19  21.068   2.837 -19.881
  164    HE2  LYS  19           HE2      LYS  19  20.338   1.995 -22.107
  165    HE3  LYS  19           HE3      LYS  19  19.199   3.339 -22.246
  166    HZ1  LYS  19           HZ1      LYS  19  21.092   4.860 -22.234
  167    HZ2  LYS  19           HZ2      LYS  19  22.148   3.618 -22.102
  168    HZ3  LYS  19           HZ3      LYS  19  21.245   3.784 -23.445
  169    H    LYS  20           H        LYS  20  17.552  -0.130 -19.464
  170    HA   LYS  20           HA       LYS  20  17.259  -2.456 -17.893
  171    HB2  LYS  20           HB2      LYS  20  16.990  -2.250 -20.404
  172    HB3  LYS  20           HB3      LYS  20  18.763  -2.190 -20.538
  173    HG2  LYS  20           HG2      LYS  20  18.900  -4.455 -19.494
  174    HG3  LYS  20           HG3      LYS  20  17.138  -4.486 -19.334
  175    HD2  LYS  20           HD2      LYS  20  16.924  -4.308 -21.814
  176    HD3  LYS  20           HD3      LYS  20  18.693  -4.265 -21.964
  177    HE2  LYS  20           HE2      LYS  20  18.850  -6.519 -20.955
  178    HE3  LYS  20           HE3      LYS  20  17.095  -6.551 -20.731
  179    HZ1  LYS  20           HZ1      LYS  20  18.450  -6.425 -23.365
  180    HZ2  LYS  20           HZ2      LYS  20  17.770  -7.757 -22.720
  181    HZ3  LYS  20           HZ3      LYS  20  16.832  -6.490 -23.127
  182    H    GLU  21           H        GLU  21  20.234  -0.834 -19.067
  183    HA   GLU  21           HA       GLU  21  22.099  -2.688 -18.034
  184    HB2  GLU  21           HB2      GLU  21  22.656  -1.048 -19.685
  185    HB3  GLU  21           HB3      GLU  21  22.210   0.294 -18.628
  186    HG2  GLU  21           HG2      GLU  21  24.072  -0.153 -17.130
  187    HG3  GLU  21           HG3      GLU  21  24.482  -1.638 -18.003
  188    H    GLU  22           H        GLU  22  20.632   0.236 -16.527
  189    HA   GLU  22           HA       GLU  22  22.144   0.098 -14.114
  190    HB2  GLU  22           HB2      GLU  22  19.412   1.303 -14.690
  191    HB3  GLU  22           HB3      GLU  22  20.338   1.571 -13.208
  192    HG2  GLU  22           HG2      GLU  22  22.162   2.599 -14.505
  193    HG3  GLU  22           HG3      GLU  22  21.284   2.334 -16.008
  194    H    LEU  23           H        LEU  23  18.947  -1.207 -15.052
  195    HA   LEU  23           HA       LEU  23  18.258  -2.426 -12.584
  196    HG   LEU  23           HG       LEU  23  15.470  -4.042 -14.689
  197    HB2  LEU  23           HB2      LEU  23  16.648  -2.078 -14.337
  198    HB3  LEU  23           HB3      LEU  23  17.561  -3.014 -15.496
  199   HD11  LEU  23          HD11      LEU  23  16.198  -6.279 -14.566
  200   HD12  LEU  23          HD12      LEU  23  17.327  -5.432 -15.636
  201   HD13  LEU  23          HD13      LEU  23  17.796  -5.837 -13.968
  202   HD21  LEU  23          HD21      LEU  23  15.649  -3.309 -12.312
  203   HD22  LEU  23          HD22      LEU  23  15.307  -5.042 -12.492
  204   HD23  LEU  23          HD23      LEU  23  16.942  -4.497 -12.067
  205    H    LYS  24           H        LYS  24  19.978  -3.877 -15.442
  206    HA   LYS  24           HA       LYS  24  20.415  -6.381 -14.200
  207    HB2  LYS  24           HB2      LYS  24  22.011  -4.900 -16.333
  208    HB3  LYS  24           HB3      LYS  24  22.414  -6.533 -15.782
  209    HG2  LYS  24           HG2      LYS  24  20.071  -7.258 -16.378
  210    HG3  LYS  24           HG3      LYS  24  19.820  -5.693 -17.144
  211    HD2  LYS  24           HD2      LYS  24  21.927  -7.772 -17.881
  212    HD3  LYS  24           HD3      LYS  24  20.442  -7.428 -18.777
  213    HE2  LYS  24           HE2      LYS  24  21.240  -5.134 -19.267
  214    HE3  LYS  24           HE3      LYS  24  22.711  -5.431 -18.332
  215    HZ1  LYS  24           HZ1      LYS  24  21.970  -6.902 -20.797
  216    HZ2  LYS  24           HZ2      LYS  24  23.099  -5.732 -20.694
  217    HZ3  LYS  24           HZ3      LYS  24  23.326  -7.145 -19.922
  218    H    LYS  25           H        LYS  25  22.593  -3.503 -14.259
  219    HA   LYS  25           HA       LYS  25  24.641  -4.699 -12.693
  220    HB2  LYS  25           HB2      LYS  25  23.769  -1.795 -13.030
  221    HB3  LYS  25           HB3      LYS  25  25.186  -2.254 -12.098
  222    HG2  LYS  25           HG2      LYS  25  24.800  -2.925 -15.048
  223    HG3  LYS  25           HG3      LYS  25  25.663  -1.513 -14.456
  224    HD2  LYS  25           HD2      LYS  25  26.451  -4.409 -13.917
  225    HD3  LYS  25           HD3      LYS  25  27.161  -3.346 -15.136
  226    HE2  LYS  25           HE2      LYS  25  27.877  -1.771 -13.333
  227    HE3  LYS  25           HE3      LYS  25  27.234  -2.884 -12.120
  228    HZ1  LYS  25           HZ1      LYS  25  29.603  -3.187 -12.426
  229    HZ2  LYS  25           HZ2      LYS  25  28.832  -4.543 -12.892
  230    HZ3  LYS  25           HZ3      LYS  25  29.427  -3.509 -14.011
  231    H    SER  26           H        SER  26  21.689  -2.913 -11.660
  232    HA   SER  26           HA       SER  26  22.346  -2.951  -8.902
  233    HG   SER  26           HG       SER  26  20.759  -1.229 -10.964
  234    HB2  SER  26           HB2      SER  26  19.602  -2.940 -10.195
  235    HB3  SER  26           HB3      SER  26  19.984  -2.464  -8.527
  236    H    LEU  27           H        LEU  27  20.503  -5.329 -10.873
  237    HA   LEU  27           HA       LEU  27  19.854  -6.920  -8.583
  238    HG   LEU  27           HG       LEU  27  18.478  -6.480 -11.819
  239    HB2  LEU  27           HB2      LEU  27  20.236  -7.981 -11.375
  240    HB3  LEU  27           HB3      LEU  27  19.356  -8.719 -10.039
  241   HD11  LEU  27          HD11      LEU  27  16.554  -7.896 -12.143
  242   HD12  LEU  27          HD12      LEU  27  18.011  -8.892 -12.326
  243   HD13  LEU  27          HD13      LEU  27  17.075  -8.975 -10.830
  244   HD21  LEU  27          HD21      LEU  27  16.486  -6.179 -10.384
  245   HD22  LEU  27          HD22      LEU  27  17.236  -7.193  -9.137
  246   HD23  LEU  27          HD23      LEU  27  17.960  -5.622  -9.578
  247    H    TYR  28           H        TYR  28  22.645  -7.103 -10.900
  248    HA   TYR  28           HA       TYR  28  23.873  -9.316  -9.559
  249    HD1  TYR  28           HD2      TYR  28  24.558 -10.871 -11.057
  250    HD2  TYR  28           HD1      TYR  28  24.570  -7.357 -13.567
  251    HE1  TYR  28           HE2      TYR  28  23.964 -12.267 -13.001
  252    HE2  TYR  28           HE1      TYR  28  23.979  -8.752 -15.524
  253    HH   TYR  28           HH       TYR  28  23.521 -12.310 -15.296
  254    HB2  TYR  28           HB2      TYR  28  25.056  -7.107 -11.272
  255    HB3  TYR  28           HB3      TYR  28  25.979  -8.472 -10.662
  256    H    ALA  29           H        ALA  29  23.892  -5.830  -8.829
  257    HA   ALA  29           HA       ALA  29  26.082  -5.962  -6.985
  258    HB1  ALA  29           HB1      ALA  29  25.333  -3.752  -6.249
  259    HB2  ALA  29           HB2      ALA  29  25.338  -3.850  -8.018
  260    HB3  ALA  29           HB3      ALA  29  23.803  -3.940  -7.120
  261    H    ILE  30           H        ILE  30  22.512  -6.241  -6.509
  262    HA   ILE  30           HA       ILE  30  23.086  -6.937  -3.654
  263    HB   ILE  30           HB       ILE  30  20.787  -5.911  -3.232
  264   HG12  ILE  30          HG12      ILE  30  21.487  -4.266  -5.687
  265   HG13  ILE  30          HG13      ILE  30  20.208  -5.494  -5.647
  266   HG21  ILE  30          HG21      ILE  30  22.993  -5.100  -2.391
  267   HG22  ILE  30          HG22      ILE  30  23.188  -4.127  -3.864
  268   HG23  ILE  30          HG23      ILE  30  21.887  -3.770  -2.707
  269   HD11  ILE  30          HD11      ILE  30  19.184  -3.352  -5.378
  270   HD12  ILE  30          HD12      ILE  30  19.130  -4.141  -3.789
  271   HD13  ILE  30          HD13      ILE  30  20.325  -2.869  -4.116
  272    H    PHE  31           H        PHE  31  20.770  -7.754  -6.317
  273    HA   PHE  31           HA       PHE  31  19.362  -9.655  -4.657
  274    HD1  PHE  31           HD2      PHE  31  18.565  -7.008  -6.429
  275    HD2  PHE  31           HD1      PHE  31  16.573 -10.818  -6.768
  276    HE1  PHE  31           HE2      PHE  31  16.390  -5.900  -6.128
  277    HE2  PHE  31           HE1      PHE  31  14.385  -9.691  -6.470
  278    HZ   PHE  31           HZ       PHE  31  14.280  -7.235  -6.171
  279    HB2  PHE  31           HB2      PHE  31  19.560  -9.256  -7.642
  280    HB3  PHE  31           HB3      PHE  31  18.882 -10.735  -7.001
  281    H    SER  32           H        SER  32  22.222  -9.967  -6.821
  282    HA   SER  32           HA       SER  32  22.503 -12.779  -6.484
  283    HG   SER  32           HG       SER  32  22.824 -11.076  -8.650
  284    HB2  SER  32           HB2      SER  32  24.562 -10.671  -7.162
  285    HB3  SER  32           HB3      SER  32  24.869 -12.416  -7.199
  286    H    GLN  33           H        GLN  33  22.985 -10.348  -4.080
  287    HA   GLN  33           HA       GLN  33  25.015 -11.803  -2.565
  288    HB2  GLN  33           HB2      GLN  33  23.061  -9.709  -1.548
  289    HB3  GLN  33           HB3      GLN  33  24.545 -10.234  -0.774
  290    HG2  GLN  33           HG2      GLN  33  24.357  -8.714  -3.403
  291    HG3  GLN  33           HG3      GLN  33  24.753  -8.011  -1.844
  292   HE21  GLN  33          HE22      GLN  33  26.372  -7.697  -4.088
  293   HE22  GLN  33          HE21      GLN  33  27.893  -8.547  -3.836
  294    H    PHE  34           H        PHE  34  21.583 -12.138  -3.071
  295    HA   PHE  34           HA       PHE  34  21.339 -13.866  -0.654
  296    HD1  PHE  34           HD2      PHE  34  21.022 -12.316   1.364
  297    HD2  PHE  34           HD1      PHE  34  19.506  -9.849  -1.840
  298    HE1  PHE  34           HE2      PHE  34  21.807 -10.282   2.549
  299    HE2  PHE  34           HE1      PHE  34  20.285  -7.826  -0.649
  300    HZ   PHE  34           HZ       PHE  34  21.440  -8.033   1.548
  301    HB2  PHE  34           HB2      PHE  34  19.166 -12.168  -1.934
  302    HB3  PHE  34           HB3      PHE  34  19.066 -13.031  -0.408
  303    H    GLY  35           H        GLY  35  20.752 -13.612  -4.108
  304    HA2  GLY  35           HA2      GLY  35  20.453 -16.521  -4.109
  305    HA3  GLY  35           HA3      GLY  35  19.108 -15.603  -4.830
  306    H    GLN  36           H        GLN  36  22.253 -16.825  -5.354
  307    HA   GLN  36           HA       GLN  36  23.278 -14.958  -7.168
  308    HB2  GLN  36           HB2      GLN  36  24.621 -16.783  -6.275
  309    HB3  GLN  36           HB3      GLN  36  23.669 -17.975  -7.172
  310    HG2  GLN  36           HG2      GLN  36  25.859 -17.434  -8.253
  311    HG3  GLN  36           HG3      GLN  36  24.469 -17.139  -9.286
  312   HE21  GLN  36          HE22      GLN  36  24.483 -15.195 -10.395
  313   HE22  GLN  36          HE21      GLN  36  25.293 -13.741  -9.839
  314    H    ILE  37           H        ILE  37  22.570 -14.202  -8.960
  315    HA   ILE  37           HA       ILE  37  20.317 -15.138 -10.434
  316    HB   ILE  37           HB       ILE  37  22.494 -13.056 -10.890
  317   HG12  ILE  37          HG12      ILE  37  19.585 -12.866  -9.974
  318   HG13  ILE  37          HG13      ILE  37  20.996 -12.712  -8.930
  319   HG21  ILE  37          HG21      ILE  37  19.961 -13.430 -12.539
  320   HG22  ILE  37          HG22      ILE  37  21.060 -12.035 -12.617
  321   HG23  ILE  37          HG23      ILE  37  21.639 -13.596 -13.115
  322   HD11  ILE  37          HD11      ILE  37  20.319 -10.550  -9.292
  323   HD12  ILE  37          HD12      ILE  37  21.706 -10.723 -10.385
  324   HD13  ILE  37          HD13      ILE  37  20.047 -10.774 -11.031
  325    H    LEU  38           H        LEU  38  20.257 -15.852 -12.575
  326    HA   LEU  38           HA       LEU  38  22.688 -17.080 -13.741
  327    HG   LEU  38           HG       LEU  38  20.877 -18.662 -15.891
  328    HB2  LEU  38           HB2      LEU  38  21.149 -18.789 -12.852
  329    HB3  LEU  38           HB3      LEU  38  19.807 -18.066 -13.739
  330   HD11  LEU  38          HD11      LEU  38  22.997 -20.002 -14.144
  331   HD12  LEU  38          HD12      LEU  38  22.815 -20.231 -15.897
  332   HD13  LEU  38          HD13      LEU  38  23.258 -18.646 -15.264
  333   HD21  LEU  38          HD21      LEU  38  20.615 -20.985 -13.935
  334   HD22  LEU  38          HD22      LEU  38  19.285 -20.194 -14.806
  335   HD23  LEU  38          HD23      LEU  38  20.516 -21.089 -15.708
  336    H    ASP  39           H        ASP  39  19.537 -15.308 -14.287
  337    HA   ASP  39           HA       ASP  39  20.765 -13.939 -16.525
  338    HB2  ASP  39           HB2      ASP  39  19.990 -16.028 -17.659
  339    HB3  ASP  39           HB3      ASP  39  18.354 -15.711 -17.096
  340    H    ILE  40           H        ILE  40  19.188 -12.197 -17.400
  341    HA   ILE  40           HA       ILE  40  17.137 -11.376 -15.427
  342    HB   ILE  40           HB       ILE  40  19.406  -9.573 -16.378
  343   HG12  ILE  40          HG12      ILE  40  19.034 -10.712 -13.581
  344   HG13  ILE  40          HG13      ILE  40  20.267 -11.229 -14.732
  345   HG21  ILE  40          HG21      ILE  40  18.412  -7.978 -14.663
  346   HG22  ILE  40          HG22      ILE  40  17.352  -8.316 -16.005
  347   HG23  ILE  40          HG23      ILE  40  17.077  -9.121 -14.448
  348   HD11  ILE  40          HD11      ILE  40  21.252  -8.957 -14.729
  349   HD12  ILE  40          HD12      ILE  40  20.109  -8.486 -13.458
  350   HD13  ILE  40          HD13      ILE  40  21.292  -9.751 -13.142
  351    H    VAL  41           H        VAL  41  15.471 -10.180 -16.414
  352    HA   VAL  41           HA       VAL  41  15.722  -9.411 -19.266
  353    HB   VAL  41           HB       VAL  41  13.454 -11.072 -18.080
  354   HG11  VAL  41          HG11      VAL  41  12.625 -11.189 -20.409
  355   HG12  VAL  41          HG12      VAL  41  12.675  -9.520 -19.844
  356   HG13  VAL  41          HG13      VAL  41  13.940 -10.118 -20.940
  357   HG21  VAL  41          HG21      VAL  41  15.615 -11.910 -20.052
  358   HG22  VAL  41          HG22      VAL  41  15.361 -12.550 -18.411
  359   HG23  VAL  41          HG23      VAL  41  14.160 -12.852 -19.661
  360    H    ALA  42           H        ALA  42  15.350  -7.264 -19.223
  361    HA   ALA  42           HA       ALA  42  12.837  -6.242 -18.171
  362    HB1  ALA  42           HB1      ALA  42  13.929  -4.247 -17.187
  363    HB2  ALA  42           HB2      ALA  42  14.413  -5.721 -16.328
  364    HB3  ALA  42           HB3      ALA  42  15.528  -4.959 -17.487
  365    H    LEU  43           H        LEU  43  12.323  -4.197 -19.437
  366    HA   LEU  43           HA       LEU  43  14.016  -3.559 -21.710
  367    HG   LEU  43           HG       LEU  43  11.804  -3.482 -24.003
  368    HB2  LEU  43           HB2      LEU  43  12.946  -5.759 -22.340
  369    HB3  LEU  43           HB3      LEU  43  11.366  -5.026 -22.118
  370   HD11  LEU  43          HD11      LEU  43  13.766  -3.898 -25.487
  371   HD12  LEU  43          HD12      LEU  43  14.257  -3.265 -23.916
  372   HD13  LEU  43          HD13      LEU  43  14.440  -4.997 -24.264
  373   HD21  LEU  43          HD21      LEU  43  11.672  -5.193 -25.761
  374   HD22  LEU  43          HD22      LEU  43  12.350  -6.416 -24.657
  375   HD23  LEU  43          HD23      LEU  43  10.754  -5.713 -24.340
  376    H    LYS  44           H        LYS  44  13.289  -1.586 -22.701
  377    HA   LYS  44           HA       LYS  44  11.663   0.020 -20.949
  378    HB2  LYS  44           HB2      LYS  44  13.213   0.508 -23.513
  379    HB3  LYS  44           HB3      LYS  44  12.159   1.763 -22.892
  380    HG2  LYS  44           HG2      LYS  44  14.343   0.510 -21.180
  381    HG3  LYS  44           HG3      LYS  44  14.601   1.913 -22.226
  382    HD2  LYS  44           HD2      LYS  44  12.790   3.143 -21.034
  383    HD3  LYS  44           HD3      LYS  44  12.615   1.774 -19.914
  384    HE2  LYS  44           HE2      LYS  44  14.870   2.039 -19.105
  385    HE3  LYS  44           HE3      LYS  44  15.229   3.274 -20.327
  386    HZ1  LYS  44           HZ1      LYS  44  14.727   4.256 -18.155
  387    HZ2  LYS  44           HZ2      LYS  44  13.608   4.717 -19.255
  388    HZ3  LYS  44           HZ3      LYS  44  13.238   3.575 -18.133
  389    H    THR  45           H        THR  45  10.610  -2.026 -23.450
  390    HA   THR  45           HA       THR  45   8.549  -0.448 -24.647
  391    HB   THR  45           HB       THR  45   7.559  -2.798 -25.005
  392    HG1  THR  45           HG1      THR  45   8.675  -3.691 -23.134
  393   HG21  THR  45          HG21      THR  45   9.301  -3.511 -26.584
  394   HG22  THR  45          HG22      THR  45   9.029  -1.764 -26.700
  395   HG23  THR  45          HG23      THR  45  10.463  -2.386 -25.853
  396    H    LEU  46           H        LEU  46   6.318  -0.249 -24.004
  397    HA   LEU  46           HA       LEU  46   5.806   0.299 -21.359
  398    HG   LEU  46           HG       LEU  46   2.318   1.106 -22.501
  399    HB2  LEU  46           HB2      LEU  46   4.484   1.055 -23.248
  400    HB3  LEU  46           HB3      LEU  46   3.882  -0.560 -23.558
  401   HD11  LEU  46          HD11      LEU  46   2.555  -1.406 -20.813
  402   HD12  LEU  46          HD12      LEU  46   1.123  -0.439 -21.164
  403   HD13  LEU  46          HD13      LEU  46   1.891  -1.359 -22.460
  404   HD21  LEU  46          HD21      LEU  46   3.833   0.578 -19.920
  405   HD22  LEU  46          HD22      LEU  46   3.907   2.085 -20.864
  406   HD23  LEU  46          HD23      LEU  46   2.378   1.562 -20.138
  407    H    LYS  47           H        LYS  47   5.195  -2.826 -22.984
  408    HA   LYS  47           HA       LYS  47   3.891  -4.170 -20.914
  409    HB2  LYS  47           HB2      LYS  47   4.696  -6.250 -22.027
  410    HB3  LYS  47           HB3      LYS  47   4.020  -5.082 -23.162
  411    HG2  LYS  47           HG2      LYS  47   6.257  -4.386 -23.875
  412    HG3  LYS  47           HG3      LYS  47   7.015  -5.415 -22.650
  413    HD2  LYS  47           HD2      LYS  47   6.118  -7.425 -23.756
  414    HD3  LYS  47           HD3      LYS  47   5.331  -6.396 -24.980
  415    HE2  LYS  47           HE2      LYS  47   7.488  -5.541 -25.733
  416    HE3  LYS  47           HE3      LYS  47   8.337  -6.407 -24.453
  417    HZ1  LYS  47           HZ1      LYS  47   6.777  -7.755 -26.595
  418    HZ2  LYS  47           HZ2      LYS  47   8.405  -7.542 -26.633
  419    HZ3  LYS  47           HZ3      LYS  47   7.732  -8.483 -25.483
  420    H    MET  48           H        MET  48   7.227  -3.193 -20.873
  421    HA   MET  48           HA       MET  48   7.799  -4.991 -18.580
  422    HB2  MET  48           HB2      MET  48   9.333  -4.644 -21.146
  423    HB3  MET  48           HB3      MET  48  10.177  -5.076 -19.664
  424    HG2  MET  48           HG2      MET  48   7.878  -6.625 -20.893
  425    HG3  MET  48           HG3      MET  48   9.583  -7.068 -20.960
  426    HE1  MET  48           HE1      MET  48  10.417  -6.351 -17.785
  427    HE2  MET  48           HE2      MET  48  10.280  -8.005 -17.168
  428    HE3  MET  48           HE3      MET  48  11.010  -7.714 -18.773
  429    H    ARG  49           H        ARG  49   7.740  -1.760 -19.687
  430    HA   ARG  49           HA       ARG  49  10.157  -0.819 -18.722
  431    HE   ARG  49           HE       ARG  49   8.941   2.264 -21.603
  432    HB2  ARG  49           HB2      ARG  49   8.234   0.320 -20.131
  433    HB3  ARG  49           HB3      ARG  49   7.665   0.892 -18.559
  434    HG2  ARG  49           HG2      ARG  49  10.058   1.809 -18.208
  435    HG3  ARG  49           HG3      ARG  49  10.370   1.402 -19.885
  436    HD2  ARG  49           HD2      ARG  49   8.096   3.194 -18.987
  437    HD3  ARG  49           HD3      ARG  49   9.696   3.803 -19.451
  438   HH11  ARG  49          HH11      ARG  49   7.508   5.041 -19.853
  439   HH12  ARG  49          HH12      ARG  49   6.691   5.656 -21.253
  440   HH21  ARG  49          HH21      ARG  49   7.860   3.101 -23.439
  441   HH22  ARG  49          HH22      ARG  49   6.893   4.525 -23.338
  442    H    GLY  50           H        GLY  50   7.382  -1.717 -16.759
  443    HA2  GLY  50           HA2      GLY  50   8.530  -0.311 -14.377
  444    HA3  GLY  50           HA3      GLY  50   6.812  -0.623 -14.649
  445    H    GLN  51           H        GLN  51   8.977  -3.193 -15.607
  446    HA   GLN  51           HA       GLN  51   8.788  -4.629 -13.073
  447    HB2  GLN  51           HB2      GLN  51   7.664  -6.587 -14.176
  448    HB3  GLN  51           HB3      GLN  51   6.640  -5.193 -13.902
  449    HG2  GLN  51           HG2      GLN  51   7.914  -5.582 -16.603
  450    HG3  GLN  51           HG3      GLN  51   6.533  -6.563 -16.151
  451   HE21  GLN  51          HE22      GLN  51   4.439  -5.483 -15.599
  452   HE22  GLN  51          HE21      GLN  51   4.131  -3.891 -16.254
  453    H    ALA  52           H        ALA  52   9.755  -6.947 -13.505
  454    HA   ALA  52           HA       ALA  52  11.640  -7.172 -15.678
  455    HB1  ALA  52           HB1      ALA  52  12.729  -6.828 -12.842
  456    HB2  ALA  52           HB2      ALA  52  13.657  -7.351 -14.260
  457    HB3  ALA  52           HB3      ALA  52  12.989  -5.712 -14.199
  458    H    PHE  53           H        PHE  53  12.589  -9.298 -15.633
  459    HA   PHE  53           HA       PHE  53  11.538 -11.190 -13.588
  460    HD1  PHE  53           HD2      PHE  53   9.321 -12.914 -14.135
  461    HD2  PHE  53           HD1      PHE  53  10.154 -10.417 -17.550
  462    HE1  PHE  53           HE2      PHE  53   6.877 -12.557 -14.489
  463    HE2  PHE  53           HE1      PHE  53   7.717 -10.060 -17.876
  464    HZ   PHE  53           HZ       PHE  53   6.082 -11.109 -16.324
  465    HB2  PHE  53           HB2      PHE  53  11.910 -11.758 -16.557
  466    HB3  PHE  53           HB3      PHE  53  11.546 -12.954 -15.327
  467    H    VAL  54           H        VAL  54  13.140 -12.736 -12.937
  468    HA   VAL  54           HA       VAL  54  15.790 -12.578 -14.160
  469    HB   VAL  54           HB       VAL  54  16.134 -10.760 -12.783
  470   HG11  VAL  54          HG11      VAL  54  14.838 -12.205 -10.454
  471   HG12  VAL  54          HG12      VAL  54  15.594 -10.617 -10.362
  472   HG13  VAL  54          HG13      VAL  54  14.129 -10.826 -11.326
  473   HG21  VAL  54          HG21      VAL  54  17.137 -13.109 -11.133
  474   HG22  VAL  54          HG22      VAL  54  17.928 -12.396 -12.543
  475   HG23  VAL  54          HG23      VAL  54  17.734 -11.441 -11.071
  476    H    ILE  55           H        ILE  55  16.830 -14.391 -13.992
  477    HA   ILE  55           HA       ILE  55  15.375 -16.757 -12.957
  478    HB   ILE  55           HB       ILE  55  17.443 -16.494 -15.183
  479   HG12  ILE  55          HG12      ILE  55  15.669 -17.143 -16.797
  480   HG13  ILE  55          HG13      ILE  55  14.439 -16.914 -15.581
  481   HG21  ILE  55          HG21      ILE  55  17.455 -18.692 -14.099
  482   HG22  ILE  55          HG22      ILE  55  15.702 -18.847 -14.348
  483   HG23  ILE  55          HG23      ILE  55  16.817 -18.826 -15.733
  484   HD11  ILE  55          HD11      ILE  55  14.724 -15.074 -17.300
  485   HD12  ILE  55          HD12      ILE  55  14.763 -14.505 -15.637
  486   HD13  ILE  55          HD13      ILE  55  16.280 -14.679 -16.551
  487    H    PHE  56           H        PHE  56  16.610 -18.121 -11.613
  488    HA   PHE  56           HA       PHE  56  19.330 -17.170 -10.809
  489    HD1  PHE  56           HD1      PHE  56  15.482 -16.571  -9.803
  490    HD2  PHE  56           HD2      PHE  56  19.268 -15.533  -8.043
  491    HE1  PHE  56           HE1      PHE  56  14.682 -14.270  -9.388
  492    HE2  PHE  56           HE2      PHE  56  18.441 -13.251  -7.576
  493    HZ   PHE  56           HZ       PHE  56  16.137 -12.609  -8.260
  494    HB2  PHE  56           HB2      PHE  56  17.180 -18.345  -9.022
  495    HB3  PHE  56           HB3      PHE  56  18.790 -17.825  -8.542
  496    H    LYS  57           H        LYS  57  20.444 -19.030  -9.517
  497    HA   LYS  57           HA       LYS  57  20.601 -21.236 -11.386
  498    HB2  LYS  57           HB2      LYS  57  21.961 -20.778  -8.691
  499    HB3  LYS  57           HB3      LYS  57  22.343 -22.093  -9.815
  500    HG2  LYS  57           HG2      LYS  57  22.751 -20.379 -11.622
  501    HG3  LYS  57           HG3      LYS  57  22.563 -19.102 -10.410
  502    HD2  LYS  57           HD2      LYS  57  24.514 -19.979  -9.169
  503    HD3  LYS  57           HD3      LYS  57  24.687 -21.285 -10.375
  504    HE2  LYS  57           HE2      LYS  57  24.862 -19.555 -12.176
  505    HE3  LYS  57           HE3      LYS  57  24.760 -18.287 -10.961
  506    HZ1  LYS  57           HZ1      LYS  57  26.932 -20.311 -11.189
  507    HZ2  LYS  57           HZ2      LYS  57  27.064 -18.738 -11.576
  508    HZ3  LYS  57           HZ3      LYS  57  26.867 -19.178 -10.017
  509    H    GLU  58           H        GLU  58  18.732 -20.807  -8.425
  510    HA   GLU  58           HA       GLU  58  17.722 -23.535  -8.663
  511    HB2  GLU  58           HB2      GLU  58  19.842 -23.754  -7.356
  512    HB3  GLU  58           HB3      GLU  58  19.263 -22.544  -6.217
  513    HG2  GLU  58           HG2      GLU  58  19.087 -24.800  -5.337
  514    HG3  GLU  58           HG3      GLU  58  17.507 -24.033  -5.445
  515    H    ILE  59           H        ILE  59  15.792 -23.826  -7.409
  516    HA   ILE  59           HA       ILE  59  14.162 -21.484  -7.372
  517    HB   ILE  59           HB       ILE  59  12.384 -22.901  -6.672
  518   HG12  ILE  59          HG12      ILE  59  14.465 -24.993  -5.893
  519   HG13  ILE  59          HG13      ILE  59  13.380 -24.122  -4.809
  520   HG21  ILE  59          HG21      ILE  59  14.096 -24.675  -8.445
  521   HG22  ILE  59          HG22      ILE  59  12.332 -24.458  -8.452
  522   HG23  ILE  59          HG23      ILE  59  13.384 -23.155  -9.006
  523   HD11  ILE  59          HD11      ILE  59  11.423 -25.217  -5.943
  524   HD12  ILE  59          HD12      ILE  59  12.579 -26.218  -6.856
  525   HD13  ILE  59          HD13      ILE  59  12.514 -26.329  -5.092
  526    H    GLY  60           H        GLY  60  15.964 -23.107  -4.761
  527    HA2  GLY  60           HA2      GLY  60  14.667 -21.703  -2.600
  528    HA3  GLY  60           HA3      GLY  60  16.238 -22.528  -2.551
  529    H    SER  61           H        SER  61  17.423 -21.006  -4.753
  530    HA   SER  61           HA       SER  61  18.412 -18.722  -3.267
  531    HG   SER  61           HG       SER  61  20.400 -20.155  -4.003
  532    HB2  SER  61           HB2      SER  61  18.764 -19.424  -6.219
  533    HB3  SER  61           HB3      SER  61  19.785 -18.351  -5.257
  534    H    ALA  62           H        ALA  62  16.287 -19.216  -6.129
  535    HA   ALA  62           HA       ALA  62  15.593 -16.526  -6.617
  536    HB1  ALA  62           HB1      ALA  62  15.009 -18.450  -8.091
  537    HB2  ALA  62           HB2      ALA  62  13.902 -19.055  -6.842
  538    HB3  ALA  62           HB3      ALA  62  13.563 -17.523  -7.648
  539    H    SER  63           H        SER  63  14.037 -18.931  -4.410
  540    HA   SER  63           HA       SER  63  12.011 -17.226  -3.445
  541    HG   SER  63           HG       SER  63  12.654 -20.251  -3.897
  542    HB2  SER  63           HB2      SER  63  13.414 -19.471  -1.932
  543    HB3  SER  63           HB3      SER  63  11.810 -18.802  -1.592
  544    H    ASN  64           H        ASN  64  15.327 -17.753  -2.205
  545    HA   ASN  64           HA       ASN  64  14.913 -16.101   0.097
  546    HB2  ASN  64           HB2      ASN  64  16.693 -17.865  -0.106
  547    HB3  ASN  64           HB3      ASN  64  17.569 -16.796  -1.207
  548   HD21  ASN  64          HD22      ASN  64  19.187 -15.691  -0.115
  549   HD22  ASN  64          HD21      ASN  64  19.084 -15.139   1.551
  550    H    ALA  65           H        ALA  65  16.283 -15.415  -3.137
  551    HA   ALA  65           HA       ALA  65  16.943 -12.683  -2.733
  552    HB1  ALA  65           HB1      ALA  65  16.692 -12.499  -5.180
  553    HB2  ALA  65           HB2      ALA  65  17.582 -13.971  -4.771
  554    HB3  ALA  65           HB3      ALA  65  15.875 -14.068  -5.255
  555    H    LEU  66           H        LEU  66  13.911 -14.216  -3.914
  556    HA   LEU  66           HA       LEU  66  12.349 -11.945  -4.253
  557    HG   LEU  66           HG       LEU  66  10.116 -12.761  -5.242
  558    HB2  LEU  66           HB2      LEU  66  11.905 -14.375  -4.849
  559    HB3  LEU  66           HB3      LEU  66  11.365 -14.640  -3.206
  560   HD11  LEU  66          HD11      LEU  66   9.279 -15.502  -4.212
  561   HD12  LEU  66          HD12      LEU  66   8.296 -14.468  -5.269
  562   HD13  LEU  66          HD13      LEU  66   9.837 -15.104  -5.847
  563   HD21  LEU  66          HD21      LEU  66   8.160 -12.734  -3.652
  564   HD22  LEU  66          HD22      LEU  66   9.213 -13.509  -2.439
  565   HD23  LEU  66          HD23      LEU  66   9.567 -11.877  -3.054
  566    H    ARG  67           H        ARG  67  12.451 -14.015  -1.265
  567    HA   ARG  67           HA       ARG  67  10.698 -12.235   0.126
  568    HE   ARG  67           HE       ARG  67   8.942 -15.507   3.171
  569    HB2  ARG  67           HB2      ARG  67  12.596 -14.406   1.118
  570    HB3  ARG  67           HB3      ARG  67  11.512 -13.498   2.187
  571    HG2  ARG  67           HG2      ARG  67   9.547 -14.228   0.887
  572    HG3  ARG  67           HG3      ARG  67  10.595 -15.133  -0.216
  573    HD2  ARG  67           HD2      ARG  67   9.747 -16.744   1.293
  574    HD3  ARG  67           HD3      ARG  67  11.412 -16.485   1.775
  575   HH11  ARG  67          HH21      ARG  67  12.460 -16.037   3.378
  576   HH12  ARG  67          HH22      ARG  67  12.513 -15.723   5.072
  577   HH21  ARG  67          HH11      ARG  67   9.002 -15.151   5.309
  578   HH22  ARG  67          HH12      ARG  67  10.481 -15.193   6.223
  579    H    THR  68           H        THR  68  14.314 -12.378   0.061
  580    HA   THR  68           HA       THR  68  14.605 -10.494   2.195
  581    HB   THR  68           HB       THR  68  16.538 -11.045  -0.099
  582    HG1  THR  68           HG1      THR  68  16.156 -12.950   0.822
  583   HG21  THR  68          HG21      THR  68  18.253 -10.490   1.662
  584   HG22  THR  68          HG22      THR  68  17.256  -9.109   1.197
  585   HG23  THR  68          HG23      THR  68  16.938  -9.956   2.729
  586    H    MET  69           H        MET  69  14.195 -10.098  -1.348
  587    HA   MET  69           HA       MET  69  14.633  -7.204  -1.116
  588    HB2  MET  69           HB2      MET  69  14.118  -8.997  -3.515
  589    HB3  MET  69           HB3      MET  69  14.525  -7.285  -3.579
  590    HG2  MET  69           HG2      MET  69  16.276  -9.546  -2.514
  591    HG3  MET  69           HG3      MET  69  16.522  -8.645  -3.987
  592    HE1  MET  69           HE1      MET  69  16.013  -5.671  -3.244
  593    HE2  MET  69           HE2      MET  69  17.544  -5.085  -2.570
  594    HE3  MET  69           HE3      MET  69  17.545  -6.070  -4.045
  595    H    GLN  70           H        GLN  70  11.904  -9.236  -0.840
  596    HA   GLN  70           HA       GLN  70   9.890  -7.729  -2.040
  597    HB2  GLN  70           HB2      GLN  70   9.691 -10.009  -0.973
  598    HB3  GLN  70           HB3      GLN  70   9.845  -9.257   0.609
  599    HG2  GLN  70           HG2      GLN  70   7.580  -9.806   0.255
  600    HG3  GLN  70           HG3      GLN  70   7.681  -8.042   0.178
  601   HE21  GLN  70          HE22      GLN  70   6.284 -10.715  -1.330
  602   HE22  GLN  70          HE21      GLN  70   6.194 -10.137  -2.978
  603    H    GLY  71           H        GLY  71   9.196  -5.668  -1.737
  604    HA2  GLY  71           HA2      GLY  71   8.632  -3.725  -0.708
  605    HA3  GLY  71           HA3      GLY  71   8.994  -4.444   0.864
  606    H    PHE  72           H        PHE  72  11.765  -4.799  -1.133
  607    HA   PHE  72           HA       PHE  72  13.292  -2.999   0.481
  608    HD1  PHE  72           HD1      PHE  72  15.996  -4.011   0.878
  609    HD2  PHE  72           HD2      PHE  72  15.400  -2.714  -3.192
  610    HE1  PHE  72           HE1      PHE  72  18.254  -2.979   0.874
  611    HE2  PHE  72           HE2      PHE  72  17.663  -1.680  -3.189
  612    HZ   PHE  72           HZ       PHE  72  19.091  -1.815  -1.160
  613    HB2  PHE  72           HB2      PHE  72  14.221  -5.000  -0.603
  614    HB3  PHE  72           HB3      PHE  72  13.908  -4.307  -2.197
  615    HA   PRO  73           HA       PRO  73  12.447   0.669  -2.112
  616    HB2  PRO  73           HB2      PRO  73  14.105   2.488  -0.958
  617    HB3  PRO  73           HB3      PRO  73  12.579   1.934  -0.205
  618    HG2  PRO  73           HG2      PRO  73  15.398   0.990   0.393
  619    HG3  PRO  73           HG3      PRO  73  14.098   1.409   1.548
  620    HD2  PRO  73           HD2      PRO  73  14.672  -1.176   0.766
  621    HD3  PRO  73           HD3      PRO  73  13.026  -0.648   1.229
  622    H    PHE  74           H        PHE  74  13.222   0.011  -4.116
  623    HA   PHE  74           HA       PHE  74  15.857  -0.898  -4.582
  624    HD1  PHE  74           HD1      PHE  74  16.439  -2.519  -5.987
  625    HD2  PHE  74           HD2      PHE  74  14.484   0.019  -8.886
  626    HE1  PHE  74           HE1      PHE  74  17.746  -3.576  -7.798
  627    HE2  PHE  74           HE2      PHE  74  15.802  -1.051 -10.688
  628    HZ   PHE  74           HZ       PHE  74  17.406  -2.864 -10.162
  629    HB2  PHE  74           HB2      PHE  74  13.787  -1.351  -5.940
  630    HB3  PHE  74           HB3      PHE  74  13.905   0.248  -6.621
  631    H    TYR  75           H        TYR  75  14.346   2.186  -5.489
  632    HA   TYR  75           HA       TYR  75  16.690   3.684  -4.768
  633    HD1  TYR  75           HD1      TYR  75  19.095   4.306  -6.120
  634    HD2  TYR  75           HD2      TYR  75  16.672   1.737  -8.603
  635    HE1  TYR  75           HE1      TYR  75  21.110   2.999  -6.730
  636    HE2  TYR  75           HE2      TYR  75  18.672   0.420  -9.209
  637    HH   TYR  75           HH       TYR  75  20.954   0.154  -8.930
  638    HB2  TYR  75           HB2      TYR  75  15.740   3.751  -7.680
  639    HB3  TYR  75           HB3      TYR  75  16.776   4.963  -6.952
  640    H    ASP  76           H        ASP  76  13.839   4.149  -6.862
  641    HA   ASP  76           HA       ASP  76  13.009   6.390  -5.159
  642    HB2  ASP  76           HB2      ASP  76  13.292   6.792  -7.540
  643    HB3  ASP  76           HB3      ASP  76  12.150   5.501  -7.921
  644    H    LYS  77           H        LYS  77  12.050   3.076  -5.842
  645    HA   LYS  77           HA       LYS  77   9.531   3.540  -4.389
  646    HB2  LYS  77           HB2      LYS  77   9.880   2.013  -7.017
  647    HB3  LYS  77           HB3      LYS  77   8.443   1.900  -6.007
  648    HG2  LYS  77           HG2      LYS  77   8.115   4.380  -6.249
  649    HG3  LYS  77           HG3      LYS  77   9.459   4.394  -7.411
  650    HD2  LYS  77           HD2      LYS  77   8.241   2.826  -8.877
  651    HD3  LYS  77           HD3      LYS  77   6.924   2.730  -7.689
  652    HE2  LYS  77           HE2      LYS  77   6.599   5.218  -7.918
  653    HE3  LYS  77           HE3      LYS  77   7.794   5.225  -9.218
  654    HZ1  LYS  77           HZ1      LYS  77   5.537   5.101 -10.073
  655    HZ2  LYS  77           HZ2      LYS  77   6.315   3.724 -10.464
  656    HZ3  LYS  77           HZ3      LYS  77   5.225   3.737  -9.245
  657    HA   PRO  78           HA       PRO  78  10.576  -0.362  -2.422
  658    HB2  PRO  78           HB2      PRO  78   8.144  -1.187  -1.506
  659    HB3  PRO  78           HB3      PRO  78   9.056   0.166  -0.768
  660    HG2  PRO  78           HG2      PRO  78   6.782   0.319  -2.765
  661    HG3  PRO  78           HG3      PRO  78   7.014   1.276  -1.270
  662    HD2  PRO  78           HD2      PRO  78   7.704   2.212  -3.753
  663    HD3  PRO  78           HD3      PRO  78   8.622   2.651  -2.285
  664    H    MET  79           H        MET  79  10.935  -2.263  -3.430
  665    HA   MET  79           HA       MET  79   9.722  -2.986  -5.931
  666    HB2  MET  79           HB2      MET  79  11.350  -4.652  -3.945
  667    HB3  MET  79           HB3      MET  79  11.003  -5.094  -5.628
  668    HG2  MET  79           HG2      MET  79  12.177  -3.045  -6.393
  669    HG3  MET  79           HG3      MET  79  12.528  -2.626  -4.730
  670    HE1  MET  79           HE1      MET  79  13.896  -3.677  -7.768
  671    HE2  MET  79           HE2      MET  79  15.038  -5.003  -7.508
  672    HE3  MET  79           HE3      MET  79  13.296  -5.344  -7.546
  673    H    GLN  80           H        GLN  80   8.227  -4.621  -6.378
  674    HA   GLN  80           HA       GLN  80   6.906  -6.001  -4.083
  675    HB2  GLN  80           HB2      GLN  80   5.584  -4.815  -6.576
  676    HB3  GLN  80           HB3      GLN  80   4.803  -5.920  -5.433
  677    HG2  GLN  80           HG2      GLN  80   5.104  -4.263  -3.606
  678    HG3  GLN  80           HG3      GLN  80   5.925  -3.172  -4.721
  679   HE21  GLN  80          HE22      GLN  80   4.407  -1.457  -4.500
  680   HE22  GLN  80          HE21      GLN  80   2.781  -1.577  -5.121
  681    H    ILE  81           H        ILE  81   7.081  -8.215  -4.415
  682    HA   ILE  81           HA       ILE  81   7.923  -9.097  -7.118
  683    HB   ILE  81           HB       ILE  81   9.307 -10.108  -4.629
  684   HG12  ILE  81          HG12      ILE  81  10.132  -7.612  -6.175
  685   HG13  ILE  81          HG13      ILE  81   9.695  -7.719  -4.461
  686   HG21  ILE  81          HG21      ILE  81  11.061 -10.716  -6.215
  687   HG22  ILE  81          HG22      ILE  81   9.537 -11.300  -6.858
  688   HG23  ILE  81          HG23      ILE  81  10.249  -9.828  -7.519
  689   HD11  ILE  81          HD11      ILE  81  12.198  -8.842  -5.745
  690   HD12  ILE  81          HD12      ILE  81  12.054  -7.504  -4.606
  691   HD13  ILE  81          HD13      ILE  81  11.688  -9.159  -4.067
  692    H    ALA  82           H        ALA  82   7.505 -11.238  -7.624
  693    HA   ALA  82           HA       ALA  82   6.312 -13.094  -5.732
  694    HB1  ALA  82           HB1      ALA  82   4.293 -11.839  -6.455
  695    HB2  ALA  82           HB2      ALA  82   4.694 -12.173  -8.152
  696    HB3  ALA  82           HB3      ALA  82   4.267 -13.502  -7.059
  697    H    TYR  83           H        TYR  83   5.676 -15.162  -7.343
  698    HA   TYR  83           HA       TYR  83   8.145 -15.806  -8.776
  699    HD1  TYR  83           HD1      TYR  83   5.499 -17.157  -5.978
  700    HD2  TYR  83           HD2      TYR  83   4.535 -17.862 -10.124
  701    HE1  TYR  83           HE1      TYR  83   3.104 -17.430  -5.373
  702    HE2  TYR  83           HE2      TYR  83   2.158 -18.172  -9.529
  703    HH   TYR  83           HH       TYR  83   0.577 -18.184  -7.812
  704    HB2  TYR  83           HB2      TYR  83   6.888 -17.938  -9.297
  705    HB3  TYR  83           HB3      TYR  83   7.250 -17.616  -7.616
  706    H    SER  84           H        SER  84   8.144 -16.454 -11.039
  707    HA   SER  84           HA       SER  84   7.155 -14.506 -12.743
  708    HG   SER  84           HG       SER  84   9.650 -14.980 -13.024
  709    HB2  SER  84           HB2      SER  84   8.090 -17.298 -13.499
  710    HB3  SER  84           HB3      SER  84   8.209 -15.826 -14.486
  711    H    LYS  85           H        LYS  85   5.837 -14.705 -14.652
  712    HA   LYS  85           HA       LYS  85   3.876 -14.914 -15.686
  713    HB2  LYS  85           HB2      LYS  85   3.868 -17.778 -14.677
  714    HB3  LYS  85           HB3      LYS  85   2.950 -17.140 -16.038
  715    HG2  LYS  85           HG2      LYS  85   5.010 -16.632 -17.269
  716    HG3  LYS  85           HG3      LYS  85   6.001 -17.231 -15.934
  717    HD2  LYS  85           HD2      LYS  85   4.003 -18.919 -17.494
  718    HD3  LYS  85           HD3      LYS  85   5.746 -18.857 -17.796
  719    HE2  LYS  85           HE2      LYS  85   6.181 -19.652 -15.470
  720    HE3  LYS  85           HE3      LYS  85   4.442 -19.761 -15.185
  721    HZ1  LYS  85           HZ1      LYS  85   5.932 -21.329 -17.209
  722    HZ2  LYS  85           HZ2      LYS  85   5.366 -21.899 -15.793
  723    HZ3  LYS  85           HZ3      LYS  85   4.321 -21.426 -16.948
  724    H    SER  86           H        SER  86   3.846 -14.313 -12.570
  725    HA   SER  86           HA       SER  86   1.200 -15.111 -11.774
  726    HG   SER  86           HG       SER  86   3.946 -14.646 -10.156
  727    HB2  SER  86           HB2      SER  86   2.982 -12.825 -10.826
  728    HB3  SER  86           HB3      SER  86   1.466 -13.325 -10.061
  729    H    ASP  87           H        ASP  87   2.489 -12.188 -13.471
  730    HA   ASP  87           HA       ASP  87  -0.080 -11.319 -14.451
  731    HB2  ASP  87           HB2      ASP  87  -0.368 -10.731 -12.104
  732    HB3  ASP  87           HB3      ASP  87   1.173  -9.907 -12.068
  733    H    SER  88           H        SER  88   0.433  -8.840 -15.180
  734    HA   SER  88           HA       SER  88   1.316  -7.590 -16.762
  735    HG   SER  88           HG       SER  88   2.363  -6.400 -15.090
  736    HB2  SER  88           HB2      SER  88   4.051  -8.553 -15.869
  737    HB3  SER  88           HB3      SER  88   3.714  -7.204 -16.953
  738    H    ASP  89           H        ASP  89   3.459 -10.509 -16.970
  739    HA   ASP  89           HA       ASP  89   3.656 -10.255 -19.818
  740    HB2  ASP  89           HB2      ASP  89   5.371 -11.385 -18.537
  741    HB3  ASP  89           HB3      ASP  89   4.220 -12.600 -17.966
  742    H    ILE  90           H        ILE  90   1.668 -12.413 -17.777
  743    HA   ILE  90           HA       ILE  90   0.483 -13.757 -20.003
  744    HB   ILE  90           HB       ILE  90  -1.132 -14.672 -18.480
  745   HG12  ILE  90          HG12      ILE  90  -0.096 -12.760 -16.340
  746   HG13  ILE  90          HG13      ILE  90  -1.690 -12.702 -17.111
  747   HG21  ILE  90          HG21      ILE  90   1.585 -14.567 -17.099
  748   HG22  ILE  90          HG22      ILE  90   0.402 -15.888 -17.070
  749   HG23  ILE  90          HG23      ILE  90   1.240 -15.501 -18.572
  750   HD11  ILE  90          HD11      ILE  90  -1.954 -13.704 -14.966
  751   HD12  ILE  90          HD12      ILE  90  -2.217 -14.951 -16.200
  752   HD13  ILE  90          HD13      ILE  90  -0.691 -14.902 -15.284
  753    H    VAL  91           H        VAL  91  -0.522 -10.812 -18.199
  754    HA   VAL  91           HA       VAL  91  -3.034 -10.590 -19.544
  755    HB   VAL  91           HB       VAL  91  -1.351  -8.433 -18.199
  756   HG11  VAL  91          HG11      VAL  91  -4.327  -8.490 -18.890
  757   HG12  VAL  91          HG12      VAL  91  -3.510  -7.237 -17.929
  758   HG13  VAL  91          HG13      VAL  91  -3.103  -7.439 -19.635
  759   HG21  VAL  91          HG21      VAL  91  -3.566 -10.246 -17.125
  760   HG22  VAL  91          HG22      VAL  91  -1.863 -10.229 -16.609
  761   HG23  VAL  91          HG23      VAL  91  -2.896  -8.845 -16.265
  762    H    ALA  92           H        ALA  92   0.219  -9.165 -20.168
  763    HA   ALA  92           HA       ALA  92  -0.489  -7.678 -22.463
  764    HB1  ALA  92           HB1      ALA  92   1.943  -7.703 -22.923
  765    HB2  ALA  92           HB2      ALA  92   1.635  -7.416 -21.205
  766    HB3  ALA  92           HB3      ALA  92   2.167  -9.020 -21.757
  767    H    LYS  93           H        LYS  93   0.487 -11.133 -22.123
  768    HA   LYS  93           HA       LYS  93   0.603 -11.658 -24.920
  769    HB2  LYS  93           HB2      LYS  93   1.593 -13.084 -23.143
  770    HB3  LYS  93           HB3      LYS  93  -0.028 -13.573 -22.629
  771    HG2  LYS  93           HG2      LYS  93  -0.433 -14.586 -24.858
  772    HG3  LYS  93           HG3      LYS  93   1.170 -14.044 -25.397
  773    HD2  LYS  93           HD2      LYS  93   2.231 -15.445 -23.644
  774    HD3  LYS  93           HD3      LYS  93   0.624 -15.983 -23.102
  775    HE2  LYS  93           HE2      LYS  93   0.190 -16.938 -25.358
  776    HE3  LYS  93           HE3      LYS  93   1.786 -16.404 -25.896
  777    HZ1  LYS  93           HZ1      LYS  93   2.766 -17.889 -24.244
  778    HZ2  LYS  93           HZ2      LYS  93   1.288 -18.385 -23.747
  779    HZ3  LYS  93           HZ3      LYS  93   1.802 -18.726 -25.253
  780    H    ILE  94           H        ILE  94  -2.136 -12.243 -22.574
  781    HA   ILE  94           HA       ILE  94  -3.772 -13.199 -24.722
  782    HB   ILE  94           HB       ILE  94  -5.607 -13.266 -23.178
  783   HG12  ILE  94          HG12      ILE  94  -3.870 -11.686 -21.255
  784   HG13  ILE  94          HG13      ILE  94  -5.380 -11.161 -21.992
  785   HG21  ILE  94          HG21      ILE  94  -4.694 -14.890 -21.653
  786   HG22  ILE  94          HG22      ILE  94  -3.791 -14.998 -23.162
  787   HG23  ILE  94          HG23      ILE  94  -3.073 -14.183 -21.757
  788   HD11  ILE  94          HD11      ILE  94  -5.051 -13.356 -19.915
  789   HD12  ILE  94          HD12      ILE  94  -5.823 -11.775 -19.718
  790   HD13  ILE  94          HD13      ILE  94  -6.575 -12.995 -20.768
  791    H    LYS  95           H        LYS  95  -3.404  -9.950 -23.323
  792    HA   LYS  95           HA       LYS  95  -5.644  -8.828 -24.765
  793    HB2  LYS  95           HB2      LYS  95  -4.732  -7.776 -22.749
  794    HB3  LYS  95           HB3      LYS  95  -3.168  -7.527 -23.544
  795    HG2  LYS  95           HG2      LYS  95  -4.195  -6.021 -25.176
  796    HG3  LYS  95           HG3      LYS  95  -5.802  -6.289 -24.475
  797    HD2  LYS  95           HD2      LYS  95  -5.192  -5.204 -22.420
  798    HD3  LYS  95           HD3      LYS  95  -3.483  -5.189 -22.832
  799    HE2  LYS  95           HE2      LYS  95  -5.686  -3.575 -24.197
  800    HE3  LYS  95           HE3      LYS  95  -4.461  -2.961 -23.084
  801    HZ1  LYS  95           HZ1      LYS  95  -2.779  -3.733 -24.774
  802    HZ2  LYS  95           HZ2      LYS  95  -4.014  -3.975 -25.819
  803    HZ3  LYS  95           HZ3      LYS  95  -3.716  -2.471 -25.254
  804    H    GLY  96           H        GLY  96  -2.096  -8.963 -25.410
  805    HA2  GLY  96           HA2      GLY  96  -1.607  -9.360 -27.863
  806    HA3  GLY  96           HA3      GLY  96  -2.567  -7.901 -28.161
  807    H    THR  97           H        THR  97  -1.460  -6.693 -25.521
  808    HA   THR  97           HA       THR  97   0.423  -5.026 -26.555
  809    HB   THR  97           HB       THR  97   0.370  -5.863 -23.647
  810    HG1  THR  97           HG1      THR  97  -1.466  -4.805 -23.365
  811   HG21  THR  97          HG21      THR  97   0.468  -3.340 -23.325
  812   HG22  THR  97          HG22      THR  97   1.920  -4.063 -24.031
  813   HG23  THR  97          HG23      THR  97   0.773  -3.210 -25.076
  814    H    PHE  98           H        PHE  98   1.064  -8.318 -25.497
  815    HA   PHE  98           HA       PHE  98   3.837  -8.158 -24.951
  816    HD1  PHE  98           HD2      PHE  98   4.917 -10.238 -23.644
  817    HD2  PHE  98           HD1      PHE  98   3.707 -11.705 -27.522
  818    HE1  PHE  98           HE2      PHE  98   6.976 -11.616 -23.773
  819    HE2  PHE  98           HE1      PHE  98   5.766 -13.078 -27.642
  820    HZ   PHE  98           HZ       PHE  98   7.408 -13.035 -25.771
  821    HB2  PHE  98           HB2      PHE  98   2.488 -10.133 -24.514
  822    HB3  PHE  98           HB3      PHE  98   2.196 -10.364 -26.237
  823    H    LYS  99           H        LYS  99   2.078  -8.050 -28.026
  824    HA   LYS  99           HA       LYS  99   4.602  -7.682 -29.526
  825    HB2  LYS  99           HB2      LYS  99   3.861  -9.448 -31.173
  826    HB3  LYS  99           HB3      LYS  99   4.427  -9.998 -29.616
  827    HG2  LYS  99           HG2      LYS  99   2.601 -11.361 -30.266
  828    HG3  LYS  99           HG3      LYS  99   2.100 -10.422 -28.867
  829    HD2  LYS  99           HD2      LYS  99   0.781  -8.923 -30.315
  830    HD3  LYS  99           HD3      LYS  99   1.372  -9.788 -31.759
  831    HE2  LYS  99           HE2      LYS  99   0.376 -11.908 -30.727
  832    HE3  LYS  99           HE3      LYS  99  -0.369 -10.876 -29.500
  833    HZ1  LYS  99           HZ1      LYS  99  -0.882 -10.784 -32.415
  834    HZ2  LYS  99           HZ2      LYS  99  -1.918 -11.288 -31.266
  835    HZ3  LYS  99           HZ3      LYS  99  -1.512  -9.701 -31.360
  836    H    GLU 100           H        GLU 100   1.841  -6.215 -28.865
  837    HA   GLU 100           HA       GLU 100   1.703  -4.903 -31.511
  838    HB2  GLU 100           HB2      GLU 100  -0.631  -6.056 -29.927
  839    HB3  GLU 100           HB3      GLU 100  -0.843  -4.688 -31.014
  840    HG2  GLU 100           HG2      GLU 100  -0.063  -5.966 -32.926
  841    HG3  GLU 100           HG3      GLU 100   0.295  -7.358 -31.909
  842    H    ARG 101           H        ARG 101   0.592  -2.744 -31.246
  843    HA   ARG 101           HA       ARG 101   1.877  -1.231 -29.248
  844    HE   ARG 101           HE       ARG 101   1.713   3.365 -29.613
  845    HB2  ARG 101           HB2      ARG 101   0.930  -0.530 -31.571
  846    HB3  ARG 101           HB3      ARG 101  -0.638  -0.412 -30.778
  847    HG2  ARG 101           HG2      ARG 101   0.280   1.774 -30.914
  848    HG3  ARG 101           HG3      ARG 101   0.359   1.303 -29.215
  849    HD2  ARG 101           HD2      ARG 101   2.783   0.747 -29.513
  850    HD3  ARG 101           HD3      ARG 101   2.662   1.239 -31.215
  851   HH11  ARG 101          HH11      ARG 101   4.791   1.728 -30.298
  852   HH12  ARG 101          HH12      ARG 101   5.764   3.108 -29.955
  853   HH21  ARG 101          HH21      ARG 101   3.010   5.205 -29.154
  854   HH22  ARG 101          HH22      ARG 101   4.724   5.129 -29.295
  855    HA   PRO 102           HA       PRO 102  -0.799  -1.800 -25.692
  856    HB2  PRO 102           HB2      PRO 102  -0.342   1.157 -25.254
  857    HB3  PRO 102           HB3      PRO 102  -0.291  -0.177 -24.059
  858    HG2  PRO 102           HG2      PRO 102   2.010   0.826 -25.079
  859    HG3  PRO 102           HG3      PRO 102   1.808  -0.947 -24.899
  860    HD2  PRO 102           HD2      PRO 102   1.554   0.729 -27.385
  861    HD3  PRO 102           HD3      PRO 102   2.306  -0.881 -27.169
  862    H    LYS 103           H        LYS 103  -1.397   1.098 -27.692
  863    HA   LYS 103           HA       LYS 103  -4.103   0.239 -28.172
  864    HB2  LYS 103           HB2      LYS 103  -5.190   2.363 -27.525
  865    HB3  LYS 103           HB3      LYS 103  -4.571   1.481 -26.134
  866    HG2  LYS 103           HG2      LYS 103  -2.598   3.008 -26.040
  867    HG3  LYS 103           HG3      LYS 103  -3.240   3.906 -27.429
  868    HD2  LYS 103           HD2      LYS 103  -5.275   4.465 -26.131
  869    HD3  LYS 103           HD3      LYS 103  -4.634   3.561 -24.739
  870    HE2  LYS 103           HE2      LYS 103  -2.664   5.075 -24.668
  871    HE3  LYS 103           HE3      LYS 103  -3.299   5.975 -26.052
  872    HZ1  LYS 103           HZ1      LYS 103  -5.210   6.593 -24.687
  873    HZ2  LYS 103           HZ2      LYS 103  -4.623   5.761 -23.408
  874    HZ3  LYS 103           HZ3      LYS 103  -3.829   7.066 -23.969
  875    H    LYS 104           H        LYS 104  -4.916   1.270 -30.084
  876    HA   LYS 104           HA       LYS 104  -2.994   2.160 -31.988
  877    HB2  LYS 104           HB2      LYS 104  -5.166   1.105 -32.590
  878    HB3  LYS 104           HB3      LYS 104  -6.028   2.492 -31.923
  879    HG2  LYS 104           HG2      LYS 104  -5.991   2.638 -34.321
  880    HG3  LYS 104           HG3      LYS 104  -5.036   3.960 -33.655
  881    HD2  LYS 104           HD2      LYS 104  -2.945   2.725 -34.163
  882    HD3  LYS 104           HD3      LYS 104  -3.878   1.362 -34.789
  883    HE2  LYS 104           HE2      LYS 104  -3.932   4.207 -35.907
  884    HE3  LYS 104           HE3      LYS 104  -2.920   2.904 -36.534
  885    HZ1  LYS 104           HZ1      LYS 104  -5.881   2.890 -36.529
  886    HZ2  LYS 104           HZ2      LYS 104  -4.925   3.119 -37.825
  887    HZ3  LYS 104           HZ3      LYS 104  -4.934   1.672 -37.081
  Start of MODEL   17
    1    HA   MET   1           HA       MET   1   3.921 -15.650   1.455
    2    H1   MET   1           H1       MET   1   2.196 -14.073   0.907
    3    H2   MET   1           H2       MET   1   1.083 -15.268   0.810
    4    H3   MET   1           H3       MET   1   1.804 -14.942   2.254
    5    HB2  MET   1           HB2      MET   1   2.597 -17.396   2.465
    6    HB3  MET   1           HB3      MET   1   1.682 -17.661   0.979
    7    HG2  MET   1           HG2      MET   1   3.389 -19.393   1.406
    8    HG3  MET   1           HG3      MET   1   3.596 -18.586  -0.138
    9    HE1  MET   1           HE1      MET   1   7.228 -19.636   0.917
   10    HE2  MET   1           HE2      MET   1   5.711 -20.503   1.235
   11    HE3  MET   1           HE3      MET   1   5.981 -19.733  -0.346
   12    H    GLU   2           H        GLU   2   5.189 -15.166  -0.245
   13    HA   GLU   2           HA       GLU   2   4.158 -15.659  -3.017
   14    HB2  GLU   2           HB2      GLU   2   6.073 -13.464  -2.133
   15    HB3  GLU   2           HB3      GLU   2   5.401 -13.732  -3.732
   16    HG2  GLU   2           HG2      GLU   2   4.144 -11.952  -2.949
   17    HG3  GLU   2           HG3      GLU   2   3.080 -13.330  -2.700
   18    H    MET   3           H        MET   3   6.619 -16.303  -0.702
   19    HA   MET   3           HA       MET   3   8.813 -16.662  -2.429
   20    HB2  MET   3           HB2      MET   3   8.431 -17.614   0.451
   21    HB3  MET   3           HB3      MET   3   9.961 -17.320  -0.374
   22    HG2  MET   3           HG2      MET   3   9.625 -15.529   1.106
   23    HG3  MET   3           HG3      MET   3   9.372 -14.894  -0.516
   24    HE1  MET   3           HE1      MET   3   8.627 -12.907   1.572
   25    HE2  MET   3           HE2      MET   3   8.086 -12.735  -0.116
   26    HE3  MET   3           HE3      MET   3   6.941 -12.500   1.222
   27    H    LEU   4           H        LEU   4   6.951 -18.218  -3.605
   28    HA   LEU   4           HA       LEU   4   7.165 -20.992  -2.699
   29    HG   LEU   4           HG       LEU   4   4.941 -20.831  -2.381
   30    HB2  LEU   4           HB2      LEU   4   5.767 -19.722  -5.080
   31    HB3  LEU   4           HB3      LEU   4   5.834 -21.450  -4.755
   32   HD11  LEU   4          HD11      LEU   4   4.974 -18.476  -2.316
   33   HD12  LEU   4          HD12      LEU   4   4.144 -18.327  -3.883
   34   HD13  LEU   4          HD13      LEU   4   3.282 -18.921  -2.455
   35   HD21  LEU   4          HD21      LEU   4   3.691 -22.137  -4.090
   36   HD22  LEU   4          HD22      LEU   4   2.605 -21.058  -3.208
   37   HD23  LEU   4          HD23      LEU   4   3.142 -20.624  -4.847
   38    HA   PRO   5           HA       PRO   5  11.027 -21.436  -4.878
   39    HB2  PRO   5           HB2      PRO   5  10.330 -24.372  -4.709
   40    HB3  PRO   5           HB3      PRO   5  11.898 -23.556  -4.405
   41    HG2  PRO   5           HG2      PRO   5  10.356 -24.234  -2.317
   42    HG3  PRO   5           HG3      PRO   5  11.118 -22.606  -2.376
   43    HD2  PRO   5           HD2      PRO   5   8.269 -23.367  -3.087
   44    HD3  PRO   5           HD3      PRO   5   8.873 -22.006  -2.095
   45    H    ASN   6           H        ASN   6  11.432 -21.060  -6.869
   46    HA   ASN   6           HA       ASN   6  11.072 -22.923  -8.994
   47    HB2  ASN   6           HB2      ASN   6   8.857 -21.664  -9.168
   48    HB3  ASN   6           HB3      ASN   6   9.776 -20.164  -9.333
   49   HD21  ASN   6          HD22      ASN   6   8.963 -23.273 -10.910
   50   HD22  ASN   6          HD21      ASN   6   9.590 -22.837 -12.477
   51    H    GLN   7           H        GLN   7  12.674 -22.163 -10.746
   52    HA   GLN   7           HA       GLN   7  14.854 -20.690  -9.552
   53    HB2  GLN   7           HB2      GLN   7  14.342 -21.659 -12.394
   54    HB3  GLN   7           HB3      GLN   7  15.765 -20.723 -11.936
   55    HG2  GLN   7           HG2      GLN   7  16.300 -22.454 -10.183
   56    HG3  GLN   7           HG3      GLN   7  14.995 -23.451 -10.847
   57   HE21  GLN   7          HE22      GLN   7  17.990 -21.670 -11.864
   58   HE22  GLN   7          HE21      GLN   7  18.462 -22.850 -13.077
   59    H    THR   8           H        THR   8  11.964 -19.552 -11.121
   60    HA   THR   8           HA       THR   8  13.285 -16.993 -11.859
   61    HB   THR   8           HB       THR   8  10.790 -18.283 -13.021
   62    HG1  THR   8           HG1      THR   8  12.429 -19.608 -13.538
   63   HG21  THR   8          HG21      THR   8  10.837 -15.901 -13.488
   64   HG22  THR   8          HG22      THR   8  12.542 -15.972 -13.967
   65   HG23  THR   8          HG23      THR   8  11.297 -16.764 -14.962
   66    H    ILE   9           H        ILE   9  12.274 -15.071 -11.338
   67    HA   ILE   9           HA       ILE   9   9.784 -15.144  -9.747
   68    HB   ILE   9           HB       ILE   9  10.593 -13.794  -8.023
   69   HG12  ILE   9          HG12      ILE   9  13.036 -13.238  -9.707
   70   HG13  ILE   9          HG13      ILE   9  11.785 -12.107  -9.216
   71   HG21  ILE   9          HG21      ILE   9  12.929 -15.691  -8.522
   72   HG22  ILE   9          HG22      ILE   9  12.406 -15.050  -6.973
   73   HG23  ILE   9          HG23      ILE   9  11.350 -16.162  -7.846
   74   HD11  ILE   9          HD11      ILE   9  13.718 -11.653  -7.891
   75   HD12  ILE   9          HD12      ILE   9  12.496 -12.379  -6.825
   76   HD13  ILE   9          HD13      ILE   9  13.870 -13.337  -7.377
   77    H    TYR  10           H        TYR  10   8.836 -12.943  -9.636
   78    HA   TYR  10           HA       TYR  10   9.141 -11.457 -12.206
   79    HD1  TYR  10           HD2      TYR  10   7.720 -10.214 -13.539
   80    HD2  TYR  10           HD1      TYR  10   4.488 -11.943 -11.255
   81    HE1  TYR  10           HE2      TYR  10   6.131  -8.737 -14.683
   82    HE2  TYR  10           HE1      TYR  10   2.878 -10.472 -12.421
   83    HH   TYR  10           HH       TYR  10   3.926  -8.070 -14.886
   84    HB2  TYR  10           HB2      TYR  10   7.272 -13.006 -12.330
   85    HB3  TYR  10           HB3      TYR  10   6.708 -12.541 -10.734
   86    H    ILE  11           H        ILE  11   9.358  -9.317 -11.867
   87    HA   ILE  11           HA       ILE  11   9.025  -8.234  -9.108
   88    HB   ILE  11           HB       ILE  11  11.035  -7.695 -11.336
   89   HG12  ILE  11          HG12      ILE  11  11.485  -8.570  -8.447
   90   HG13  ILE  11          HG13      ILE  11  11.398  -9.695  -9.804
   91   HG21  ILE  11          HG21      ILE  11  12.037  -5.962  -9.923
   92   HG22  ILE  11          HG22      ILE  11  10.395  -5.524 -10.318
   93   HG23  ILE  11          HG23      ILE  11  10.748  -6.172  -8.703
   94   HD11  ILE  11          HD11      ILE  11  13.697  -9.325  -9.281
   95   HD12  ILE  11          HD12      ILE  11  13.367  -8.543 -10.842
   96   HD13  ILE  11          HD13      ILE  11  13.523  -7.568  -9.359
   97    H    ASN  12           H        ASN  12   7.919  -6.366  -8.906
   98    HA   ASN  12           HA       ASN  12   6.696  -4.998 -11.232
   99    HB2  ASN  12           HB2      ASN  12   5.267  -6.333  -8.874
  100    HB3  ASN  12           HB3      ASN  12   4.507  -5.153  -9.930
  101   HD21  ASN  12          HD22      ASN  12   5.709  -8.489  -9.751
  102   HD22  ASN  12          HD21      ASN  12   5.055  -8.989 -11.295
  103    H    ASN  13           H        ASN  13   5.507  -3.036 -10.362
  104    HA   ASN  13           HA       ASN  13   5.729  -0.972  -9.569
  105    HB2  ASN  13           HB2      ASN  13   4.802  -2.159  -7.512
  106    HB3  ASN  13           HB3      ASN  13   6.449  -2.159  -6.874
  107   HD21  ASN  13          HD22      ASN  13   6.619  -0.508  -5.354
  108   HD22  ASN  13          HD21      ASN  13   5.836   1.058  -5.496
  109    H    LEU  14           H        LEU  14   8.027  -2.179 -10.784
  110    HA   LEU  14           HA       LEU  14  10.491  -1.328  -9.492
  111    HG   LEU  14           HG       LEU  14  12.229  -2.913 -10.632
  112    HB2  LEU  14           HB2      LEU  14   9.906  -3.171 -11.321
  113    HB3  LEU  14           HB3      LEU  14  10.035  -1.832 -12.446
  114   HD11  LEU  14          HD11      LEU  14  13.140  -3.790 -12.725
  115   HD12  LEU  14          HD12      LEU  14  11.503  -4.383 -12.495
  116   HD13  LEU  14          HD13      LEU  14  11.813  -3.067 -13.648
  117   HD21  LEU  14          HD21      LEU  14  12.752  -0.579 -10.947
  118   HD22  LEU  14          HD22      LEU  14  13.771  -1.507 -12.037
  119   HD23  LEU  14          HD23      LEU  14  12.350  -0.664 -12.680
  120    H    ASN  15           H        ASN  15  11.465   0.776  -9.840
  121    HA   ASN  15           HA       ASN  15   9.725   2.883 -10.776
  122    HB2  ASN  15           HB2      ASN  15  11.494   3.184  -9.031
  123    HB3  ASN  15           HB3      ASN  15  12.726   3.040 -10.288
  124   HD21  ASN  15          HD22      ASN  15  11.768   5.389  -8.487
  125   HD22  ASN  15          HD21      ASN  15  11.444   6.671  -9.622
  126    H    GLU  16           H        GLU  16   9.229   3.245 -12.811
  127    HA   GLU  16           HA       GLU  16  10.491   1.836 -14.930
  128    HB2  GLU  16           HB2      GLU  16   8.876   3.005 -16.355
  129    HB3  GLU  16           HB3      GLU  16   8.120   2.230 -14.978
  130    HG2  GLU  16           HG2      GLU  16   8.838   5.173 -14.789
  131    HG3  GLU  16           HG3      GLU  16   7.467   4.685 -15.770
  132    H    LYS  17           H        LYS  17  11.539   4.815 -13.530
  133    HA   LYS  17           HA       LYS  17  12.536   5.987 -15.954
  134    HB2  LYS  17           HB2      LYS  17  13.606   7.549 -14.699
  135    HB3  LYS  17           HB3      LYS  17  12.145   7.155 -13.801
  136    HG2  LYS  17           HG2      LYS  17  13.693   5.555 -12.405
  137    HG3  LYS  17           HG3      LYS  17  15.037   6.408 -13.194
  138    HD2  LYS  17           HD2      LYS  17  14.079   8.577 -12.426
  139    HD3  LYS  17           HD3      LYS  17  12.762   7.699 -11.654
  140    HE2  LYS  17           HE2      LYS  17  14.261   8.199  -9.887
  141    HE3  LYS  17           HE3      LYS  17  14.476   6.480 -10.227
  142    HZ1  LYS  17           HZ1      LYS  17  16.594   7.634  -9.953
  143    HZ2  LYS  17           HZ2      LYS  17  16.497   7.084 -11.485
  144    HZ3  LYS  17           HZ3      LYS  17  16.259   8.668 -11.160
  145    H    ILE  18           H        ILE  18  13.590   3.302 -14.002
  146    HA   ILE  18           HA       ILE  18  16.418   3.541 -14.440
  147    HB   ILE  18           HB       ILE  18  14.670   1.206 -13.549
  148   HG12  ILE  18          HG12      ILE  18  14.347   3.054 -12.018
  149   HG13  ILE  18          HG13      ILE  18  15.327   1.834 -11.246
  150   HG21  ILE  18          HG21      ILE  18  16.675   0.281 -12.475
  151   HG22  ILE  18          HG22      ILE  18  16.869   0.390 -14.225
  152   HG23  ILE  18          HG23      ILE  18  17.661   1.579 -13.170
  153   HD11  ILE  18          HD11      ILE  18  16.322   4.471 -12.433
  154   HD12  ILE  18          HD12      ILE  18  16.116   4.094 -10.723
  155   HD13  ILE  18          HD13      ILE  18  17.359   3.253 -11.667
  156    H    LYS  19           H        LYS  19  17.584   2.996 -16.185
  157    HA   LYS  19           HA       LYS  19  16.336   1.946 -18.584
  158    HB2  LYS  19           HB2      LYS  19  19.264   2.361 -17.819
  159    HB3  LYS  19           HB3      LYS  19  18.708   1.927 -19.436
  160    HG2  LYS  19           HG2      LYS  19  17.469   4.032 -19.640
  161    HG3  LYS  19           HG3      LYS  19  17.873   4.472 -17.980
  162    HD2  LYS  19           HD2      LYS  19  19.320   5.699 -19.429
  163    HD3  LYS  19           HD3      LYS  19  20.293   4.495 -18.570
  164    HE2  LYS  19           HE2      LYS  19  20.255   3.029 -20.580
  165    HE3  LYS  19           HE3      LYS  19  19.230   4.201 -21.421
  166    HZ1  LYS  19           HZ1      LYS  19  21.551   4.446 -22.039
  167    HZ2  LYS  19           HZ2      LYS  19  21.053   5.797 -21.280
  168    HZ3  LYS  19           HZ3      LYS  19  22.001   4.718 -20.498
  169    H    LYS  20           H        LYS  20  17.198  -0.025 -19.728
  170    HA   LYS  20           HA       LYS  20  16.963  -2.408 -18.208
  171    HB2  LYS  20           HB2      LYS  20  16.687  -2.149 -20.729
  172    HB3  LYS  20           HB3      LYS  20  18.453  -2.043 -20.847
  173    HG2  LYS  20           HG2      LYS  20  18.551  -4.348 -19.712
  174    HG3  LYS  20           HG3      LYS  20  16.793  -4.383 -19.803
  175    HD2  LYS  20           HD2      LYS  20  17.634  -5.659 -21.640
  176    HD3  LYS  20           HD3      LYS  20  17.000  -4.154 -22.327
  177    HE2  LYS  20           HE2      LYS  20  19.305  -3.232 -22.442
  178    HE3  LYS  20           HE3      LYS  20  19.937  -4.702 -21.690
  179    HZ1  LYS  20           HZ1      LYS  20  19.181  -5.945 -23.633
  180    HZ2  LYS  20           HZ2      LYS  20  18.598  -4.584 -24.333
  181    HZ3  LYS  20           HZ3      LYS  20  20.197  -4.755 -24.083
  182    H    GLU  21           H        GLU  21  19.861  -0.658 -19.364
  183    HA   GLU  21           HA       GLU  21  21.847  -2.419 -18.445
  184    HB2  GLU  21           HB2      GLU  21  22.128  -0.498 -20.001
  185    HB3  GLU  21           HB3      GLU  21  21.813   0.622 -18.681
  186    HG2  GLU  21           HG2      GLU  21  24.137   0.651 -18.900
  187    HG3  GLU  21           HG3      GLU  21  23.866  -0.363 -17.494
  188    H    GLU  22           H        GLU  22  20.246   0.336 -16.785
  189    HA   GLU  22           HA       GLU  22  21.840   0.175 -14.417
  190    HB2  GLU  22           HB2      GLU  22  19.129   1.425 -14.969
  191    HB3  GLU  22           HB3      GLU  22  20.067   1.685 -13.486
  192    HG2  GLU  22           HG2      GLU  22  21.890   2.695 -14.780
  193    HG3  GLU  22           HG3      GLU  22  21.032   2.414 -16.291
  194    H    LEU  23           H        LEU  23  18.636  -1.130 -15.327
  195    HA   LEU  23           HA       LEU  23  17.950  -2.347 -12.847
  196    HG   LEU  23           HG       LEU  23  15.268  -4.095 -15.101
  197    HB2  LEU  23           HB2      LEU  23  16.316  -2.058 -14.582
  198    HB3  LEU  23           HB3      LEU  23  17.287  -2.876 -15.783
  199   HD11  LEU  23          HD11      LEU  23  16.131  -6.276 -15.044
  200   HD12  LEU  23          HD12      LEU  23  17.241  -5.308 -16.033
  201   HD13  LEU  23          HD13      LEU  23  17.672  -5.760 -14.375
  202   HD21  LEU  23          HD21      LEU  23  15.323  -3.417 -12.696
  203   HD22  LEU  23          HD22      LEU  23  15.114  -5.172 -12.918
  204   HD23  LEU  23          HD23      LEU  23  16.684  -4.504 -12.432
  205    H    LYS  24           H        LYS  24  19.685  -3.686 -15.703
  206    HA   LYS  24           HA       LYS  24  20.175  -6.245 -14.617
  207    HB2  LYS  24           HB2      LYS  24  20.378  -5.636 -16.986
  208    HB3  LYS  24           HB3      LYS  24  21.731  -4.563 -16.622
  209    HG2  LYS  24           HG2      LYS  24  23.110  -6.517 -15.949
  210    HG3  LYS  24           HG3      LYS  24  21.730  -7.585 -16.226
  211    HD2  LYS  24           HD2      LYS  24  23.295  -7.658 -18.131
  212    HD3  LYS  24           HD3      LYS  24  21.710  -7.056 -18.602
  213    HE2  LYS  24           HE2      LYS  24  23.383  -5.719 -19.719
  214    HE3  LYS  24           HE3      LYS  24  22.571  -4.710 -18.529
  215    HZ1  LYS  24           HZ1      LYS  24  24.524  -5.187 -17.042
  216    HZ2  LYS  24           HZ2      LYS  24  25.285  -5.843 -18.341
  217    HZ3  LYS  24           HZ3      LYS  24  24.812  -4.262 -18.350
  218    H    LYS  25           H        LYS  25  22.246  -3.302 -14.557
  219    HA   LYS  25           HA       LYS  25  24.382  -4.407 -13.068
  220    HB2  LYS  25           HB2      LYS  25  24.419  -2.240 -14.289
  221    HB3  LYS  25           HB3      LYS  25  23.327  -1.539 -13.087
  222    HG2  LYS  25           HG2      LYS  25  25.035  -1.899 -11.321
  223    HG3  LYS  25           HG3      LYS  25  26.111  -2.654 -12.515
  224    HD2  LYS  25           HD2      LYS  25  26.163  -0.526 -13.801
  225    HD3  LYS  25           HD3      LYS  25  25.089   0.223 -12.597
  226    HE2  LYS  25           HE2      LYS  25  26.787  -0.201 -10.829
  227    HE3  LYS  25           HE3      LYS  25  27.853  -0.945 -12.028
  228    HZ1  LYS  25           HZ1      LYS  25  27.961   1.198 -13.163
  229    HZ2  LYS  25           HZ2      LYS  25  26.976   1.887 -12.053
  230    HZ3  LYS  25           HZ3      LYS  25  28.451   1.353 -11.619
  231    H    SER  26           H        SER  26  21.414  -2.694 -11.900
  232    HA   SER  26           HA       SER  26  22.133  -2.795  -9.174
  233    HG   SER  26           HG       SER  26  20.578  -0.979 -11.183
  234    HB2  SER  26           HB2      SER  26  19.383  -2.621 -10.436
  235    HB3  SER  26           HB3      SER  26  19.794  -2.199  -8.756
  236    H    LEU  27           H        LEU  27  20.160  -5.042 -11.122
  237    HA   LEU  27           HA       LEU  27  19.439  -6.838  -9.034
  238    HG   LEU  27           HG       LEU  27  17.753  -6.109 -11.379
  239    HB2  LEU  27           HB2      LEU  27  19.918  -7.187 -12.012
  240    HB3  LEU  27           HB3      LEU  27  19.505  -8.550 -10.992
  241   HD11  LEU  27          HD11      LEU  27  18.005  -7.634 -13.334
  242   HD12  LEU  27          HD12      LEU  27  17.430  -8.984 -12.347
  243   HD13  LEU  27          HD13      LEU  27  16.351  -7.611 -12.701
  244   HD21  LEU  27          HD21      LEU  27  17.307  -8.698  -9.851
  245   HD22  LEU  27          HD22      LEU  27  17.246  -7.025  -9.221
  246   HD23  LEU  27          HD23      LEU  27  16.000  -7.590 -10.330
  247    H    TYR  28           H        TYR  28  22.329  -6.932 -11.266
  248    HA   TYR  28           HA       TYR  28  23.363  -9.181  -9.836
  249    HD1  TYR  28           HD1      TYR  28  23.722 -10.671 -12.225
  250    HD2  TYR  28           HD2      TYR  28  27.117  -8.680 -10.450
  251    HE1  TYR  28           HE1      TYR  28  24.938 -12.824 -12.154
  252    HE2  TYR  28           HE2      TYR  28  28.342 -10.829 -10.371
  253    HH   TYR  28           HH       TYR  28  28.265 -13.118 -10.828
  254    HB2  TYR  28           HB2      TYR  28  23.936  -8.202 -12.236
  255    HB3  TYR  28           HB3      TYR  28  25.219  -7.373 -11.357
  256    H    ALA  29           H        ALA  29  23.611  -5.719  -9.220
  257    HA   ALA  29           HA       ALA  29  25.831  -5.847  -7.428
  258    HB1  ALA  29           HB1      ALA  29  25.148  -3.595  -6.751
  259    HB2  ALA  29           HB2      ALA  29  25.106  -3.752  -8.515
  260    HB3  ALA  29           HB3      ALA  29  23.592  -3.785  -7.574
  261    H    ILE  30           H        ILE  30  22.279  -6.241  -6.870
  262    HA   ILE  30           HA       ILE  30  23.029  -7.033  -4.075
  263    HB   ILE  30           HB       ILE  30  20.739  -6.012  -3.445
  264   HG12  ILE  30          HG12      ILE  30  21.407  -4.212  -5.807
  265   HG13  ILE  30          HG13      ILE  30  20.044  -5.342  -5.740
  266   HG21  ILE  30          HG21      ILE  30  21.910  -4.008  -2.697
  267   HG22  ILE  30          HG22      ILE  30  23.023  -5.366  -2.627
  268   HG23  ILE  30          HG23      ILE  30  23.142  -4.202  -3.964
  269   HD11  ILE  30          HD11      ILE  30  19.148  -4.040  -3.787
  270   HD12  ILE  30          HD12      ILE  30  20.473  -2.874  -3.998
  271   HD13  ILE  30          HD13      ILE  30  19.288  -3.085  -5.281
  272    H    PHE  31           H        PHE  31  20.527  -7.660  -6.613
  273    HA   PHE  31           HA       PHE  31  19.191  -9.615  -4.967
  274    HD1  PHE  31           HD1      PHE  31  18.169  -6.887  -6.714
  275    HD2  PHE  31           HD2      PHE  31  16.366 -10.802  -6.790
  276    HE1  PHE  31           HE1      PHE  31  15.926  -5.874  -6.436
  277    HE2  PHE  31           HE2      PHE  31  14.134  -9.783  -6.503
  278    HZ   PHE  31           HZ       PHE  31  13.901  -7.315  -6.347
  279    HB2  PHE  31           HB2      PHE  31  19.218  -9.051  -7.926
  280    HB3  PHE  31           HB3      PHE  31  18.612 -10.581  -7.357
  281    H    SER  32           H        SER  32  21.969  -9.937  -7.306
  282    HA   SER  32           HA       SER  32  22.240 -12.727  -6.989
  283    HG   SER  32           HG       SER  32  24.124 -11.445  -9.581
  284    HB2  SER  32           HB2      SER  32  24.341 -10.589  -7.477
  285    HB3  SER  32           HB3      SER  32  24.683 -12.331  -7.513
  286    H    GLN  33           H        GLN  33  23.274 -10.119  -4.765
  287    HA   GLN  33           HA       GLN  33  24.882 -11.937  -3.161
  288    HB2  GLN  33           HB2      GLN  33  24.062  -9.029  -2.959
  289    HB3  GLN  33           HB3      GLN  33  24.776  -9.848  -1.574
  290    HG2  GLN  33           HG2      GLN  33  26.473  -8.658  -2.915
  291    HG3  GLN  33           HG3      GLN  33  26.792 -10.381  -2.767
  292   HE21  GLN  33          HE22      GLN  33  25.566  -7.859  -5.034
  293   HE22  GLN  33          HE21      GLN  33  25.823  -8.790  -6.491
  294    H    PHE  34           H        PHE  34  21.569 -11.784  -3.545
  295    HA   PHE  34           HA       PHE  34  21.188 -13.047  -0.876
  296    HD1  PHE  34           HD1      PHE  34  20.812 -11.584   0.948
  297    HD2  PHE  34           HD2      PHE  34  19.391  -9.109  -2.286
  298    HE1  PHE  34           HE1      PHE  34  21.509  -9.555   2.189
  299    HE2  PHE  34           HE2      PHE  34  20.078  -7.084  -1.038
  300    HZ   PHE  34           HZ       PHE  34  21.143  -7.299   1.203
  301    HB2  PHE  34           HB2      PHE  34  19.166 -11.439  -2.472
  302    HB3  PHE  34           HB3      PHE  34  18.865 -12.243  -0.939
  303    H    GLY  35           H        GLY  35  21.589 -13.894  -4.074
  304    HA2  GLY  35           HA2      GLY  35  20.522 -16.464  -3.557
  305    HA3  GLY  35           HA3      GLY  35  19.335 -15.578  -4.510
  306    H    GLN  36           H        GLN  36  22.607 -14.810  -5.319
  307    HA   GLN  36           HA       GLN  36  23.483 -14.692  -7.332
  308    HB2  GLN  36           HB2      GLN  36  24.723 -16.412  -6.181
  309    HB3  GLN  36           HB3      GLN  36  23.695 -17.670  -6.885
  310    HG2  GLN  36           HG2      GLN  36  25.860 -17.412  -8.086
  311    HG3  GLN  36           HG3      GLN  36  24.475 -17.137  -9.128
  312   HE21  GLN  36          HE22      GLN  36  24.483 -15.228 -10.388
  313   HE22  GLN  36          HE21      GLN  36  25.613 -13.922 -10.119
  314    H    ILE  37           H        ILE  37  22.433 -13.937  -8.942
  315    HA   ILE  37           HA       ILE  37  20.306 -15.064 -10.410
  316    HB   ILE  37           HB       ILE  37  22.416 -12.950 -10.961
  317   HG12  ILE  37          HG12      ILE  37  19.468 -12.826 -10.164
  318   HG13  ILE  37          HG13      ILE  37  20.822 -12.547  -9.078
  319   HG21  ILE  37          HG21      ILE  37  21.645 -13.698 -13.162
  320   HG22  ILE  37          HG22      ILE  37  19.948 -13.465 -12.654
  321   HG23  ILE  37          HG23      ILE  37  21.082 -12.102 -12.793
  322   HD11  ILE  37          HD11      ILE  37  21.498 -10.585 -10.524
  323   HD12  ILE  37          HD12      ILE  37  19.936 -10.783 -11.358
  324   HD13  ILE  37          HD13      ILE  37  19.976 -10.430  -9.628
  325    H    LEU  38           H        LEU  38  20.254 -15.914 -12.444
  326    HA   LEU  38           HA       LEU  38  22.659 -17.186 -13.615
  327    HG   LEU  38           HG       LEU  38  20.687 -18.873 -15.606
  328    HB2  LEU  38           HB2      LEU  38  21.185 -18.872 -12.593
  329    HB3  LEU  38           HB3      LEU  38  19.788 -18.189 -13.420
  330   HD11  LEU  38          HD11      LEU  38  22.647 -20.392 -15.738
  331   HD12  LEU  38          HD12      LEU  38  23.118 -18.787 -15.178
  332   HD13  LEU  38          HD13      LEU  38  22.977 -20.123 -14.013
  333   HD21  LEU  38          HD21      LEU  38  20.656 -21.126 -13.554
  334   HD22  LEU  38          HD22      LEU  38  19.230 -20.391 -14.317
  335   HD23  LEU  38          HD23      LEU  38  20.390 -21.291 -15.304
  336    H    ASP  39           H        ASP  39  19.448 -15.504 -14.119
  337    HA   ASP  39           HA       ASP  39  20.544 -14.268 -16.503
  338    HB2  ASP  39           HB2      ASP  39  19.728 -16.452 -17.429
  339    HB3  ASP  39           HB3      ASP  39  18.115 -16.077 -16.832
  340    H    ILE  40           H        ILE  40  18.902 -12.633 -17.420
  341    HA   ILE  40           HA       ILE  40  17.020 -11.586 -15.373
  342    HB   ILE  40           HB       ILE  40  19.402 -10.141 -16.620
  343   HG12  ILE  40          HG12      ILE  40  18.682 -10.563 -13.686
  344   HG13  ILE  40          HG13      ILE  40  19.863 -11.516 -14.578
  345   HG21  ILE  40          HG21      ILE  40  17.504  -8.612 -16.706
  346   HG22  ILE  40          HG22      ILE  40  17.109  -8.954 -15.008
  347   HG23  ILE  40          HG23      ILE  40  18.606  -8.092 -15.460
  348   HD11  ILE  40          HD11      ILE  40  21.267  -9.516 -14.924
  349   HD12  ILE  40          HD12      ILE  40  20.143  -8.578 -13.900
  350   HD13  ILE  40          HD13      ILE  40  21.050  -9.930 -13.224
  351    H    VAL  41           H        VAL  41  15.279 -10.473 -16.351
  352    HA   VAL  41           HA       VAL  41  15.327 -10.084 -19.290
  353    HB   VAL  41           HB       VAL  41  13.100 -11.492 -17.782
  354   HG11  VAL  41          HG11      VAL  41  12.161 -11.884 -20.056
  355   HG12  VAL  41          HG12      VAL  41  12.236 -10.168 -19.659
  356   HG13  VAL  41          HG13      VAL  41  13.453 -10.872 -20.743
  357   HG21  VAL  41          HG21      VAL  41  13.660 -13.487 -19.142
  358   HG22  VAL  41          HG22      VAL  41  15.104 -12.653 -19.755
  359   HG23  VAL  41          HG23      VAL  41  14.956 -13.062 -18.030
  360    H    ALA  42           H        ALA  42  15.356  -7.911 -19.230
  361    HA   ALA  42           HA       ALA  42  12.848  -6.566 -18.585
  362    HB1  ALA  42           HB1      ALA  42  15.598  -5.516 -17.757
  363    HB2  ALA  42           HB2      ALA  42  14.080  -4.600 -17.694
  364    HB3  ALA  42           HB3      ALA  42  14.294  -6.012 -16.645
  365    H    LEU  43           H        LEU  43  12.910  -4.444 -19.969
  366    HA   LEU  43           HA       LEU  43  14.780  -4.563 -22.250
  367    HG   LEU  43           HG       LEU  43  12.788  -6.949 -22.390
  368    HB2  LEU  43           HB2      LEU  43  11.759  -4.638 -22.588
  369    HB3  LEU  43           HB3      LEU  43  12.890  -4.290 -23.872
  370   HD11  LEU  43          HD11      LEU  43  10.722  -6.547 -23.652
  371   HD12  LEU  43          HD12      LEU  43  11.660  -6.151 -25.106
  372   HD13  LEU  43          HD13      LEU  43  11.698  -7.799 -24.434
  373   HD21  LEU  43          HD21      LEU  43  15.006  -6.502 -23.409
  374   HD22  LEU  43          HD22      LEU  43  14.151  -7.764 -24.294
  375   HD23  LEU  43          HD23      LEU  43  14.227  -6.118 -24.959
  376    H    LYS  44           H        LYS  44  14.647  -2.519 -23.515
  377    HA   LYS  44           HA       LYS  44  14.375  -0.279 -21.723
  378    HB2  LYS  44           HB2      LYS  44  16.064  -0.499 -23.573
  379    HB3  LYS  44           HB3      LYS  44  14.762  -0.289 -24.755
  380    HG2  LYS  44           HG2      LYS  44  14.322   1.975 -23.910
  381    HG3  LYS  44           HG3      LYS  44  15.502   1.748 -22.602
  382    HD2  LYS  44           HD2      LYS  44  17.306   1.487 -24.284
  383    HD3  LYS  44           HD3      LYS  44  16.146   1.732 -25.594
  384    HE2  LYS  44           HE2      LYS  44  16.755   3.756 -23.386
  385    HE3  LYS  44           HE3      LYS  44  17.519   3.757 -24.976
  386    HZ1  LYS  44           HZ1      LYS  44  15.685   5.296 -24.918
  387    HZ2  LYS  44           HZ2      LYS  44  15.338   4.108 -25.971
  388    HZ3  LYS  44           HZ3      LYS  44  14.621   4.138 -24.498
  389    H    THR  45           H        THR  45  12.081  -1.862 -23.866
  390    HA   THR  45           HA       THR  45  10.295   0.316 -24.303
  391    HB   THR  45           HB       THR  45   8.669  -1.752 -24.443
  392    HG1  THR  45           HG1      THR  45   9.699  -3.705 -24.621
  393   HG21  THR  45          HG21      THR  45   9.612  -0.590 -26.419
  394   HG22  THR  45          HG22      THR  45  11.102  -1.551 -26.286
  395   HG23  THR  45          HG23      THR  45   9.558  -2.341 -26.673
  396    H    LEU  46           H        LEU  46   8.815   1.232 -22.953
  397    HA   LEU  46           HA       LEU  46   9.138   1.298 -20.230
  398    HG   LEU  46           HG       LEU  46   6.105   1.640 -19.382
  399    HB2  LEU  46           HB2      LEU  46   7.855   2.958 -21.525
  400    HB3  LEU  46           HB3      LEU  46   6.609   1.756 -21.868
  401   HD11  LEU  46          HD11      LEU  46   6.894   3.477 -17.952
  402   HD12  LEU  46          HD12      LEU  46   8.260   2.512 -18.523
  403   HD13  LEU  46          HD13      LEU  46   7.920   4.090 -19.268
  404   HD21  LEU  46          HD21      LEU  46   5.794   4.336 -20.736
  405   HD22  LEU  46          HD22      LEU  46   4.725   2.919 -20.903
  406   HD23  LEU  46          HD23      LEU  46   4.859   3.741 -19.342
  407    H    LYS  47           H        LYS  47   6.942  -0.821 -22.029
  408    HA   LYS  47           HA       LYS  47   5.430  -1.891 -19.970
  409    HB2  LYS  47           HB2      LYS  47   5.058  -2.139 -22.416
  410    HB3  LYS  47           HB3      LYS  47   6.407  -3.279 -22.511
  411    HG2  LYS  47           HG2      LYS  47   5.199  -4.886 -21.114
  412    HG3  LYS  47           HG3      LYS  47   3.902  -3.708 -20.820
  413    HD2  LYS  47           HD2      LYS  47   3.374  -3.689 -23.240
  414    HD3  LYS  47           HD3      LYS  47   4.652  -4.866 -23.552
  415    HE2  LYS  47           HE2      LYS  47   2.247  -5.343 -21.727
  416    HE3  LYS  47           HE3      LYS  47   2.301  -5.797 -23.431
  417    HZ1  LYS  47           HZ1      LYS  47   4.107  -6.877 -21.345
  418    HZ2  LYS  47           HZ2      LYS  47   2.857  -7.661 -22.034
  419    HZ3  LYS  47           HZ3      LYS  47   4.154  -7.272 -22.934
  420    H    MET  48           H        MET  48   8.847  -2.511 -20.572
  421    HA   MET  48           HA       MET  48   8.809  -4.551 -18.412
  422    HB2  MET  48           HB2      MET  48  10.256  -4.640 -21.058
  423    HB3  MET  48           HB3      MET  48  10.778  -5.610 -19.683
  424    HG2  MET  48           HG2      MET  48   8.071  -5.731 -21.039
  425    HG3  MET  48           HG3      MET  48   9.369  -6.914 -21.170
  426    HE1  MET  48           HE1      MET  48   9.272  -8.235 -17.307
  427    HE2  MET  48           HE2      MET  48  10.218  -8.340 -18.815
  428    HE3  MET  48           HE3      MET  48  10.176  -6.826 -17.876
  429    H    ARG  49           H        ARG  49   9.150  -1.640 -18.322
  430    HA   ARG  49           HA       ARG  49  11.758  -1.712 -16.851
  431    HE   ARG  49           HE       ARG  49  12.154   2.867 -17.971
  432    HB2  ARG  49           HB2      ARG  49  10.345   0.772 -17.904
  433    HB3  ARG  49           HB3      ARG  49  11.820   0.713 -16.933
  434    HG2  ARG  49           HG2      ARG  49  12.814  -0.714 -18.858
  435    HG3  ARG  49           HG3      ARG  49  11.446  -0.120 -19.813
  436    HD2  ARG  49           HD2      ARG  49  13.785   1.374 -18.657
  437    HD3  ARG  49           HD3      ARG  49  13.214   1.382 -20.309
  438   HH11  ARG  49          HH11      ARG  49  11.803   2.347 -21.498
  439   HH12  ARG  49          HH12      ARG  49  10.857   3.781 -21.702
  440   HH21  ARG  49          HH21      ARG  49  10.908   4.603 -18.231
  441   HH22  ARG  49          HH22      ARG  49  10.339   5.137 -19.786
  442    H    GLY  50           H        GLY  50   8.254  -0.976 -16.745
  443    HA2  GLY  50           HA2      GLY  50   8.286  -0.272 -13.924
  444    HA3  GLY  50           HA3      GLY  50   6.881  -0.671 -14.921
  445    H    GLN  51           H        GLN  51   8.718  -3.235 -15.598
  446    HA   GLN  51           HA       GLN  51   8.406  -4.845 -13.205
  447    HB2  GLN  51           HB2      GLN  51   7.007  -6.535 -14.387
  448    HB3  GLN  51           HB3      GLN  51   6.146  -5.023 -14.104
  449    HG2  GLN  51           HG2      GLN  51   6.541  -4.345 -16.454
  450    HG3  GLN  51           HG3      GLN  51   7.417  -5.838 -16.762
  451   HE21  GLN  51          HE22      GLN  51   5.301  -5.137 -18.340
  452   HE22  GLN  51          HE21      GLN  51   3.914  -6.188 -18.035
  453    H    ALA  52           H        ALA  52   9.377  -7.046 -13.651
  454    HA   ALA  52           HA       ALA  52  11.102  -7.402 -15.963
  455    HB1  ALA  52           HB1      ALA  52  12.469  -5.785 -14.674
  456    HB2  ALA  52           HB2      ALA  52  12.345  -6.822 -13.232
  457    HB3  ALA  52           HB3      ALA  52  13.213  -7.391 -14.672
  458    H    PHE  53           H        PHE  53  12.474  -9.469 -15.523
  459    HA   PHE  53           HA       PHE  53  11.406 -11.183 -13.366
  460    HD1  PHE  53           HD2      PHE  53  10.103 -10.539 -17.152
  461    HD2  PHE  53           HD1      PHE  53   9.128 -13.475 -14.145
  462    HE1  PHE  53           HE2      PHE  53   7.695 -10.330 -17.728
  463    HE2  PHE  53           HE1      PHE  53   6.729 -13.297 -14.758
  464    HZ   PHE  53           HZ       PHE  53   6.006 -11.715 -16.535
  465    HB2  PHE  53           HB2      PHE  53  11.800 -12.168 -16.217
  466    HB3  PHE  53           HB3      PHE  53  11.401 -13.147 -14.833
  467    H    VAL  54           H        VAL  54  13.006 -12.866 -12.824
  468    HA   VAL  54           HA       VAL  54  15.614 -12.747 -14.077
  469    HB   VAL  54           HB       VAL  54  16.008 -10.864 -12.802
  470   HG11  VAL  54          HG11      VAL  54  15.571 -10.538 -10.418
  471   HG12  VAL  54          HG12      VAL  54  14.059 -10.889 -11.255
  472   HG13  VAL  54          HG13      VAL  54  14.862 -12.155 -10.305
  473   HG21  VAL  54          HG21      VAL  54  17.847 -12.409 -12.552
  474   HG22  VAL  54          HG22      VAL  54  17.652 -11.439 -11.093
  475   HG23  VAL  54          HG23      VAL  54  17.111 -13.128 -11.112
  476    H    ILE  55           H        ILE  55  16.887 -14.478 -13.500
  477    HA   ILE  55           HA       ILE  55  15.407 -16.811 -12.435
  478    HB   ILE  55           HB       ILE  55  17.332 -16.674 -14.797
  479   HG12  ILE  55          HG12      ILE  55  15.435 -17.440 -16.226
  480   HG13  ILE  55          HG13      ILE  55  14.319 -17.095 -14.919
  481   HG21  ILE  55          HG21      ILE  55  17.402 -18.830 -13.597
  482   HG22  ILE  55          HG22      ILE  55  15.637 -18.978 -13.753
  483   HG23  ILE  55          HG23      ILE  55  16.682 -19.028 -15.186
  484   HD11  ILE  55          HD11      ILE  55  14.495 -15.424 -16.839
  485   HD12  ILE  55          HD12      ILE  55  14.587 -14.733 -15.227
  486   HD13  ILE  55          HD13      ILE  55  16.074 -14.955 -16.186
  487    H    PHE  56           H        PHE  56  16.743 -18.142 -11.122
  488    HA   PHE  56           HA       PHE  56  19.523 -17.203 -10.557
  489    HD1  PHE  56           HD1      PHE  56  15.754 -16.516  -9.433
  490    HD2  PHE  56           HD2      PHE  56  19.547 -15.291  -7.801
  491    HE1  PHE  56           HE1      PHE  56  14.927 -14.212  -9.224
  492    HE2  PHE  56           HE2      PHE  56  18.680 -12.991  -7.506
  493    HZ   PHE  56           HZ       PHE  56  16.369 -12.436  -8.259
  494    HB2  PHE  56           HB2      PHE  56  17.504 -18.187  -8.529
  495    HB3  PHE  56           HB3      PHE  56  19.128 -17.616  -8.222
  496    H    LYS  57           H        LYS  57  20.781 -18.881  -9.337
  497    HA   LYS  57           HA       LYS  57  20.791 -21.171 -11.064
  498    HB2  LYS  57           HB2      LYS  57  22.484 -20.499  -8.617
  499    HB3  LYS  57           HB3      LYS  57  22.791 -21.850  -9.725
  500    HG2  LYS  57           HG2      LYS  57  22.892 -20.233 -11.633
  501    HG3  LYS  57           HG3      LYS  57  22.735 -18.894 -10.485
  502    HD2  LYS  57           HD2      LYS  57  24.855 -19.644  -9.381
  503    HD3  LYS  57           HD3      LYS  57  25.006 -20.919 -10.617
  504    HE2  LYS  57           HE2      LYS  57  24.893 -19.150 -12.396
  505    HE3  LYS  57           HE3      LYS  57  24.833 -17.912 -11.144
  506    HZ1  LYS  57           HZ1      LYS  57  27.088 -19.794 -11.617
  507    HZ2  LYS  57           HZ2      LYS  57  27.086 -18.211 -11.987
  508    HZ3  LYS  57           HZ3      LYS  57  27.064 -18.680 -10.425
  509    H    GLU  58           H        GLU  58  19.298 -20.776  -7.899
  510    HA   GLU  58           HA       GLU  58  18.491 -23.611  -7.982
  511    HB2  GLU  58           HB2      GLU  58  19.873 -22.293  -5.603
  512    HB3  GLU  58           HB3      GLU  58  18.949 -23.793  -5.511
  513    HG2  GLU  58           HG2      GLU  58  20.523 -24.830  -7.160
  514    HG3  GLU  58           HG3      GLU  58  21.492 -23.351  -7.127
  515    H    ILE  59           H        ILE  59  16.518 -23.960  -6.880
  516    HA   ILE  59           HA       ILE  59  14.742 -21.749  -7.007
  517    HB   ILE  59           HB       ILE  59  13.032 -23.310  -6.342
  518   HG12  ILE  59          HG12      ILE  59  15.264 -25.274  -5.635
  519   HG13  ILE  59          HG13      ILE  59  14.122 -24.535  -4.512
  520   HG21  ILE  59          HG21      ILE  59  14.087 -23.359  -8.648
  521   HG22  ILE  59          HG22      ILE  59  14.937 -24.831  -8.154
  522   HG23  ILE  59          HG23      ILE  59  13.161 -24.787  -8.187
  523   HD11  ILE  59          HD11      ILE  59  13.481 -26.581  -6.664
  524   HD12  ILE  59          HD12      ILE  59  13.405 -26.778  -4.908
  525   HD13  ILE  59          HD13      ILE  59  12.247 -25.709  -5.723
  526    H    GLY  60           H        GLY  60  16.410 -23.214  -4.215
  527    HA2  GLY  60           HA2      GLY  60  14.835 -21.864  -2.206
  528    HA3  GLY  60           HA3      GLY  60  16.448 -22.580  -1.998
  529    H    SER  61           H        SER  61  17.958 -21.154  -3.869
  530    HA   SER  61           HA       SER  61  18.489 -18.709  -2.566
  531    HG   SER  61           HG       SER  61  21.096 -20.511  -4.222
  532    HB2  SER  61           HB2      SER  61  19.310 -19.541  -5.377
  533    HB3  SER  61           HB3      SER  61  20.160 -18.454  -4.257
  534    H    ALA  62           H        ALA  62  16.689 -19.427  -5.622
  535    HA   ALA  62           HA       ALA  62  16.014 -16.775  -6.325
  536    HB1  ALA  62           HB1      ALA  62  15.560 -18.825  -7.723
  537    HB2  ALA  62           HB2      ALA  62  14.298 -19.288  -6.570
  538    HB3  ALA  62           HB3      ALA  62  14.125 -17.802  -7.516
  539    H    SER  63           H        SER  63  14.308 -19.089  -4.142
  540    HA   SER  63           HA       SER  63  12.174 -17.355  -3.464
  541    HG   SER  63           HG       SER  63  12.871 -20.404  -3.724
  542    HB2  SER  63           HB2      SER  63  13.402 -19.537  -1.727
  543    HB3  SER  63           HB3      SER  63  11.773 -18.858  -1.597
  544    H    ASN  64           H        ASN  64  15.412 -17.733  -1.997
  545    HA   ASN  64           HA       ASN  64  14.848 -15.949   0.178
  546    HB2  ASN  64           HB2      ASN  64  16.729 -17.582   0.225
  547    HB3  ASN  64           HB3      ASN  64  17.575 -16.613  -0.995
  548   HD21  ASN  64          HD22      ASN  64  18.755 -14.808  -0.265
  549   HD22  ASN  64          HD21      ASN  64  18.646 -14.167   1.368
  550    H    ALA  65           H        ALA  65  16.303 -15.389  -3.055
  551    HA   ALA  65           HA       ALA  65  16.873 -12.642  -2.754
  552    HB1  ALA  65           HB1      ALA  65  17.582 -14.040  -4.703
  553    HB2  ALA  65           HB2      ALA  65  15.892 -14.105  -5.263
  554    HB3  ALA  65           HB3      ALA  65  16.751 -12.558  -5.202
  555    H    LEU  66           H        LEU  66  13.918 -14.276  -3.981
  556    HA   LEU  66           HA       LEU  66  12.263 -12.055  -4.372
  557    HG   LEU  66           HG       LEU  66  10.007 -12.917  -5.212
  558    HB2  LEU  66           HB2      LEU  66  11.895 -14.501  -4.924
  559    HB3  LEU  66           HB3      LEU  66  11.419 -14.772  -3.262
  560   HD11  LEU  66          HD11      LEU  66   8.277 -14.765  -5.178
  561   HD12  LEU  66          HD12      LEU  66   9.800 -15.179  -5.977
  562   HD13  LEU  66          HD13      LEU  66   9.458 -15.778  -4.345
  563   HD21  LEU  66          HD21      LEU  66   9.129 -13.873  -2.456
  564   HD22  LEU  66          HD22      LEU  66   9.456 -12.191  -2.943
  565   HD23  LEU  66          HD23      LEU  66   8.087 -13.040  -3.627
  566    H    ARG  67           H        ARG  67  12.523 -14.086  -1.392
  567    HA   ARG  67           HA       ARG  67  10.728 -12.575   0.130
  568    HE   ARG  67           HE       ARG  67  13.933 -14.747   2.939
  569    HB2  ARG  67           HB2      ARG  67  11.626 -14.867   0.678
  570    HB3  ARG  67           HB3      ARG  67  13.181 -14.153   1.069
  571    HG2  ARG  67           HG2      ARG  67  12.152 -12.852   2.923
  572    HG3  ARG  67           HG3      ARG  67  10.560 -13.467   2.484
  573    HD2  ARG  67           HD2      ARG  67  11.520 -14.683   4.415
  574    HD3  ARG  67           HD3      ARG  67  11.275 -15.766   3.034
  575   HH11  ARG  67          HH22      ARG  67  12.012 -16.889   5.013
  576   HH12  ARG  67          HH21      ARG  67  13.339 -17.906   5.432
  577   HH21  ARG  67          HH11      ARG  67  15.690 -16.170   3.396
  578   HH22  ARG  67          HH12      ARG  67  15.480 -17.451   4.537
  579    H    THR  68           H        THR  68  14.340 -12.304   0.001
  580    HA   THR  68           HA       THR  68  14.480 -10.369   2.081
  581    HB   THR  68           HB       THR  68  16.490 -10.864  -0.164
  582    HG1  THR  68           HG1      THR  68  16.131 -12.793   0.750
  583   HG21  THR  68          HG21      THR  68  18.145 -10.265   1.632
  584   HG22  THR  68          HG22      THR  68  17.108  -8.912   1.163
  585   HG23  THR  68          HG23      THR  68  16.793  -9.787   2.679
  586    H    MET  69           H        MET  69  14.161 -10.067  -1.475
  587    HA   MET  69           HA       MET  69  14.444  -7.158  -1.315
  588    HB2  MET  69           HB2      MET  69  13.959  -9.021  -3.665
  589    HB3  MET  69           HB3      MET  69  14.309  -7.294  -3.762
  590    HG2  MET  69           HG2      MET  69  16.145  -9.482  -2.683
  591    HG3  MET  69           HG3      MET  69  16.347  -8.597  -4.172
  592    HE1  MET  69           HE1      MET  69  17.335  -4.998  -2.885
  593    HE2  MET  69           HE2      MET  69  17.276  -6.038  -4.316
  594    HE3  MET  69           HE3      MET  69  15.773  -5.603  -3.471
  595    H    GLN  70           H        GLN  70  11.825  -9.321  -0.919
  596    HA   GLN  70           HA       GLN  70   9.729  -7.951  -2.131
  597    HB2  GLN  70           HB2      GLN  70   9.645 -10.212  -1.001
  598    HB3  GLN  70           HB3      GLN  70   9.748  -9.403   0.557
  599    HG2  GLN  70           HG2      GLN  70   7.537 -10.117   0.182
  600    HG3  GLN  70           HG3      GLN  70   7.534  -8.351   0.132
  601   HE21  GLN  70          HE22      GLN  70   6.038 -10.905  -1.351
  602   HE22  GLN  70          HE21      GLN  70   6.070 -10.404  -3.041
  603    H    GLY  71           H        GLY  71   8.937  -5.926  -1.873
  604    HA2  GLY  71           HA2      GLY  71   8.318  -3.958  -0.903
  605    HA3  GLY  71           HA3      GLY  71   8.649  -4.648   0.687
  606    H    PHE  72           H        PHE  72  11.493  -4.977  -1.206
  607    HA   PHE  72           HA       PHE  72  12.815  -3.080   0.515
  608    HD1  PHE  72           HD2      PHE  72  15.317  -4.283   1.501
  609    HD2  PHE  72           HD1      PHE  72  15.541  -2.991  -2.607
  610    HE1  PHE  72           HE2      PHE  72  17.528  -3.246   1.944
  611    HE2  PHE  72           HE1      PHE  72  17.748  -1.943  -2.156
  612    HZ   PHE  72           HZ       PHE  72  18.746  -2.072   0.118
  613    HB2  PHE  72           HB2      PHE  72  13.814  -5.213  -0.247
  614    HB3  PHE  72           HB3      PHE  72  13.858  -4.605  -1.902
  615    HA   PRO  73           HA       PRO  73  12.537   0.353  -2.458
  616    HB2  PRO  73           HB2      PRO  73  14.076   2.215  -1.242
  617    HB3  PRO  73           HB3      PRO  73  12.486   1.711  -0.601
  618    HG2  PRO  73           HG2      PRO  73  15.226   0.732   0.275
  619    HG3  PRO  73           HG3      PRO  73  13.873   1.297   1.303
  620    HD2  PRO  73           HD2      PRO  73  14.345  -1.356   0.772
  621    HD3  PRO  73           HD3      PRO  73  12.696  -0.710   1.020
  622    H    PHE  74           H        PHE  74  13.581  -1.142  -3.945
  623    HA   PHE  74           HA       PHE  74  16.401  -1.412  -4.352
  624    HD1  PHE  74           HD2      PHE  74  17.098  -3.585  -5.792
  625    HD2  PHE  74           HD1      PHE  74  14.621  -1.324  -8.502
  626    HE1  PHE  74           HE2      PHE  74  18.317  -4.560  -7.724
  627    HE2  PHE  74           HE1      PHE  74  15.836  -2.302 -10.427
  628    HZ   PHE  74           HZ       PHE  74  17.642  -3.965 -10.046
  629    HB2  PHE  74           HB2      PHE  74  14.652  -2.827  -5.306
  630    HB3  PHE  74           HB3      PHE  74  14.017  -1.478  -6.240
  631    H    TYR  75           H        TYR  75  14.045   1.006  -5.246
  632    HA   TYR  75           HA       TYR  75  16.005   3.083  -5.589
  633    HD1  TYR  75           HD1      TYR  75  17.000   4.682  -7.561
  634    HD2  TYR  75           HD2      TYR  75  16.030   0.693  -8.889
  635    HE1  TYR  75           HE1      TYR  75  19.210   4.518  -8.650
  636    HE2  TYR  75           HE2      TYR  75  18.246   0.516  -9.982
  637    HH   TYR  75           HH       TYR  75  20.642   3.205  -9.920
  638    HB2  TYR  75           HB2      TYR  75  14.301   2.107  -7.907
  639    HB3  TYR  75           HB3      TYR  75  14.622   3.821  -7.749
  640    H    ASP  76           H        ASP  76  13.955   4.975  -6.401
  641    HA   ASP  76           HA       ASP  76  12.755   5.463  -3.894
  642    HB2  ASP  76           HB2      ASP  76  13.522   7.139  -5.586
  643    HB3  ASP  76           HB3      ASP  76  12.129   6.726  -6.585
  644    H    LYS  77           H        LYS  77  11.806   2.866  -5.168
  645    HA   LYS  77           HA       LYS  77   9.021   3.227  -4.460
  646    HB2  LYS  77           HB2      LYS  77   9.832   1.833  -7.059
  647    HB3  LYS  77           HB3      LYS  77   8.259   1.674  -6.281
  648    HG2  LYS  77           HG2      LYS  77   7.950   4.172  -6.510
  649    HG3  LYS  77           HG3      LYS  77   9.437   4.204  -7.485
  650    HD2  LYS  77           HD2      LYS  77   8.381   2.491  -9.015
  651    HD3  LYS  77           HD3      LYS  77   6.880   2.647  -8.111
  652    HE2  LYS  77           HE2      LYS  77   8.298   4.939  -9.555
  653    HE3  LYS  77           HE3      LYS  77   6.978   3.992 -10.237
  654    HZ1  LYS  77           HZ1      LYS  77   6.763   5.696  -7.822
  655    HZ2  LYS  77           HZ2      LYS  77   6.156   6.031  -9.294
  656    HZ3  LYS  77           HZ3      LYS  77   5.550   4.786  -8.442
  657    HA   PRO  78           HA       PRO  78  10.374  -0.625  -2.499
  658    HB2  PRO  78           HB2      PRO  78   7.992  -1.538  -1.511
  659    HB3  PRO  78           HB3      PRO  78   8.890  -0.172  -0.780
  660    HG2  PRO  78           HG2      PRO  78   6.542  -0.055  -2.690
  661    HG3  PRO  78           HG3      PRO  78   6.802   0.888  -1.190
  662    HD2  PRO  78           HD2      PRO  78   7.372   1.871  -3.692
  663    HD3  PRO  78           HD3      PRO  78   8.326   2.328  -2.249
  664    H    MET  79           H        MET  79  10.738  -2.527  -3.543
  665    HA   MET  79           HA       MET  79   9.484  -3.238  -6.021
  666    HB2  MET  79           HB2      MET  79  11.083  -4.879  -4.005
  667    HB3  MET  79           HB3      MET  79  10.679  -5.428  -5.636
  668    HG2  MET  79           HG2      MET  79  12.276  -2.910  -5.042
  669    HG3  MET  79           HG3      MET  79  12.995  -4.485  -5.330
  670    HE1  MET  79           HE1      MET  79  13.639  -4.545  -8.919
  671    HE2  MET  79           HE2      MET  79  14.295  -4.562  -7.269
  672    HE3  MET  79           HE3      MET  79  13.034  -5.719  -7.726
  673    H    GLN  80           H        GLN  80   8.016  -4.957  -6.471
  674    HA   GLN  80           HA       GLN  80   6.702  -6.321  -4.170
  675    HB2  GLN  80           HB2      GLN  80   5.356  -5.122  -6.640
  676    HB3  GLN  80           HB3      GLN  80   4.572  -6.230  -5.515
  677    HG2  GLN  80           HG2      GLN  80   5.675  -3.489  -4.725
  678    HG3  GLN  80           HG3      GLN  80   4.012  -3.800  -5.193
  679   HE21  GLN  80          HE22      GLN  80   6.464  -4.476  -2.666
  680   HE22  GLN  80          HE21      GLN  80   5.296  -4.933  -1.438
  681    H    ILE  81           H        ILE  81   6.956  -8.502  -4.477
  682    HA   ILE  81           HA       ILE  81   7.750  -9.394  -7.198
  683    HB   ILE  81           HB       ILE  81   9.134 -10.431  -4.724
  684   HG12  ILE  81          HG12      ILE  81   9.874  -7.858  -6.171
  685   HG13  ILE  81          HG13      ILE  81   9.514  -8.082  -4.448
  686   HG21  ILE  81          HG21      ILE  81  10.045 -10.085  -7.616
  687   HG22  ILE  81          HG22      ILE  81  10.907 -10.956  -6.333
  688   HG23  ILE  81          HG23      ILE  81   9.393 -11.582  -6.952
  689   HD11  ILE  81          HD11      ILE  81  11.987  -9.028  -5.910
  690   HD12  ILE  81          HD12      ILE  81  11.854  -7.763  -4.690
  691   HD13  ILE  81          HD13      ILE  81  11.576  -9.458  -4.227
  692    H    ALA  82           H        ALA  82   7.371 -11.553  -7.688
  693    HA   ALA  82           HA       ALA  82   6.006 -13.297  -5.763
  694    HB1  ALA  82           HB1      ALA  82   4.145 -12.156  -6.956
  695    HB2  ALA  82           HB2      ALA  82   4.860 -12.628  -8.516
  696    HB3  ALA  82           HB3      ALA  82   4.240 -13.868  -7.407
  697    H    TYR  83           H        TYR  83   5.911 -15.546  -6.729
  698    HA   TYR  83           HA       TYR  83   8.398 -16.291  -8.036
  699    HD1  TYR  83           HD1      TYR  83   4.903 -16.949  -5.739
  700    HD2  TYR  83           HD2      TYR  83   5.766 -19.436  -9.156
  701    HE1  TYR  83           HE1      TYR  83   2.506 -17.542  -5.903
  702    HE2  TYR  83           HE2      TYR  83   3.368 -20.027  -9.337
  703    HH   TYR  83           HH       TYR  83   1.233 -19.750  -8.439
  704    HB2  TYR  83           HB2      TYR  83   7.568 -18.537  -7.820
  705    HB3  TYR  83           HB3      TYR  83   7.263 -17.690  -6.317
  706    H    SER  84           H        SER  84   8.143 -17.864 -10.020
  707    HA   SER  84           HA       SER  84   5.966 -17.058 -11.871
  708    HG   SER  84           HG       SER  84   7.370 -15.012 -12.057
  709    HB2  SER  84           HB2      SER  84   8.885 -17.315 -12.686
  710    HB3  SER  84           HB3      SER  84   7.533 -16.736 -13.674
  711    H    LYS  85           H        LYS  85   5.566 -18.677 -13.502
  712    HA   LYS  85           HA       LYS  85   7.085 -21.204 -13.416
  713    HB2  LYS  85           HB2      LYS  85   4.047 -21.057 -13.092
  714    HB3  LYS  85           HB3      LYS  85   4.951 -22.525 -13.484
  715    HG2  LYS  85           HG2      LYS  85   6.224 -22.301 -11.346
  716    HG3  LYS  85           HG3      LYS  85   5.177 -20.933 -10.910
  717    HD2  LYS  85           HD2      LYS  85   3.189 -22.387 -11.031
  718    HD3  LYS  85           HD3      LYS  85   4.214 -23.761 -11.503
  719    HE2  LYS  85           HE2      LYS  85   5.462 -23.568  -9.363
  720    HE3  LYS  85           HE3      LYS  85   4.438 -22.209  -8.881
  721    HZ1  LYS  85           HZ1      LYS  85   3.485 -24.976  -9.368
  722    HZ2  LYS  85           HZ2      LYS  85   3.677 -24.284  -7.908
  723    HZ3  LYS  85           HZ3      LYS  85   2.533 -23.723  -8.925
  724    H    SER  86           H        SER  86   7.071 -18.914 -15.173
  725    HA   SER  86           HA       SER  86   5.875 -20.008 -17.670
  726    HG   SER  86           HG       SER  86   3.520 -17.556 -16.402
  727    HB2  SER  86           HB2      SER  86   5.750 -17.103 -16.779
  728    HB3  SER  86           HB3      SER  86   4.943 -17.845 -18.169
  729    H    ASP  87           H        ASP  87   8.715 -19.925 -16.575
  730    HA   ASP  87           HA       ASP  87  10.284 -17.903 -17.720
  731    HB2  ASP  87           HB2      ASP  87  11.215 -19.464 -16.159
  732    HB3  ASP  87           HB3      ASP  87  10.877 -20.829 -17.227
  733    H    SER  88           H        SER  88   9.331 -21.070 -19.193
  734    HA   SER  88           HA       SER  88  10.618 -20.711 -21.643
  735    HG   SER  88           HG       SER  88   9.294 -23.920 -20.578
  736    HB2  SER  88           HB2      SER  88   7.974 -22.151 -21.224
  737    HB3  SER  88           HB3      SER  88   9.245 -22.517 -22.405
  738    H    ASP  89           H        ASP  89   7.533 -19.332 -20.514
  739    HA   ASP  89           HA       ASP  89   6.622 -18.680 -23.216
  740    HB2  ASP  89           HB2      ASP  89   4.978 -19.209 -21.474
  741    HB3  ASP  89           HB3      ASP  89   5.567 -17.874 -20.481
  742    H    ILE  90           H        ILE  90   8.022 -16.895 -20.418
  743    HA   ILE  90           HA       ILE  90   7.962 -14.381 -21.847
  744    HB   ILE  90           HB       ILE  90   9.480 -13.486 -20.201
  745   HG12  ILE  90          HG12      ILE  90   9.616 -16.245 -18.946
  746   HG13  ILE  90          HG13      ILE  90  10.945 -15.475 -19.823
  747   HG21  ILE  90          HG21      ILE  90   7.965 -13.648 -18.317
  748   HG22  ILE  90          HG22      ILE  90   7.025 -13.707 -19.810
  749   HG23  ILE  90          HG23      ILE  90   7.329 -15.202 -18.896
  750   HD11  ILE  90          HD11      ILE  90  11.357 -15.210 -17.484
  751   HD12  ILE  90          HD12      ILE  90  10.927 -13.619 -18.142
  752   HD13  ILE  90          HD13      ILE  90   9.741 -14.555 -17.194
  753    H    VAL  91           H        VAL  91  10.383 -17.029 -21.656
  754    HA   VAL  91           HA       VAL  91  12.304 -15.690 -23.249
  755    HB   VAL  91           HB       VAL  91  11.741 -18.631 -22.774
  756   HG11  VAL  91          HG11      VAL  91  12.829 -18.484 -24.981
  757   HG12  VAL  91          HG12      VAL  91  14.082 -17.417 -24.317
  758   HG13  VAL  91          HG13      VAL  91  13.961 -19.109 -23.779
  759   HG21  VAL  91          HG21      VAL  91  13.775 -18.489 -21.407
  760   HG22  VAL  91          HG22      VAL  91  14.039 -16.803 -21.903
  761   HG23  VAL  91          HG23      VAL  91  12.663 -17.224 -20.878
  762    H    ALA  92           H        ALA  92   9.495 -17.819 -24.214
  763    HA   ALA  92           HA       ALA  92   9.944 -17.630 -26.972
  764    HB1  ALA  92           HB1      ALA  92   8.295 -19.156 -25.905
  765    HB2  ALA  92           HB2      ALA  92   7.241 -17.766 -25.566
  766    HB3  ALA  92           HB3      ALA  92   7.589 -18.220 -27.240
  767    H    LYS  93           H        LYS  93   8.244 -15.286 -24.829
  768    HA   LYS  93           HA       LYS  93   7.368 -13.603 -26.984
  769    HB2  LYS  93           HB2      LYS  93   7.839 -13.020 -24.029
  770    HB3  LYS  93           HB3      LYS  93   7.177 -11.844 -25.145
  771    HG2  LYS  93           HG2      LYS  93   5.910 -14.509 -24.398
  772    HG3  LYS  93           HG3      LYS  93   5.411 -12.920 -23.845
  773    HD2  LYS  93           HD2      LYS  93   5.210 -14.002 -26.689
  774    HD3  LYS  93           HD3      LYS  93   3.896 -13.766 -25.539
  775    HE2  LYS  93           HE2      LYS  93   4.336 -11.312 -25.529
  776    HE3  LYS  93           HE3      LYS  93   5.622 -11.542 -26.720
  777    HZ1  LYS  93           HZ1      LYS  93   3.554 -10.890 -27.771
  778    HZ2  LYS  93           HZ2      LYS  93   3.947 -12.390 -28.264
  779    HZ3  LYS  93           HZ3      LYS  93   2.759 -12.172 -27.161
  780    H    ILE  94           H        ILE  94  10.381 -13.411 -24.935
  781    HA   ILE  94           HA       ILE  94  11.170 -11.024 -26.405
  782    HB   ILE  94           HB       ILE  94  13.219 -11.058 -25.188
  783   HG12  ILE  94          HG12      ILE  94  12.425 -13.818 -24.228
  784   HG13  ILE  94          HG13      ILE  94  13.820 -13.397 -25.216
  785   HG21  ILE  94          HG21      ILE  94  11.074 -10.253 -24.143
  786   HG22  ILE  94          HG22      ILE  94  10.970 -11.797 -23.274
  787   HG23  ILE  94          HG23      ILE  94  12.331 -10.697 -22.989
  788   HD11  ILE  94          HD11      ILE  94  14.718 -12.065 -23.272
  789   HD12  ILE  94          HD12      ILE  94  13.389 -12.736 -22.286
  790   HD13  ILE  94          HD13      ILE  94  14.596 -13.815 -22.995
  791    H    LYS  95           H        LYS  95  11.708 -14.465 -26.852
  792    HA   LYS  95           HA       LYS  95  13.536 -14.024 -29.148
  793    HB2  LYS  95           HB2      LYS  95  12.403 -16.605 -27.973
  794    HB3  LYS  95           HB3      LYS  95  13.667 -16.453 -29.190
  795    HG2  LYS  95           HG2      LYS  95  13.954 -15.579 -26.303
  796    HG3  LYS  95           HG3      LYS  95  14.600 -17.041 -27.035
  797    HD2  LYS  95           HD2      LYS  95  15.979 -15.640 -28.582
  798    HD3  LYS  95           HD3      LYS  95  15.368 -14.180 -27.766
  799    HE2  LYS  95           HE2      LYS  95  16.274 -15.014 -25.607
  800    HE3  LYS  95           HE3      LYS  95  16.895 -16.454 -26.422
  801    HZ1  LYS  95           HZ1      LYS  95  17.762 -13.674 -26.985
  802    HZ2  LYS  95           HZ2      LYS  95  18.611 -14.783 -26.150
  803    HZ3  LYS  95           HZ3      LYS  95  18.336 -15.009 -27.738
  804    H    GLY  96           H        GLY  96  12.045 -16.451 -30.480
  805    HA2  GLY  96           HA2      GLY  96   9.504 -15.098 -31.239
  806    HA3  GLY  96           HA3      GLY  96  10.719 -15.380 -32.486
  807    H    THR  97           H        THR  97  11.619 -18.042 -31.791
  808    HA   THR  97           HA       THR  97   9.428 -19.525 -32.944
  809    HB   THR  97           HB       THR  97  11.002 -21.416 -32.797
  810    HG1  THR  97           HG1      THR  97  12.967 -21.184 -31.833
  811   HG21  THR  97          HG21      THR  97  11.265 -19.745 -34.644
  812   HG22  THR  97          HG22      THR  97  12.498 -18.911 -33.669
  813   HG23  THR  97          HG23      THR  97  12.770 -20.576 -34.211
  814    H    PHE  98           H        PHE  98  11.065 -19.483 -29.866
  815    HA   PHE  98           HA       PHE  98   9.156 -20.066 -27.942
  816    HD1  PHE  98           HD2      PHE  98   7.705 -21.882 -26.630
  817    HD2  PHE  98           HD1      PHE  98  11.458 -23.864 -27.419
  818    HE1  PHE  98           HE2      PHE  98   7.549 -23.055 -24.449
  819    HE2  PHE  98           HE1      PHE  98  11.300 -25.027 -25.234
  820    HZ   PHE  98           HZ       PHE  98   9.343 -24.634 -23.750
  821    HB2  PHE  98           HB2      PHE  98   8.722 -22.230 -29.018
  822    HB3  PHE  98           HB3      PHE  98  10.445 -22.565 -29.127
  823    H    LYS  99           H        LYS  99  12.400 -20.784 -29.224
  824    HA   LYS  99           HA       LYS  99  13.643 -19.712 -26.749
  825    HB2  LYS  99           HB2      LYS  99  15.132 -21.641 -26.558
  826    HB3  LYS  99           HB3      LYS  99  13.444 -22.105 -26.366
  827    HG2  LYS  99           HG2      LYS  99  13.397 -22.964 -28.701
  828    HG3  LYS  99           HG3      LYS  99  15.083 -22.469 -28.918
  829    HD2  LYS  99           HD2      LYS  99  15.773 -24.010 -27.102
  830    HD3  LYS  99           HD3      LYS  99  14.080 -24.517 -26.894
  831    HE2  LYS  99           HE2      LYS  99  14.031 -25.300 -29.254
  832    HE3  LYS  99           HE3      LYS  99  15.707 -24.782 -29.468
  833    HZ1  LYS  99           HZ1      LYS  99  15.562 -27.145 -29.011
  834    HZ2  LYS  99           HZ2      LYS  99  16.355 -26.416 -27.791
  835    HZ3  LYS  99           HZ3      LYS  99  14.803 -26.895 -27.592
  836    H    GLU 100           H        GLU 100  13.563 -19.654 -30.116
  837    HA   GLU 100           HA       GLU 100  16.138 -18.252 -30.276
  838    HB2  GLU 100           HB2      GLU 100  15.241 -20.554 -32.082
  839    HB3  GLU 100           HB3      GLU 100  16.493 -19.386 -32.524
  840    HG2  GLU 100           HG2      GLU 100  17.824 -20.054 -30.535
  841    HG3  GLU 100           HG3      GLU 100  16.623 -21.289 -30.157
  842    H    ARG 101           H        ARG 101  15.904 -17.433 -32.921
  843    HA   ARG 101           HA       ARG 101  13.126 -16.466 -33.267
  844    HE   ARG 101           HE       ARG 101  12.529 -11.091 -33.914
  845    HB2  ARG 101           HB2      ARG 101  14.559 -14.762 -31.972
  846    HB3  ARG 101           HB3      ARG 101  15.583 -14.648 -33.423
  847    HG2  ARG 101           HG2      ARG 101  13.763 -13.781 -34.732
  848    HG3  ARG 101           HG3      ARG 101  12.602 -14.031 -33.412
  849    HD2  ARG 101           HD2      ARG 101  13.472 -12.295 -32.112
  850    HD3  ARG 101           HD3      ARG 101  15.039 -12.319 -32.914
  851   HH11  ARG 101          HH21      ARG 101  16.056 -11.567 -34.378
  852   HH12  ARG 101          HH22      ARG 101  16.085 -10.451 -35.740
  853   HH21  ARG 101          HH11      ARG 101  12.757  -9.610 -35.745
  854   HH22  ARG 101          HH12      ARG 101  14.346  -9.458 -36.478
  855    HA   PRO 102           HA       PRO 102  14.495 -17.464 -37.463
  856    HB2  PRO 102           HB2      PRO 102  12.640 -16.052 -38.953
  857    HB3  PRO 102           HB3      PRO 102  12.316 -17.636 -38.189
  858    HG2  PRO 102           HG2      PRO 102  11.602 -14.884 -37.152
  859    HG3  PRO 102           HG3      PRO 102  10.588 -16.360 -37.184
  860    HD2  PRO 102           HD2      PRO 102  11.915 -15.554 -34.947
  861    HD3  PRO 102           HD3      PRO 102  11.711 -17.284 -35.335
  862    H    LYS 103           H        LYS 103  16.442 -16.426 -37.634
  863    HA   LYS 103           HA       LYS 103  17.055 -13.911 -36.745
  864    HB2  LYS 103           HB2      LYS 103  18.498 -15.432 -38.956
  865    HB3  LYS 103           HB3      LYS 103  19.179 -14.114 -38.017
  866    HG2  LYS 103           HG2      LYS 103  18.338 -16.853 -36.971
  867    HG3  LYS 103           HG3      LYS 103  19.978 -16.297 -37.227
  868    HD2  LYS 103           HD2      LYS 103  18.014 -15.223 -35.157
  869    HD3  LYS 103           HD3      LYS 103  19.368 -16.287 -34.840
  870    HE2  LYS 103           HE2      LYS 103  19.612 -13.436 -35.916
  871    HE3  LYS 103           HE3      LYS 103  19.783 -13.900 -34.225
  872    HZ1  LYS 103           HZ1      LYS 103  21.690 -15.263 -34.841
  873    HZ2  LYS 103           HZ2      LYS 103  21.560 -14.819 -36.411
  874    HZ3  LYS 103           HZ3      LYS 103  21.928 -13.714 -35.275
  875    H    LYS 104           H        LYS 104  16.268 -12.013 -37.306
  876    HA   LYS 104           HA       LYS 104  16.447 -11.123 -40.114
  877    HB2  LYS 104           HB2      LYS 104  14.123 -11.948 -39.822
  878    HB3  LYS 104           HB3      LYS 104  13.934 -10.949 -38.385
  879    HG2  LYS 104           HG2      LYS 104  12.817  -9.914 -40.259
  880    HG3  LYS 104           HG3      LYS 104  14.170  -8.898 -39.762
  881    HD2  LYS 104           HD2      LYS 104  15.523  -9.736 -41.659
  882    HD3  LYS 104           HD3      LYS 104  14.212 -10.849 -42.114
  883    HE2  LYS 104           HE2      LYS 104  12.707  -8.905 -42.483
  884    HE3  LYS 104           HE3      LYS 104  14.011  -7.803 -42.024
  885    HZ1  LYS 104           HZ1      LYS 104  13.828  -8.007 -44.418
  886    HZ2  LYS 104           HZ2      LYS 104  15.269  -8.597 -43.942
  887    HZ3  LYS 104           HZ3      LYS 104  14.062  -9.617 -44.366
  Start of MODEL   18
    1    HA   MET   1           HA       MET   1   2.268 -13.383  -2.715
    2    H1   MET   1           H1       MET   1   1.821 -12.472  -0.549
    3    H2   MET   1           H2       MET   1   2.602 -11.083  -0.918
    4    H3   MET   1           H3       MET   1   1.220 -11.485  -1.726
    5    HB2  MET   1           HB2      MET   1   3.882 -10.812  -3.044
    6    HB3  MET   1           HB3      MET   1   4.136 -12.269  -4.009
    7    HG2  MET   1           HG2      MET   1   1.553 -10.672  -3.901
    8    HG3  MET   1           HG3      MET   1   2.748 -10.654  -5.192
    9    HE1  MET   1           HE1      MET   1  -0.222 -12.425  -6.968
   10    HE2  MET   1           HE2      MET   1  -0.283 -11.076  -5.812
   11    HE3  MET   1           HE3      MET   1   0.993 -11.130  -7.052
   12    H    GLU   2           H        GLU   2   3.621 -15.076  -2.326
   13    HA   GLU   2           HA       GLU   2   5.959 -14.658  -0.541
   14    HB2  GLU   2           HB2      GLU   2   3.975 -16.956  -0.275
   15    HB3  GLU   2           HB3      GLU   2   5.440 -16.678   0.664
   16    HG2  GLU   2           HG2      GLU   2   3.838 -15.975   2.140
   17    HG3  GLU   2           HG3      GLU   2   4.351 -14.455   1.429
   18    H    MET   3           H        MET   3   7.227 -16.879  -0.574
   19    HA   MET   3           HA       MET   3   8.070 -17.126  -3.318
   20    HB2  MET   3           HB2      MET   3   9.876 -18.420  -2.463
   21    HB3  MET   3           HB3      MET   3   9.670 -17.028  -1.417
   22    HG2  MET   3           HG2      MET   3   8.941 -19.918  -0.851
   23    HG3  MET   3           HG3      MET   3  10.212 -18.973  -0.103
   24    HE1  MET   3           HE1      MET   3   8.699 -16.198   0.676
   25    HE2  MET   3           HE2      MET   3   8.206 -16.602   2.330
   26    HE3  MET   3           HE3      MET   3   9.818 -17.080   1.745
   27    H    LEU   4           H        LEU   4   7.928 -18.778  -4.685
   28    HA   LEU   4           HA       LEU   4   6.740 -21.356  -3.864
   29    HG   LEU   4           HG       LEU   4   4.512 -21.357  -4.007
   30    HB2  LEU   4           HB2      LEU   4   5.775 -19.629  -6.168
   31    HB3  LEU   4           HB3      LEU   4   5.807 -21.380  -6.278
   32   HD11  LEU   4          HD11      LEU   4   4.607 -18.886  -3.603
   33   HD12  LEU   4          HD12      LEU   4   3.663 -18.637  -5.071
   34   HD13  LEU   4          HD13      LEU   4   2.961 -19.508  -3.698
   35   HD21  LEU   4          HD21      LEU   4   3.612 -22.199  -6.141
   36   HD22  LEU   4          HD22      LEU   4   2.370 -21.307  -5.254
   37   HD23  LEU   4          HD23      LEU   4   3.191 -20.544  -6.636
   38    HA   PRO   5           HA       PRO   5  11.026 -21.523  -5.339
   39    HB2  PRO   5           HB2      PRO   5  10.570 -24.451  -4.735
   40    HB3  PRO   5           HB3      PRO   5  11.984 -23.421  -4.347
   41    HG2  PRO   5           HG2      PRO   5  10.143 -24.009  -2.458
   42    HG3  PRO   5           HG3      PRO   5  10.844 -22.366  -2.571
   43    HD2  PRO   5           HD2      PRO   5   8.158 -23.336  -3.525
   44    HD3  PRO   5           HD3      PRO   5   8.607 -21.786  -2.753
   45    H    ASN   6           H        ASN   6  11.123 -21.171  -7.494
   46    HA   ASN   6           HA       ASN   6  10.599 -23.412  -9.358
   47    HB2  ASN   6           HB2      ASN   6   9.071 -22.235 -10.709
   48    HB3  ASN   6           HB3      ASN   6   8.489 -21.943  -9.074
   49   HD21  ASN   6          HD21      ASN   6   9.060 -19.781  -8.073
   50   HD22  ASN   6          HD22      ASN   6   9.602 -18.455  -9.120
   51    H    GLN   7           H        GLN   7  12.730 -21.062  -8.432
   52    HA   GLN   7           HA       GLN   7  14.780 -20.610  -9.169
   53    HB2  GLN   7           HB2      GLN   7  14.552 -22.767 -10.551
   54    HB3  GLN   7           HB3      GLN   7  14.264 -21.712 -11.940
   55    HG2  GLN   7           HG2      GLN   7  16.433 -20.646 -11.613
   56    HG3  GLN   7           HG3      GLN   7  16.721 -21.572 -10.141
   57   HE21  GLN   7          HE22      GLN   7  18.567 -21.544 -12.151
   58   HE22  GLN   7          HE21      GLN   7  18.637 -23.109 -12.957
   59    H    THR   8           H        THR   8  11.952 -19.253 -10.536
   60    HA   THR   8           HA       THR   8  13.549 -16.932 -11.468
   61    HB   THR   8           HB       THR   8  11.037 -17.878 -12.881
   62    HG1  THR   8           HG1      THR   8  12.444 -19.553 -13.152
   63   HG21  THR   8          HG21      THR   8  11.823 -15.546 -13.365
   64   HG22  THR   8          HG22      THR   8  13.403 -16.175 -13.769
   65   HG23  THR   8          HG23      THR   8  11.998 -16.594 -14.779
   66    H    ILE   9           H        ILE   9  12.423 -14.896 -11.272
   67    HA   ILE   9           HA       ILE   9   9.904 -14.963  -9.713
   68    HB   ILE   9           HB       ILE   9  10.596 -13.377  -8.116
   69   HG12  ILE   9          HG12      ILE   9  13.079 -13.022  -9.788
   70   HG13  ILE   9          HG13      ILE   9  11.858 -11.832  -9.396
   71   HG21  ILE   9          HG21      ILE   9  12.887 -15.380  -8.317
   72   HG22  ILE   9          HG22      ILE   9  12.355 -14.541  -6.872
   73   HG23  ILE   9          HG23      ILE   9  11.277 -15.709  -7.633
   74   HD11  ILE   9          HD11      ILE   9  12.590 -11.813  -7.029
   75   HD12  ILE   9          HD12      ILE   9  13.873 -12.968  -7.416
   76   HD13  ILE   9          HD13      ILE   9  13.881 -11.365  -8.153
   77    H    TYR  10           H        TYR  10   8.839 -12.851  -9.759
   78    HA   TYR  10           HA       TYR  10   9.230 -11.294 -12.274
   79    HD1  TYR  10           HD1      TYR  10   7.067 -10.106 -13.827
   80    HD2  TYR  10           HD2      TYR  10   5.228 -11.218 -10.091
   81    HE1  TYR  10           HE1      TYR  10   5.385  -8.313 -14.118
   82    HE2  TYR  10           HE2      TYR  10   3.535  -9.439 -10.374
   83    HH   TYR  10           HH       TYR  10   3.522  -7.224 -13.197
   84    HB2  TYR  10           HB2      TYR  10   7.276 -12.513 -12.688
   85    HB3  TYR  10           HB3      TYR  10   6.835 -12.603 -10.998
   86    H    ILE  11           H        ILE  11   9.334  -9.161 -11.924
   87    HA   ILE  11           HA       ILE  11   9.038  -8.105  -9.149
   88    HB   ILE  11           HB       ILE  11  11.153  -7.565 -11.284
   89   HG12  ILE  11          HG12      ILE  11  11.441  -8.641  -8.440
   90   HG13  ILE  11          HG13      ILE  11  11.480  -9.625  -9.902
   91   HG21  ILE  11          HG21      ILE  11  10.509  -5.426 -10.178
   92   HG22  ILE  11          HG22      ILE  11  10.841  -6.158  -8.593
   93   HG23  ILE  11          HG23      ILE  11  12.140  -5.899  -9.783
   94   HD11  ILE  11          HD11      ILE  11  13.496  -8.367 -10.679
   95   HD12  ILE  11          HD12      ILE  11  13.540  -7.550  -9.097
   96   HD13  ILE  11          HD13      ILE  11  13.729  -9.303  -9.191
   97    H    ASN  12           H        ASN  12   7.931  -6.158  -9.070
   98    HA   ASN  12           HA       ASN  12   7.322  -4.664 -11.501
   99    HB2  ASN  12           HB2      ASN  12   4.922  -4.694 -11.238
  100    HB3  ASN  12           HB3      ASN  12   5.511  -6.326 -11.464
  101   HD21  ASN  12          HD22      ASN  12   5.617  -7.763  -9.518
  102   HD22  ASN  12          HD21      ASN  12   4.519  -7.452  -8.196
  103    H    ASN  13           H        ASN  13   5.856  -2.724 -10.758
  104    HA   ASN  13           HA       ASN  13   5.930  -0.719  -9.798
  105    HB2  ASN  13           HB2      ASN  13   5.023  -1.980  -7.781
  106    HB3  ASN  13           HB3      ASN  13   6.672  -1.990  -7.146
  107   HD21  ASN  13          HD22      ASN  13   6.859  -0.380  -5.574
  108   HD22  ASN  13          HD21      ASN  13   6.070   1.183  -5.671
  109    H    LEU  14           H        LEU  14   8.246  -1.913 -11.050
  110    HA   LEU  14           HA       LEU  14  10.690  -1.120  -9.690
  111    HG   LEU  14           HG       LEU  14  12.349  -2.797 -10.597
  112    HB2  LEU  14           HB2      LEU  14  10.070  -2.960 -11.551
  113    HB3  LEU  14           HB3      LEU  14  10.417  -1.642 -12.657
  114   HD11  LEU  14          HD11      LEU  14  13.361  -3.943 -12.470
  115   HD12  LEU  14          HD12      LEU  14  11.662  -4.377 -12.392
  116   HD13  LEU  14          HD13      LEU  14  12.215  -3.207 -13.610
  117   HD21  LEU  14          HD21      LEU  14  12.780  -0.767 -12.837
  118   HD22  LEU  14          HD22      LEU  14  13.057  -0.527 -11.094
  119   HD23  LEU  14          HD23      LEU  14  14.091  -1.623 -12.001
  120    H    ASN  15           H        ASN  15  11.794   0.864 -10.028
  121    HA   ASN  15           HA       ASN  15  10.183   3.081 -10.885
  122    HB2  ASN  15           HB2      ASN  15  11.953   3.194  -9.124
  123    HB3  ASN  15           HB3      ASN  15  13.186   3.069 -10.384
  124   HD21  ASN  15          HD22      ASN  15  12.376   5.337  -8.441
  125   HD22  ASN  15          HD21      ASN  15  12.132   6.710  -9.490
  126    H    GLU  16           H        GLU  16   9.684   3.488 -12.911
  127    HA   GLU  16           HA       GLU  16  10.855   2.400 -15.179
  128    HB2  GLU  16           HB2      GLU  16   9.401   3.887 -16.438
  129    HB3  GLU  16           HB3      GLU  16   8.555   3.213 -15.046
  130    HG2  GLU  16           HG2      GLU  16   8.910   5.345 -13.799
  131    HG3  GLU  16           HG3      GLU  16   9.763   6.017 -15.189
  132    H    LYS  17           H        LYS  17  12.264   5.058 -13.409
  133    HA   LYS  17           HA       LYS  17  13.525   6.275 -15.684
  134    HB2  LYS  17           HB2      LYS  17  14.796   7.512 -14.265
  135    HB3  LYS  17           HB3      LYS  17  13.267   7.298 -13.421
  136    HG2  LYS  17           HG2      LYS  17  14.397   5.446 -12.058
  137    HG3  LYS  17           HG3      LYS  17  15.918   5.880 -12.867
  138    HD2  LYS  17           HD2      LYS  17  15.669   8.209 -12.109
  139    HD3  LYS  17           HD3      LYS  17  14.174   7.776 -11.256
  140    HE2  LYS  17           HE2      LYS  17  15.428   6.193  -9.819
  141    HE3  LYS  17           HE3      LYS  17  16.918   6.540 -10.706
  142    HZ1  LYS  17           HZ1      LYS  17  16.796   8.826  -9.907
  143    HZ2  LYS  17           HZ2      LYS  17  15.418   8.520  -9.084
  144    HZ3  LYS  17           HZ3      LYS  17  16.813   7.798  -8.648
  145    H    ILE  18           H        ILE  18  14.063   3.262 -14.025
  146    HA   ILE  18           HA       ILE  18  16.912   3.097 -14.569
  147    HB   ILE  18           HB       ILE  18  14.900   1.047 -13.551
  148   HG12  ILE  18          HG12      ILE  18  14.973   2.933 -12.008
  149   HG13  ILE  18          HG13      ILE  18  15.753   1.538 -11.305
  150   HG21  ILE  18          HG21      ILE  18  17.940   0.996 -13.421
  151   HG22  ILE  18          HG22      ILE  18  16.842  -0.163 -12.646
  152   HG23  ILE  18          HG23      ILE  18  16.902  -0.044 -14.409
  153   HD11  ILE  18          HD11      ILE  18  17.215   3.926 -12.540
  154   HD12  ILE  18          HD12      ILE  18  16.949   3.644 -10.819
  155   HD13  ILE  18          HD13      ILE  18  17.981   2.539 -11.738
  156    H    LYS  19           H        LYS  19  17.625   2.781 -16.583
  157    HA   LYS  19           HA       LYS  19  16.091   1.466 -18.667
  158    HB2  LYS  19           HB2      LYS  19  18.131   1.739 -20.021
  159    HB3  LYS  19           HB3      LYS  19  17.658   3.235 -19.222
  160    HG2  LYS  19           HG2      LYS  19  19.426   2.899 -17.514
  161    HG3  LYS  19           HG3      LYS  19  19.860   1.355 -18.256
  162    HD2  LYS  19           HD2      LYS  19  21.461   3.014 -18.922
  163    HD3  LYS  19           HD3      LYS  19  20.513   2.543 -20.340
  164    HE2  LYS  19           HE2      LYS  19  19.134   4.596 -20.108
  165    HE3  LYS  19           HE3      LYS  19  20.017   5.037 -18.641
  166    HZ1  LYS  19           HZ1      LYS  19  20.852   6.218 -20.568
  167    HZ2  LYS  19           HZ2      LYS  19  22.024   5.248 -19.989
  168    HZ3  LYS  19           HZ3      LYS  19  21.211   4.835 -21.347
  169    H    LYS  20           H        LYS  20  17.153  -0.424 -19.891
  170    HA   LYS  20           HA       LYS  20  17.004  -2.745 -18.332
  171    HB2  LYS  20           HB2      LYS  20  16.742  -2.574 -20.854
  172    HB3  LYS  20           HB3      LYS  20  18.508  -2.436 -20.973
  173    HG2  LYS  20           HG2      LYS  20  18.570  -4.699 -19.664
  174    HG3  LYS  20           HG3      LYS  20  16.854  -4.811 -20.023
  175    HD2  LYS  20           HD2      LYS  20  19.140  -4.597 -22.037
  176    HD3  LYS  20           HD3      LYS  20  18.272  -6.075 -21.604
  177    HE2  LYS  20           HE2      LYS  20  16.176  -5.144 -22.510
  178    HE3  LYS  20           HE3      LYS  20  17.010  -3.640 -22.940
  179    HZ1  LYS  20           HZ1      LYS  20  16.838  -5.119 -24.844
  180    HZ2  LYS  20           HZ2      LYS  20  18.407  -4.934 -24.455
  181    HZ3  LYS  20           HZ3      LYS  20  17.626  -6.315 -24.066
  182    H    GLU  21           H        GLU  21  19.947  -1.085 -19.569
  183    HA   GLU  21           HA       GLU  21  21.809  -2.932 -18.525
  184    HB2  GLU  21           HB2      GLU  21  22.340  -1.316 -20.241
  185    HB3  GLU  21           HB3      GLU  21  22.016   0.043 -19.156
  186    HG2  GLU  21           HG2      GLU  21  23.924  -0.517 -17.756
  187    HG3  GLU  21           HG3      GLU  21  24.191  -2.031 -18.635
  188    H    GLU  22           H        GLU  22  20.335  -0.011 -17.033
  189    HA   GLU  22           HA       GLU  22  21.991  -0.177 -14.689
  190    HB2  GLU  22           HB2      GLU  22  19.464   1.365 -15.355
  191    HB3  GLU  22           HB3      GLU  22  20.254   1.477 -13.778
  192    HG2  GLU  22           HG2      GLU  22  21.710   2.048 -16.398
  193    HG3  GLU  22           HG3      GLU  22  20.853   3.280 -15.475
  194    H    LEU  23           H        LEU  23  18.764  -1.411 -15.554
  195    HA   LEU  23           HA       LEU  23  18.065  -2.496 -13.005
  196    HG   LEU  23           HG       LEU  23  15.318  -4.270 -15.140
  197    HB2  LEU  23           HB2      LEU  23  16.387  -2.274 -14.653
  198    HB3  LEU  23           HB3      LEU  23  17.321  -3.057 -15.900
  199   HD11  LEU  23          HD11      LEU  23  17.174  -5.452 -16.265
  200   HD12  LEU  23          HD12      LEU  23  17.784  -5.943 -14.678
  201   HD13  LEU  23          HD13      LEU  23  16.183  -6.463 -15.200
  202   HD21  LEU  23          HD21      LEU  23  15.239  -5.413 -13.014
  203   HD22  LEU  23          HD22      LEU  23  16.868  -4.866 -12.588
  204   HD23  LEU  23          HD23      LEU  23  15.559  -3.690 -12.704
  205    H    LYS  24           H        LYS  24  19.839  -3.958 -15.795
  206    HA   LYS  24           HA       LYS  24  20.355  -6.449 -14.521
  207    HB2  LYS  24           HB2      LYS  24  21.845  -4.904 -16.687
  208    HB3  LYS  24           HB3      LYS  24  22.344  -6.511 -16.142
  209    HG2  LYS  24           HG2      LYS  24  20.280  -7.516 -16.864
  210    HG3  LYS  24           HG3      LYS  24  19.528  -5.949 -17.159
  211    HD2  LYS  24           HD2      LYS  24  20.146  -6.984 -19.261
  212    HD3  LYS  24           HD3      LYS  24  21.086  -5.505 -19.011
  213    HE2  LYS  24           HE2      LYS  24  23.035  -6.848 -18.278
  214    HE3  LYS  24           HE3      LYS  24  22.089  -8.335 -18.439
  215    HZ1  LYS  24           HZ1      LYS  24  23.495  -7.967 -20.362
  216    HZ2  LYS  24           HZ2      LYS  24  21.936  -7.902 -20.823
  217    HZ3  LYS  24           HZ3      LYS  24  22.809  -6.525 -20.676
  218    H    LYS  25           H        LYS  25  22.393  -3.472 -14.645
  219    HA   LYS  25           HA       LYS  25  24.490  -4.504 -13.051
  220    HB2  LYS  25           HB2      LYS  25  23.434  -1.667 -13.402
  221    HB3  LYS  25           HB3      LYS  25  24.904  -2.018 -12.512
  222    HG2  LYS  25           HG2      LYS  25  24.674  -3.032 -15.360
  223    HG3  LYS  25           HG3      LYS  25  24.923  -1.315 -15.077
  224    HD2  LYS  25           HD2      LYS  25  27.043  -2.341 -15.469
  225    HD3  LYS  25           HD3      LYS  25  26.978  -1.784 -13.794
  226    HE2  LYS  25           HE2      LYS  25  26.540  -4.095 -13.027
  227    HE3  LYS  25           HE3      LYS  25  26.506  -4.660 -14.708
  228    HZ1  LYS  25           HZ1      LYS  25  28.649  -5.074 -13.670
  229    HZ2  LYS  25           HZ2      LYS  25  28.839  -4.020 -14.895
  230    HZ3  LYS  25           HZ3      LYS  25  28.870  -3.493 -13.349
  231    H    SER  26           H        SER  26  21.497  -2.773 -12.017
  232    HA   SER  26           HA       SER  26  22.197  -2.670  -9.280
  233    HG   SER  26           HG       SER  26  20.560  -1.089 -11.423
  234    HB2  SER  26           HB2      SER  26  19.438  -2.744 -10.544
  235    HB3  SER  26           HB3      SER  26  19.832  -2.175  -8.905
  236    H    LEU  27           H        LEU  27  20.296  -5.087 -11.100
  237    HA   LEU  27           HA       LEU  27  19.663  -6.771  -8.892
  238    HG   LEU  27           HG       LEU  27  17.823  -6.146 -11.005
  239    HB2  LEU  27           HB2      LEU  27  19.958  -7.181 -11.874
  240    HB3  LEU  27           HB3      LEU  27  19.659  -8.554 -10.824
  241   HD11  LEU  27          HD11      LEU  27  17.571  -8.947 -12.190
  242   HD12  LEU  27          HD12      LEU  27  16.331  -7.671 -12.266
  243   HD13  LEU  27          HD13      LEU  27  17.881  -7.448 -13.084
  244   HD21  LEU  27          HD21      LEU  27  17.532  -8.837  -9.612
  245   HD22  LEU  27          HD22      LEU  27  17.534  -7.217  -8.868
  246   HD23  LEU  27          HD23      LEU  27  16.191  -7.702  -9.889
  247    H    TYR  28           H        TYR  28  22.446  -7.004 -11.237
  248    HA   TYR  28           HA       TYR  28  23.663  -9.147  -9.820
  249    HD1  TYR  28           HD2      TYR  28  24.336 -10.771 -11.258
  250    HD2  TYR  28           HD1      TYR  28  24.404  -7.387 -13.933
  251    HE1  TYR  28           HE2      TYR  28  23.782 -12.260 -13.149
  252    HE2  TYR  28           HE1      TYR  28  23.856  -8.870 -15.832
  253    HH   TYR  28           HH       TYR  28  23.400 -11.061 -16.512
  254    HB2  TYR  28           HB2      TYR  28  24.843  -7.022 -11.644
  255    HB3  TYR  28           HB3      TYR  28  25.780  -8.350 -10.986
  256    H    ALA  29           H        ALA  29  23.812  -5.629  -9.236
  257    HA   ALA  29           HA       ALA  29  26.064  -5.720  -7.499
  258    HB1  ALA  29           HB1      ALA  29  25.347  -3.482  -6.784
  259    HB2  ALA  29           HB2      ALA  29  25.289  -3.635  -8.547
  260    HB3  ALA  29           HB3      ALA  29  23.786  -3.694  -7.592
  261    H    ILE  30           H        ILE  30  22.514  -5.980  -6.810
  262    HA   ILE  30           HA       ILE  30  23.310  -6.619  -3.992
  263    HB   ILE  30           HB       ILE  30  21.113  -5.539  -3.372
  264   HG12  ILE  30          HG12      ILE  30  21.508  -3.936  -5.914
  265   HG13  ILE  30          HG13      ILE  30  20.278  -5.199  -5.741
  266   HG21  ILE  30          HG21      ILE  30  23.380  -3.732  -4.364
  267   HG22  ILE  30          HG22      ILE  30  22.281  -3.405  -3.008
  268   HG23  ILE  30          HG23      ILE  30  23.461  -4.700  -2.883
  269   HD11  ILE  30          HD11      ILE  30  19.217  -3.936  -3.911
  270   HD12  ILE  30          HD12      ILE  30  20.463  -2.670  -4.039
  271   HD13  ILE  30          HD13      ILE  30  19.363  -2.945  -5.382
  272    H    PHE  31           H        PHE  31  20.860  -7.518  -6.442
  273    HA   PHE  31           HA       PHE  31  19.466  -9.274  -4.612
  274    HD1  PHE  31           HD1      PHE  31  18.399  -6.829  -6.220
  275    HD2  PHE  31           HD2      PHE  31  16.707 -10.762  -6.742
  276    HE1  PHE  31           HE1      PHE  31  16.122  -5.893  -5.967
  277    HE2  PHE  31           HE2      PHE  31  14.433  -9.819  -6.460
  278    HZ   PHE  31           HZ       PHE  31  14.132  -7.386  -6.091
  279    HB2  PHE  31           HB2      PHE  31  19.525  -8.986  -7.600
  280    HB3  PHE  31           HB3      PHE  31  18.988 -10.507  -6.933
  281    H    SER  32           H        SER  32  22.286  -9.800  -6.809
  282    HA   SER  32           HA       SER  32  22.591 -12.521  -6.432
  283    HG   SER  32           HG       SER  32  24.546 -11.127  -8.919
  284    HB2  SER  32           HB2      SER  32  24.720 -10.399  -6.751
  285    HB3  SER  32           HB3      SER  32  24.986 -12.144  -6.931
  286    H    GLN  33           H        GLN  33  23.035 -10.113  -3.944
  287    HA   GLN  33           HA       GLN  33  24.898 -11.571  -2.278
  288    HB2  GLN  33           HB2      GLN  33  22.733  -9.586  -1.494
  289    HB3  GLN  33           HB3      GLN  33  24.079 -10.093  -0.483
  290    HG2  GLN  33           HG2      GLN  33  25.696  -9.019  -1.964
  291    HG3  GLN  33           HG3      GLN  33  24.422  -8.571  -3.105
  292   HE21  GLN  33          HE22      GLN  33  22.428  -7.465  -1.839
  293   HE22  GLN  33          HE21      GLN  33  22.908  -6.138  -0.788
  294    H    PHE  34           H        PHE  34  21.432 -11.816  -2.905
  295    HA   PHE  34           HA       PHE  34  21.073 -13.600  -0.543
  296    HD1  PHE  34           HD1      PHE  34  20.706 -11.971   1.411
  297    HD2  PHE  34           HD2      PHE  34  19.341  -9.595  -1.929
  298    HE1  PHE  34           HE1      PHE  34  21.468  -9.908   2.557
  299    HE2  PHE  34           HE2      PHE  34  20.076  -7.543  -0.765
  300    HZ   PHE  34           HZ       PHE  34  21.152  -7.689   1.476
  301    HB2  PHE  34           HB2      PHE  34  18.966 -11.922  -1.950
  302    HB3  PHE  34           HB3      PHE  34  18.816 -12.738  -0.401
  303    H    GLY  35           H        GLY  35  20.721 -13.350  -4.020
  304    HA2  GLY  35           HA2      GLY  35  20.415 -16.254  -4.055
  305    HA3  GLY  35           HA3      GLY  35  19.111 -15.332  -4.854
  306    H    GLN  36           H        GLN  36  22.327 -16.514  -5.179
  307    HA   GLN  36           HA       GLN  36  23.379 -14.656  -7.019
  308    HB2  GLN  36           HB2      GLN  36  24.762 -16.416  -6.084
  309    HB3  GLN  36           HB3      GLN  36  23.812 -17.662  -6.902
  310    HG2  GLN  36           HG2      GLN  36  25.977 -17.170  -8.049
  311    HG3  GLN  36           HG3      GLN  36  24.578 -16.924  -9.078
  312   HE21  GLN  36          HE22      GLN  36  24.622 -15.069 -10.316
  313   HE22  GLN  36          HE21      GLN  36  25.491 -13.611  -9.882
  314    H    ILE  37           H        ILE  37  22.756 -14.025  -8.898
  315    HA   ILE  37           HA       ILE  37  20.440 -15.025 -10.256
  316    HB   ILE  37           HB       ILE  37  22.555 -12.911 -10.843
  317   HG12  ILE  37          HG12      ILE  37  19.697 -12.774  -9.773
  318   HG13  ILE  37          HG13      ILE  37  21.164 -12.521  -8.825
  319   HG21  ILE  37          HG21      ILE  37  19.965 -13.434 -12.359
  320   HG22  ILE  37          HG22      ILE  37  21.000 -12.002 -12.544
  321   HG23  ILE  37          HG23      ILE  37  21.619 -13.558 -13.004
  322   HD11  ILE  37          HD11      ILE  37  20.235 -10.407  -9.269
  323   HD12  ILE  37          HD12      ILE  37  21.709 -10.543 -10.249
  324   HD13  ILE  37          HD13      ILE  37  20.101 -10.725 -11.000
  325    H    LEU  38           H        LEU  38  20.349 -15.830 -12.378
  326    HA   LEU  38           HA       LEU  38  22.784 -17.071 -13.530
  327    HG   LEU  38           HG       LEU  38  20.825 -18.731 -15.571
  328    HB2  LEU  38           HB2      LEU  38  21.352 -18.792 -12.561
  329    HB3  LEU  38           HB3      LEU  38  19.930 -18.108 -13.353
  330   HD11  LEU  38          HD11      LEU  38  23.080 -20.065 -14.001
  331   HD12  LEU  38          HD12      LEU  38  22.775 -20.242 -15.741
  332   HD13  LEU  38          HD13      LEU  38  23.262 -18.673 -15.098
  333   HD21  LEU  38          HD21      LEU  38  20.524 -21.161 -15.314
  334   HD22  LEU  38          HD22      LEU  38  20.761 -21.018 -13.556
  335   HD23  LEU  38          HD23      LEU  38  19.353 -20.267 -14.335
  336    H    ASP  39           H        ASP  39  19.575 -15.415 -14.108
  337    HA   ASP  39           HA       ASP  39  20.718 -14.178 -16.472
  338    HB2  ASP  39           HB2      ASP  39  19.943 -16.365 -17.417
  339    HB3  ASP  39           HB3      ASP  39  18.318 -16.018 -16.839
  340    H    ILE  40           H        ILE  40  19.089 -12.549 -17.426
  341    HA   ILE  40           HA       ILE  40  17.126 -11.559 -15.431
  342    HB   ILE  40           HB       ILE  40  19.472  -9.966 -16.572
  343   HG12  ILE  40          HG12      ILE  40  18.908 -10.823 -13.704
  344   HG13  ILE  40          HG13      ILE  40  20.210 -11.417 -14.737
  345   HG21  ILE  40          HG21      ILE  40  17.184  -9.086 -14.756
  346   HG22  ILE  40          HG22      ILE  40  18.593  -8.089 -15.195
  347   HG23  ILE  40          HG23      ILE  40  17.465  -8.562 -16.431
  348   HD11  ILE  40          HD11      ILE  40  19.966  -8.654 -13.543
  349   HD12  ILE  40          HD12      ILE  40  21.196  -9.872 -13.226
  350   HD13  ILE  40          HD13      ILE  40  21.140  -9.074 -14.810
  351    H    VAL  41           H        VAL  41  15.417 -10.419 -16.447
  352    HA   VAL  41           HA       VAL  41  15.629  -9.860 -19.351
  353    HB   VAL  41           HB       VAL  41  13.370 -11.431 -18.040
  354   HG11  VAL  41          HG11      VAL  41  12.504  -9.969 -19.807
  355   HG12  VAL  41          HG12      VAL  41  13.780 -10.505 -20.918
  356   HG13  VAL  41          HG13      VAL  41  12.513 -11.628 -20.388
  357   HG21  VAL  41          HG21      VAL  41  14.025 -13.271 -19.579
  358   HG22  VAL  41          HG22      VAL  41  15.471 -12.346 -20.043
  359   HG23  VAL  41          HG23      VAL  41  15.262 -12.926 -18.377
  360    H    ALA  42           H        ALA  42  15.264  -7.761 -19.535
  361    HA   ALA  42           HA       ALA  42  12.770  -6.581 -18.659
  362    HB1  ALA  42           HB1      ALA  42  14.287  -5.920 -16.808
  363    HB2  ALA  42           HB2      ALA  42  15.472  -5.308 -17.991
  364    HB3  ALA  42           HB3      ALA  42  13.887  -4.525 -17.825
  365    H    LEU  43           H        LEU  43  12.625  -4.409 -19.940
  366    HA   LEU  43           HA       LEU  43  14.195  -4.374 -22.457
  367    HG   LEU  43           HG       LEU  43  12.108  -6.771 -22.252
  368    HB2  LEU  43           HB2      LEU  43  11.157  -4.429 -22.323
  369    HB3  LEU  43           HB3      LEU  43  12.088  -4.130 -23.770
  370   HD11  LEU  43          HD11      LEU  43  10.755  -7.605 -24.129
  371   HD12  LEU  43          HD12      LEU  43   9.920  -6.294 -23.288
  372   HD13  LEU  43          HD13      LEU  43  10.710  -5.977 -24.842
  373   HD21  LEU  43          HD21      LEU  43  13.200  -7.644 -24.302
  374   HD22  LEU  43          HD22      LEU  43  13.262  -6.003 -24.980
  375   HD23  LEU  43          HD23      LEU  43  14.202  -6.417 -23.530
  376    H    LYS  44           H        LYS  44  13.560  -2.320 -23.715
  377    HA   LYS  44           HA       LYS  44  13.544  -0.041 -21.895
  378    HB2  LYS  44           HB2      LYS  44  13.246  -0.206 -24.940
  379    HB3  LYS  44           HB3      LYS  44  13.456   1.287 -24.039
  380    HG2  LYS  44           HG2      LYS  44  15.519  -0.957 -24.171
  381    HG3  LYS  44           HG3      LYS  44  15.505   0.497 -25.168
  382    HD2  LYS  44           HD2      LYS  44  15.669   1.894 -23.066
  383    HD3  LYS  44           HD3      LYS  44  15.802   0.398 -22.136
  384    HE2  LYS  44           HE2      LYS  44  18.024   1.254 -22.465
  385    HE3  LYS  44           HE3      LYS  44  17.852  -0.216 -23.426
  386    HZ1  LYS  44           HZ1      LYS  44  17.681   2.553 -24.487
  387    HZ2  LYS  44           HZ2      LYS  44  18.955   1.552 -24.656
  388    HZ3  LYS  44           HZ3      LYS  44  17.548   1.193 -25.388
  389    H    THR  45           H        THR  45  11.042  -1.815 -23.689
  390    HA   THR  45           HA       THR  45   9.087   0.244 -23.784
  391    HB   THR  45           HB       THR  45   7.592  -1.930 -23.887
  392    HG1  THR  45           HG1      THR  45   8.738  -3.783 -24.319
  393   HG21  THR  45          HG21      THR  45   8.271  -2.310 -26.233
  394   HG22  THR  45          HG22      THR  45   8.229  -0.580 -25.864
  395   HG23  THR  45          HG23      THR  45   9.790  -1.427 -25.953
  396    H    LEU  46           H        LEU  46   7.632   0.948 -22.250
  397    HA   LEU  46           HA       LEU  46   8.382   0.896 -19.612
  398    HG   LEU  46           HG       LEU  46   5.560   1.060 -18.230
  399    HB2  LEU  46           HB2      LEU  46   6.854   2.570 -20.564
  400    HB3  LEU  46           HB3      LEU  46   5.595   1.345 -20.744
  401   HD11  LEU  46          HD11      LEU  46   6.582   2.845 -16.841
  402   HD12  LEU  46          HD12      LEU  46   7.808   1.867 -17.645
  403   HD13  LEU  46          HD13      LEU  46   7.414   3.484 -18.275
  404   HD21  LEU  46          HD21      LEU  46   5.005   3.850 -19.280
  405   HD22  LEU  46          HD22      LEU  46   3.927   2.433 -19.369
  406   HD23  LEU  46          HD23      LEU  46   4.338   3.125 -17.795
  407    H    LYS  47           H        LYS  47   5.921  -1.228 -21.119
  408    HA   LYS  47           HA       LYS  47   4.960  -2.405 -18.773
  409    HB2  LYS  47           HB2      LYS  47   3.963  -2.530 -21.065
  410    HB3  LYS  47           HB3      LYS  47   5.209  -3.697 -21.531
  411    HG2  LYS  47           HG2      LYS  47   4.356  -5.306 -19.873
  412    HG3  LYS  47           HG3      LYS  47   3.198  -4.103 -19.267
  413    HD2  LYS  47           HD2      LYS  47   2.079  -4.071 -21.481
  414    HD3  LYS  47           HD3      LYS  47   3.249  -5.265 -22.091
  415    HE2  LYS  47           HE2      LYS  47   2.496  -6.882 -20.362
  416    HE3  LYS  47           HE3      LYS  47   1.341  -5.694 -19.745
  417    HZ1  LYS  47           HZ1      LYS  47   0.207  -5.780 -21.888
  418    HZ2  LYS  47           HZ2      LYS  47   1.277  -6.876 -22.462
  419    HZ3  LYS  47           HZ3      LYS  47   0.283  -7.268 -21.233
  420    H    MET  48           H        MET  48   8.065  -2.930 -20.305
  421    HA   MET  48           HA       MET  48   8.645  -5.154 -18.422
  422    HB2  MET  48           HB2      MET  48   9.156  -4.864 -21.374
  423    HB3  MET  48           HB3      MET  48  10.354  -5.730 -20.416
  424    HG2  MET  48           HG2      MET  48   7.494  -6.519 -20.014
  425    HG3  MET  48           HG3      MET  48   8.248  -6.920 -21.551
  426    HE1  MET  48           HE1      MET  48   9.840  -8.520 -17.484
  427    HE2  MET  48           HE2      MET  48  10.129  -6.849 -17.991
  428    HE3  MET  48           HE3      MET  48   8.470  -7.402 -17.633
  429    H    ARG  49           H        ARG  49   8.947  -2.094 -18.426
  430    HA   ARG  49           HA       ARG  49  11.791  -2.120 -17.515
  431    HE   ARG  49           HE       ARG  49  11.782   1.497 -20.329
  432    HB2  ARG  49           HB2      ARG  49  11.053  -0.545 -19.465
  433    HB3  ARG  49           HB3      ARG  49  10.166   0.341 -18.220
  434    HG2  ARG  49           HG2      ARG  49  12.533   0.266 -16.970
  435    HG3  ARG  49           HG3      ARG  49  13.151  -0.011 -18.605
  436    HD2  ARG  49           HD2      ARG  49  11.446   2.294 -17.614
  437    HD3  ARG  49           HD3      ARG  49  13.170   2.379 -18.026
  438   HH11  ARG  49          HH21      ARG  49  11.882   4.401 -18.271
  439   HH12  ARG  49          HH22      ARG  49  11.405   5.473 -19.547
  440   HH21  ARG  49          HH12      ARG  49  11.131   2.845 -21.956
  441   HH22  ARG  49          HH11      ARG  49  10.959   4.563 -21.732
  442    H    GLY  50           H        GLY  50   8.418  -1.041 -16.838
  443    HA2  GLY  50           HA2      GLY  50   8.957  -0.416 -14.040
  444    HA3  GLY  50           HA3      GLY  50   7.386  -0.509 -14.852
  445    H    GLN  51           H        GLN  51   8.855  -3.299 -15.765
  446    HA   GLN  51           HA       GLN  51   8.383  -4.899 -13.373
  447    HB2  GLN  51           HB2      GLN  51   7.232  -5.665 -16.091
  448    HB3  GLN  51           HB3      GLN  51   7.054  -6.540 -14.574
  449    HG2  GLN  51           HG2      GLN  51   5.698  -4.622 -13.675
  450    HG3  GLN  51           HG3      GLN  51   5.801  -3.844 -15.262
  451   HE21  GLN  51          HE22      GLN  51   5.097  -5.358 -17.186
  452   HE22  GLN  51          HE21      GLN  51   3.644  -6.299 -16.886
  453    H    ALA  52           H        ALA  52   9.528  -7.019 -13.656
  454    HA   ALA  52           HA       ALA  52  11.271  -7.386 -15.972
  455    HB1  ALA  52           HB1      ALA  52  13.360  -7.402 -14.648
  456    HB2  ALA  52           HB2      ALA  52  12.620  -5.796 -14.633
  457    HB3  ALA  52           HB3      ALA  52  12.471  -6.856 -13.211
  458    H    PHE  53           H        PHE  53  12.608  -9.435 -15.582
  459    HA   PHE  53           HA       PHE  53  11.512 -11.241 -13.510
  460    HD1  PHE  53           HD2      PHE  53   9.196 -13.014 -14.212
  461    HD2  PHE  53           HD1      PHE  53  10.509 -10.832 -17.689
  462    HE1  PHE  53           HE2      PHE  53   6.832 -12.781 -14.972
  463    HE2  PHE  53           HE1      PHE  53   8.152 -10.597 -18.430
  464    HZ   PHE  53           HZ       PHE  53   6.313 -11.572 -17.068
  465    HB2  PHE  53           HB2      PHE  53  12.080 -12.118 -16.367
  466    HB3  PHE  53           HB3      PHE  53  11.552 -13.132 -15.047
  467    H    VAL  54           H        VAL  54  13.136 -12.822 -12.856
  468    HA   VAL  54           HA       VAL  54  15.762 -12.712 -14.084
  469    HB   VAL  54           HB       VAL  54  16.181 -10.847 -12.815
  470   HG11  VAL  54          HG11      VAL  54  14.952 -12.059 -10.329
  471   HG12  VAL  54          HG12      VAL  54  15.694 -10.460 -10.461
  472   HG13  VAL  54          HG13      VAL  54  14.193 -10.792 -11.321
  473   HG21  VAL  54          HG21      VAL  54  17.946 -12.488 -12.493
  474   HG22  VAL  54          HG22      VAL  54  17.789 -11.441 -11.083
  475   HG23  VAL  54          HG23      VAL  54  17.165 -13.101 -11.031
  476    H    ILE  55           H        ILE  55  16.928 -14.480 -13.680
  477    HA   ILE  55           HA       ILE  55  15.487 -16.831 -12.578
  478    HB   ILE  55           HB       ILE  55  17.500 -16.652 -14.861
  479   HG12  ILE  55          HG12      ILE  55  15.796 -17.363 -16.453
  480   HG13  ILE  55          HG13      ILE  55  14.532 -17.242 -15.259
  481   HG21  ILE  55          HG21      ILE  55  15.806 -18.982 -13.877
  482   HG22  ILE  55          HG22      ILE  55  16.879 -19.020 -15.293
  483   HG23  ILE  55          HG23      ILE  55  17.565 -18.799 -13.692
  484   HD11  ILE  55          HD11      ILE  55  14.680 -15.384 -16.981
  485   HD12  ILE  55          HD12      ILE  55  14.659 -14.804 -15.322
  486   HD13  ILE  55          HD13      ILE  55  16.195 -14.862 -16.225
  487    H    PHE  56           H        PHE  56  16.833 -18.168 -11.271
  488    HA   PHE  56           HA       PHE  56  19.470 -16.995 -10.482
  489    HD1  PHE  56           HD2      PHE  56  15.605 -16.554  -9.600
  490    HD2  PHE  56           HD1      PHE  56  19.342 -15.368  -7.832
  491    HE1  PHE  56           HE2      PHE  56  14.749 -14.264  -9.286
  492    HE2  PHE  56           HE1      PHE  56  18.463 -13.087  -7.467
  493    HZ   PHE  56           HZ       PHE  56  16.157 -12.523  -8.209
  494    HB2  PHE  56           HB2      PHE  56  17.327 -18.268  -8.754
  495    HB3  PHE  56           HB3      PHE  56  18.896 -17.690  -8.206
  496    H    LYS  57           H        LYS  57  20.763 -18.636  -9.109
  497    HA   LYS  57           HA       LYS  57  21.378 -20.857 -10.805
  498    HB2  LYS  57           HB2      LYS  57  22.146 -20.272  -7.909
  499    HB3  LYS  57           HB3      LYS  57  22.873 -21.550  -8.879
  500    HG2  LYS  57           HG2      LYS  57  22.963 -18.603  -9.647
  501    HG3  LYS  57           HG3      LYS  57  24.213 -19.428  -8.713
  502    HD2  LYS  57           HD2      LYS  57  24.711 -20.921 -10.568
  503    HD3  LYS  57           HD3      LYS  57  23.381 -20.240 -11.535
  504    HE2  LYS  57           HE2      LYS  57  24.418 -18.046 -11.557
  505    HE3  LYS  57           HE3      LYS  57  25.676 -18.574 -10.436
  506    HZ1  LYS  57           HZ1      LYS  57  25.363 -19.614 -13.197
  507    HZ2  LYS  57           HZ2      LYS  57  26.492 -18.548 -12.706
  508    HZ3  LYS  57           HZ3      LYS  57  26.519 -20.070 -12.137
  509    H    GLU  58           H        GLU  58  19.162 -20.649  -8.021
  510    HA   GLU  58           HA       GLU  58  18.408 -23.459  -8.418
  511    HB2  GLU  58           HB2      GLU  58  20.402 -23.354  -6.827
  512    HB3  GLU  58           HB3      GLU  58  19.402 -22.405  -5.727
  513    HG2  GLU  58           HG2      GLU  58  17.836 -24.292  -5.493
  514    HG3  GLU  58           HG3      GLU  58  18.738 -25.213  -6.700
  515    H    ILE  59           H        ILE  59  16.387 -23.939  -7.322
  516    HA   ILE  59           HA       ILE  59  14.472 -21.878  -7.299
  517    HB   ILE  59           HB       ILE  59  12.959 -23.512  -6.381
  518   HG12  ILE  59          HG12      ILE  59  15.383 -25.259  -5.778
  519   HG13  ILE  59          HG13      ILE  59  14.298 -24.509  -4.601
  520   HG21  ILE  59          HG21      ILE  59  13.061 -25.187  -8.103
  521   HG22  ILE  59          HG22      ILE  59  13.649 -23.681  -8.769
  522   HG23  ILE  59          HG23      ILE  59  14.805 -24.951  -8.326
  523   HD11  ILE  59          HD11      ILE  59  12.414 -25.900  -5.515
  524   HD12  ILE  59          HD12      ILE  59  13.613 -26.769  -6.506
  525   HD13  ILE  59          HD13      ILE  59  13.723 -26.814  -4.742
  526    H    GLY  60           H        GLY  60  16.506 -23.105  -4.652
  527    HA2  GLY  60           HA2      GLY  60  15.146 -21.739  -2.532
  528    HA3  GLY  60           HA3      GLY  60  16.806 -22.365  -2.508
  529    H    SER  61           H        SER  61  17.942 -20.847  -4.667
  530    HA   SER  61           HA       SER  61  18.536 -18.377  -3.410
  531    HG   SER  61           HG       SER  61  20.630 -19.692  -4.275
  532    HB2  SER  61           HB2      SER  61  18.798 -19.092  -6.367
  533    HB3  SER  61           HB3      SER  61  19.780 -17.933  -5.470
  534    H    ALA  62           H        ALA  62  16.305 -19.188  -6.132
  535    HA   ALA  62           HA       ALA  62  15.427 -16.525  -6.624
  536    HB1  ALA  62           HB1      ALA  62  14.989 -18.438  -8.132
  537    HB2  ALA  62           HB2      ALA  62  13.902 -19.161  -6.923
  538    HB3  ALA  62           HB3      ALA  62  13.479 -17.619  -7.691
  539    H    SER  63           H        SER  63  14.112 -19.058  -4.434
  540    HA   SER  63           HA       SER  63  11.936 -17.551  -3.450
  541    HG   SER  63           HG       SER  63  12.811 -20.533  -3.977
  542    HB2  SER  63           HB2      SER  63  13.563 -19.733  -2.068
  543    HB3  SER  63           HB3      SER  63  11.933 -19.211  -1.624
  544    H    ASN  64           H        ASN  64  15.272 -17.848  -2.208
  545    HA   ASN  64           HA       ASN  64  14.784 -16.252   0.105
  546    HB2  ASN  64           HB2      ASN  64  16.670 -17.894  -0.144
  547    HB3  ASN  64           HB3      ASN  64  17.467 -16.747  -1.228
  548   HD21  ASN  64          HD22      ASN  64  18.958 -15.451  -0.137
  549   HD22  ASN  64          HD21      ASN  64  18.823 -14.971   1.548
  550    H    ALA  65           H        ALA  65  16.082 -15.439  -3.129
  551    HA   ALA  65           HA       ALA  65  16.614 -12.693  -2.667
  552    HB1  ALA  65           HB1      ALA  65  15.624 -14.080  -5.211
  553    HB2  ALA  65           HB2      ALA  65  16.346 -12.466  -5.119
  554    HB3  ALA  65           HB3      ALA  65  17.322 -13.890  -4.723
  555    H    LEU  66           H        LEU  66  13.619 -14.303  -3.885
  556    HA   LEU  66           HA       LEU  66  12.009 -12.041  -4.162
  557    HG   LEU  66           HG       LEU  66   9.477 -12.654  -4.313
  558    HB2  LEU  66           HB2      LEU  66  11.452 -14.242  -4.976
  559    HB3  LEU  66           HB3      LEU  66  11.291 -14.902  -3.371
  560   HD11  LEU  66          HD11      LEU  66   9.161 -15.646  -4.795
  561   HD12  LEU  66          HD12      LEU  66   7.871 -14.448  -5.017
  562   HD13  LEU  66          HD13      LEU  66   9.325 -14.378  -6.024
  563   HD21  LEU  66          HD21      LEU  66   9.244 -13.151  -1.922
  564   HD22  LEU  66          HD22      LEU  66   7.839 -13.772  -2.773
  565   HD23  LEU  66          HD23      LEU  66   9.126 -14.884  -2.261
  566    H    ARG  67           H        ARG  67  12.291 -14.151  -1.235
  567    HA   ARG  67           HA       ARG  67  10.443 -12.466   0.169
  568    HE   ARG  67           HE       ARG  67  12.093 -15.842   4.266
  569    HB2  ARG  67           HB2      ARG  67  10.722 -14.854   0.608
  570    HB3  ARG  67           HB3      ARG  67  12.370 -14.625   1.160
  571    HG2  ARG  67           HG2      ARG  67  10.189 -13.075   2.574
  572    HG3  ARG  67           HG3      ARG  67  10.204 -14.813   2.804
  573    HD2  ARG  67           HD2      ARG  67  12.594 -13.022   3.388
  574    HD3  ARG  67           HD3      ARG  67  11.421 -13.575   4.577
  575   HH11  ARG  67          HH21      ARG  67  14.415 -13.487   2.864
  576   HH12  ARG  67          HH22      ARG  67  15.598 -14.709   2.565
  577   HH21  ARG  67          HH11      ARG  67  13.798 -17.386   3.894
  578   HH22  ARG  67          HH12      ARG  67  15.277 -16.842   3.154
  579    H    THR  68           H        THR  68  14.025 -12.422  -0.015
  580    HA   THR  68           HA       THR  68  14.267 -10.583   2.210
  581    HB   THR  68           HB       THR  68  16.237 -11.061  -0.067
  582    HG1  THR  68           HG1      THR  68  15.908 -13.005   0.761
  583   HG21  THR  68          HG21      THR  68  17.917 -10.557   1.729
  584   HG22  THR  68          HG22      THR  68  16.903  -9.167   1.327
  585   HG23  THR  68          HG23      THR  68  16.588 -10.096   2.812
  586    H    MET  69           H        MET  69  13.878 -10.192  -1.339
  587    HA   MET  69           HA       MET  69  14.399  -7.313  -1.061
  588    HB2  MET  69           HB2      MET  69  14.050  -9.076  -3.506
  589    HB3  MET  69           HB3      MET  69  14.466  -7.367  -3.525
  590    HG2  MET  69           HG2      MET  69  16.118  -9.620  -2.317
  591    HG3  MET  69           HG3      MET  69  16.472  -8.745  -3.792
  592    HE1  MET  69           HE1      MET  69  17.475  -6.232  -3.873
  593    HE2  MET  69           HE2      MET  69  15.945  -5.720  -3.126
  594    HE3  MET  69           HE3      MET  69  17.501  -5.183  -2.449
  595    H    GLN  70           H        GLN  70  11.475  -9.249  -1.257
  596    HA   GLN  70           HA       GLN  70   9.887  -7.277  -2.547
  597    HB2  GLN  70           HB2      GLN  70   7.953  -8.231  -1.418
  598    HB3  GLN  70           HB3      GLN  70   8.966  -9.453  -2.179
  599    HG2  GLN  70           HG2      GLN  70   9.829 -10.176  -0.024
  600    HG3  GLN  70           HG3      GLN  70   9.044  -8.831   0.807
  601   HE21  GLN  70          HE22      GLN  70   7.978 -11.402  -1.554
  602   HE22  GLN  70          HE21      GLN  70   6.513 -11.786  -0.671
  603    H    GLY  71           H        GLY  71   8.988  -5.383  -1.950
  604    HA2  GLY  71           HA2      GLY  71   8.462  -3.558  -0.708
  605    HA3  GLY  71           HA3      GLY  71   8.868  -4.434   0.773
  606    H    PHE  72           H        PHE  72  11.660  -4.775  -1.062
  607    HA   PHE  72           HA       PHE  72  13.058  -2.901   0.591
  608    HD1  PHE  72           HD2      PHE  72  15.539  -4.050   1.491
  609    HD2  PHE  72           HD1      PHE  72  15.709  -2.921  -2.667
  610    HE1  PHE  72           HE2      PHE  72  17.784  -3.054   1.849
  611    HE2  PHE  72           HE1      PHE  72  17.952  -1.915  -2.301
  612    HZ   PHE  72           HZ       PHE  72  18.993  -1.982  -0.045
  613    HB2  PHE  72           HB2      PHE  72  14.002  -5.045  -0.237
  614    HB3  PHE  72           HB3      PHE  72  13.985  -4.411  -1.882
  615    HA   PRO  73           HA       PRO  73  12.741   0.550  -2.369
  616    HB2  PRO  73           HB2      PRO  73  14.319   2.393  -1.177
  617    HB3  PRO  73           HB3      PRO  73  12.734   1.905  -0.509
  618    HG2  PRO  73           HG2      PRO  73  15.478   0.903   0.325
  619    HG3  PRO  73           HG3      PRO  73  14.143   1.475   1.373
  620    HD2  PRO  73           HD2      PRO  73  14.595  -1.181   0.822
  621    HD3  PRO  73           HD3      PRO  73  12.956  -0.527   1.113
  622    H    PHE  74           H        PHE  74  13.746  -0.963  -3.866
  623    HA   PHE  74           HA       PHE  74  16.545  -1.302  -4.306
  624    HD1  PHE  74           HD2      PHE  74  17.158  -3.477  -5.669
  625    HD2  PHE  74           HD1      PHE  74  14.733  -1.288  -8.477
  626    HE1  PHE  74           HE2      PHE  74  18.363  -4.556  -7.555
  627    HE2  PHE  74           HE1      PHE  74  15.937  -2.363 -10.356
  628    HZ   PHE  74           HZ       PHE  74  17.718  -4.033  -9.901
  629    HB2  PHE  74           HB2      PHE  74  14.722  -2.630  -5.244
  630    HB3  PHE  74           HB3      PHE  74  14.162  -1.263  -6.202
  631    H    TYR  75           H        TYR  75  14.243   1.173  -5.221
  632    HA   TYR  75           HA       TYR  75  16.247   3.225  -5.465
  633    HD1  TYR  75           HD2      TYR  75  17.593   4.508  -7.468
  634    HD2  TYR  75           HD1      TYR  75  15.954   0.724  -8.731
  635    HE1  TYR  75           HE2      TYR  75  19.798   3.868  -8.391
  636    HE2  TYR  75           HE1      TYR  75  18.158   0.059  -9.633
  637    HH   TYR  75           HH       TYR  75  20.388   0.649  -9.882
  638    HB2  TYR  75           HB2      TYR  75  14.486   2.449  -7.832
  639    HB3  TYR  75           HB3      TYR  75  15.113   4.080  -7.636
  640    H    ASP  76           H        ASP  76  14.233   5.150  -6.332
  641    HA   ASP  76           HA       ASP  76  12.974   5.642  -3.858
  642    HB2  ASP  76           HB2      ASP  76  13.782   7.315  -5.538
  643    HB3  ASP  76           HB3      ASP  76  12.404   6.908  -6.562
  644    H    LYS  77           H        LYS  77  12.037   3.049  -5.149
  645    HA   LYS  77           HA       LYS  77   9.236   3.426  -4.514
  646    HB2  LYS  77           HB2      LYS  77  10.116   2.054  -7.102
  647    HB3  LYS  77           HB3      LYS  77   8.530   1.857  -6.360
  648    HG2  LYS  77           HG2      LYS  77   8.178   4.346  -6.551
  649    HG3  LYS  77           HG3      LYS  77   9.687   4.433  -7.486
  650    HD2  LYS  77           HD2      LYS  77   8.728   2.784  -9.111
  651    HD3  LYS  77           HD3      LYS  77   7.208   2.797  -8.222
  652    HE2  LYS  77           HE2      LYS  77   8.498   5.244  -9.528
  653    HE3  LYS  77           HE3      LYS  77   7.232   4.259 -10.266
  654    HZ1  LYS  77           HZ1      LYS  77   5.759   4.878  -8.439
  655    HZ2  LYS  77           HZ2      LYS  77   6.920   5.817  -7.765
  656    HZ3  LYS  77           HZ3      LYS  77   6.298   6.201  -9.219
  657    HA   PRO  78           HA       PRO  78  10.497  -0.410  -2.489
  658    HB2  PRO  78           HB2      PRO  78   8.080  -1.314  -1.582
  659    HB3  PRO  78           HB3      PRO  78   8.946   0.063  -0.834
  660    HG2  PRO  78           HG2      PRO  78   6.679   0.149  -2.842
  661    HG3  PRO  78           HG3      PRO  78   6.872   1.108  -1.342
  662    HD2  PRO  78           HD2      PRO  78   7.543   2.070  -3.824
  663    HD3  PRO  78           HD3      PRO  78   8.439   2.539  -2.349
  664    H    MET  79           H        MET  79  10.858  -2.366  -3.427
  665    HA   MET  79           HA       MET  79   9.760  -3.102  -5.967
  666    HB2  MET  79           HB2      MET  79  11.211  -4.696  -3.806
  667    HB3  MET  79           HB3      MET  79  10.872  -5.328  -5.425
  668    HG2  MET  79           HG2      MET  79  12.447  -2.783  -4.913
  669    HG3  MET  79           HG3      MET  79  13.183  -4.370  -5.056
  670    HE1  MET  79           HE1      MET  79  13.918  -4.758  -8.609
  671    HE2  MET  79           HE2      MET  79  14.495  -4.719  -6.928
  672    HE3  MET  79           HE3      MET  79  13.177  -5.820  -7.387
  673    H    GLN  80           H        GLN  80   8.327  -4.816  -6.500
  674    HA   GLN  80           HA       GLN  80   6.832  -6.153  -4.309
  675    HB2  GLN  80           HB2      GLN  80   5.711  -4.932  -6.869
  676    HB3  GLN  80           HB3      GLN  80   4.813  -6.037  -5.827
  677    HG2  GLN  80           HG2      GLN  80   5.870  -3.306  -4.944
  678    HG3  GLN  80           HG3      GLN  80   4.248  -3.608  -5.541
  679   HE21  GLN  80          HE22      GLN  80   6.475  -4.223  -2.813
  680   HE22  GLN  80          HE21      GLN  80   5.217  -4.697  -1.686
  681    H    ILE  81           H        ILE  81   6.772  -8.390  -4.717
  682    HA   ILE  81           HA       ILE  81   7.941  -9.320  -7.261
  683    HB   ILE  81           HB       ILE  81   9.028 -10.245  -4.580
  684   HG12  ILE  81          HG12      ILE  81  10.118  -8.000  -6.303
  685   HG13  ILE  81          HG13      ILE  81   9.657  -7.973  -4.591
  686   HG21  ILE  81          HG21      ILE  81   9.297 -11.745  -6.610
  687   HG22  ILE  81          HG22      ILE  81  10.235 -10.453  -7.376
  688   HG23  ILE  81          HG23      ILE  81  10.803 -11.240  -5.887
  689   HD11  ILE  81          HD11      ILE  81  11.568  -9.512  -4.095
  690   HD12  ILE  81          HD12      ILE  81  12.099  -9.309  -5.784
  691   HD13  ILE  81          HD13      ILE  81  12.027  -7.908  -4.711
  692    H    ALA  82           H        ALA  82   7.325 -11.414  -7.791
  693    HA   ALA  82           HA       ALA  82   6.020 -13.152  -5.857
  694    HB1  ALA  82           HB1      ALA  82   4.538 -12.469  -8.435
  695    HB2  ALA  82           HB2      ALA  82   4.010 -13.557  -7.146
  696    HB3  ALA  82           HB3      ALA  82   4.102 -11.815  -6.841
  697    H    TYR  83           H        TYR  83   5.480 -15.292  -7.238
  698    HA   TYR  83           HA       TYR  83   7.899 -16.164  -8.576
  699    HD1  TYR  83           HD1      TYR  83   4.451 -16.696  -6.332
  700    HD2  TYR  83           HD2      TYR  83   4.614 -18.487 -10.260
  701    HE1  TYR  83           HE1      TYR  83   1.986 -16.805  -6.378
  702    HE2  TYR  83           HE2      TYR  83   2.151 -18.655 -10.287
  703    HH   TYR  83           HH       TYR  83   0.103 -17.491  -7.563
  704    HB2  TYR  83           HB2      TYR  83   6.624 -18.221  -8.977
  705    HB3  TYR  83           HB3      TYR  83   6.580 -17.735  -7.292
  706    H    SER  84           H        SER  84   8.092 -16.696 -10.839
  707    HA   SER  84           HA       SER  84   7.073 -14.751 -12.576
  708    HG   SER  84           HG       SER  84   9.635 -14.968 -12.994
  709    HB2  SER  84           HB2      SER  84   8.324 -17.453 -13.223
  710    HB3  SER  84           HB3      SER  84   8.257 -16.043 -14.303
  711    H    LYS  85           H        LYS  85   5.751 -14.891 -14.404
  712    HA   LYS  85           HA       LYS  85   3.854 -17.113 -14.726
  713    HB2  LYS  85           HB2      LYS  85   3.092 -14.189 -14.227
  714    HB3  LYS  85           HB3      LYS  85   2.000 -15.375 -14.952
  715    HG2  LYS  85           HG2      LYS  85   2.055 -16.760 -12.946
  716    HG3  LYS  85           HG3      LYS  85   3.252 -15.697 -12.189
  717    HD2  LYS  85           HD2      LYS  85   1.690 -13.834 -12.159
  718    HD3  LYS  85           HD3      LYS  85   0.438 -14.805 -12.949
  719    HE2  LYS  85           HE2      LYS  85   1.775 -15.652 -10.340
  720    HE3  LYS  85           HE3      LYS  85   0.387 -14.559 -10.348
  721    HZ1  LYS  85           HZ1      LYS  85   0.306 -17.248 -11.581
  722    HZ2  LYS  85           HZ2      LYS  85  -0.186 -16.931 -10.058
  723    HZ3  LYS  85           HZ3      LYS  85  -0.957 -16.241 -11.327
  724    H    SER  86           H        SER  86   3.006 -17.066 -16.923
  725    HA   SER  86           HA       SER  86   5.001 -16.688 -18.763
  726    HG   SER  86           HG       SER  86   3.730 -18.986 -18.918
  727    HB2  SER  86           HB2      SER  86   2.025 -16.755 -19.378
  728    HB3  SER  86           HB3      SER  86   3.347 -17.341 -20.402
  729    H    ASP  87           H        ASP  87   5.540 -15.210 -20.341
  730    HA   ASP  87           HA       ASP  87   3.823 -12.996 -21.071
  731    HB2  ASP  87           HB2      ASP  87   5.017 -11.907 -19.227
  732    HB3  ASP  87           HB3      ASP  87   6.567 -12.506 -19.817
  733    H    SER  88           H        SER  88   4.376 -12.333 -23.205
  734    HA   SER  88           HA       SER  88   5.313 -14.305 -24.861
  735    HG   SER  88           HG       SER  88   3.131 -13.067 -25.645
  736    HB2  SER  88           HB2      SER  88   5.376 -11.328 -25.464
  737    HB3  SER  88           HB3      SER  88   5.123 -12.656 -26.612
  738    H    ASP  89           H        ASP  89   7.330 -11.754 -23.288
  739    HA   ASP  89           HA       ASP  89   9.502 -12.221 -25.192
  740    HB2  ASP  89           HB2      ASP  89   9.073  -9.995 -24.139
  741    HB3  ASP  89           HB3      ASP  89   9.577 -10.675 -22.583
  742    H    ILE  90           H        ILE  90   8.703 -13.344 -21.896
  743    HA   ILE  90           HA       ILE  90  11.289 -14.705 -21.657
  744    HB   ILE  90           HB       ILE  90  10.457 -15.833 -19.715
  745   HG12  ILE  90          HG12      ILE  90   7.827 -14.355 -20.052
  746   HG13  ILE  90          HG13      ILE  90   8.056 -16.089 -20.318
  747   HG21  ILE  90          HG21      ILE  90  10.381 -13.869 -18.288
  748   HG22  ILE  90          HG22      ILE  90  11.480 -13.586 -19.634
  749   HG23  ILE  90          HG23      ILE  90   9.858 -12.852 -19.650
  750   HD11  ILE  90          HD11      ILE  90   8.308 -14.603 -17.679
  751   HD12  ILE  90          HD12      ILE  90   7.110 -15.818 -18.146
  752   HD13  ILE  90          HD13      ILE  90   8.800 -16.300 -17.919
  753    H    VAL  91           H        VAL  91   8.012 -15.510 -22.814
  754    HA   VAL  91           HA       VAL  91   8.551 -18.257 -23.269
  755    HB   VAL  91           HB       VAL  91   6.611 -16.281 -24.507
  756   HG11  VAL  91          HG11      VAL  91   6.805 -19.270 -25.082
  757   HG12  VAL  91          HG12      VAL  91   5.405 -18.245 -25.473
  758   HG13  VAL  91          HG13      VAL  91   6.956 -17.937 -26.254
  759   HG21  VAL  91          HG21      VAL  91   4.959 -17.522 -23.193
  760   HG22  VAL  91          HG22      VAL  91   6.197 -18.683 -22.665
  761   HG23  VAL  91          HG23      VAL  91   6.261 -16.999 -22.121
  762    H    ALA  92           H        ALA  92   9.029 -15.339 -25.382
  763    HA   ALA  92           HA       ALA  92  10.240 -16.724 -27.519
  764    HB1  ALA  92           HB1      ALA  92  11.158 -14.549 -28.161
  765    HB2  ALA  92           HB2      ALA  92   9.472 -14.378 -27.648
  766    HB3  ALA  92           HB3      ALA  92  10.792 -13.885 -26.559
  767    H    LYS  93           H        LYS  93  11.661 -15.553 -24.446
  768    HA   LYS  93           HA       LYS  93  14.376 -16.056 -25.129
  769    HB2  LYS  93           HB2      LYS  93  13.005 -15.040 -22.887
  770    HB3  LYS  93           HB3      LYS  93  13.699 -16.516 -22.281
  771    HG2  LYS  93           HG2      LYS  93  15.281 -14.822 -21.829
  772    HG3  LYS  93           HG3      LYS  93  15.950 -15.752 -23.167
  773    HD2  LYS  93           HD2      LYS  93  16.303 -13.350 -23.494
  774    HD3  LYS  93           HD3      LYS  93  15.239 -13.977 -24.758
  775    HE2  LYS  93           HE2      LYS  93  13.257 -13.125 -23.535
  776    HE3  LYS  93           HE3      LYS  93  14.291 -12.559 -22.222
  777    HZ1  LYS  93           HZ1      LYS  93  15.267 -10.970 -23.764
  778    HZ2  LYS  93           HZ2      LYS  93  14.339 -11.537 -25.001
  779    HZ3  LYS  93           HZ3      LYS  93  13.621 -10.823 -23.721
  780    H    ILE  94           H        ILE  94  11.944 -18.248 -23.567
  781    HA   ILE  94           HA       ILE  94  13.948 -20.352 -23.382
  782    HB   ILE  94           HB       ILE  94  12.179 -21.833 -22.686
  783   HG12  ILE  94          HG12      ILE  94  10.242 -19.540 -23.112
  784   HG13  ILE  94          HG13      ILE  94  10.328 -20.984 -24.125
  785   HG21  ILE  94          HG21      ILE  94  11.935 -19.134 -21.280
  786   HG22  ILE  94          HG22      ILE  94  11.722 -20.746 -20.569
  787   HG23  ILE  94          HG23      ILE  94  13.318 -20.237 -21.114
  788   HD11  ILE  94          HD11      ILE  94   9.760 -22.372 -22.115
  789   HD12  ILE  94          HD12      ILE  94   9.509 -20.864 -21.197
  790   HD13  ILE  94          HD13      ILE  94   8.491 -21.228 -22.597
  791    H    LYS  95           H        LYS  95  11.590 -19.382 -25.815
  792    HA   LYS  95           HA       LYS  95  12.127 -21.658 -27.599
  793    HB2  LYS  95           HB2      LYS  95  10.827 -18.921 -27.958
  794    HB3  LYS  95           HB3      LYS  95  10.949 -20.114 -29.251
  795    HG2  LYS  95           HG2      LYS  95   9.564 -21.702 -28.034
  796    HG3  LYS  95           HG3      LYS  95   9.515 -20.650 -26.621
  797    HD2  LYS  95           HD2      LYS  95   7.433 -20.393 -27.827
  798    HD3  LYS  95           HD3      LYS  95   8.362 -18.900 -27.910
  799    HE2  LYS  95           HE2      LYS  95   7.371 -19.265 -30.056
  800    HE3  LYS  95           HE3      LYS  95   9.111 -19.482 -30.216
  801    HZ1  LYS  95           HZ1      LYS  95   7.115 -21.674 -30.005
  802    HZ2  LYS  95           HZ2      LYS  95   7.862 -21.210 -31.372
  803    HZ3  LYS  95           HZ3      LYS  95   8.726 -21.901 -30.177
  804    H    GLY  96           H        GLY  96  12.840 -20.639 -29.989
  805    HA2  GLY  96           HA2      GLY  96  15.501 -19.378 -29.618
  806    HA3  GLY  96           HA3      GLY  96  14.824 -20.058 -31.102
  807    H    THR  97           H        THR  97  12.213 -18.331 -30.160
  808    HA   THR  97           HA       THR  97  12.614 -16.490 -32.244
  809    HB   THR  97           HB       THR  97  10.314 -15.654 -31.251
  810    HG1  THR  97           HG1      THR  97   9.413 -17.004 -29.826
  811   HG21  THR  97          HG21      THR  97  10.707 -18.503 -32.286
  812   HG22  THR  97          HG22      THR  97   9.189 -17.576 -32.314
  813   HG23  THR  97          HG23      THR  97  10.567 -17.041 -33.286
  814    H    PHE  98           H        PHE  98  13.726 -16.109 -29.011
  815    HA   PHE  98           HA       PHE  98  13.503 -13.255 -28.877
  816    HD1  PHE  98           HD2      PHE  98  15.110 -17.023 -27.578
  817    HD2  PHE  98           HD1      PHE  98  17.500 -13.431 -27.616
  818    HE1  PHE  98           HE2      PHE  98  17.162 -18.392 -27.497
  819    HE2  PHE  98           HE1      PHE  98  19.557 -14.809 -27.523
  820    HZ   PHE  98           HZ       PHE  98  19.397 -17.293 -27.453
  821    HB2  PHE  98           HB2      PHE  98  15.141 -13.301 -27.204
  822    HB3  PHE  98           HB3      PHE  98  14.149 -14.715 -26.964
  823    H    LYS  99           H        LYS  99  15.441 -15.344 -30.913
  824    HA   LYS  99           HA       LYS  99  16.750 -12.942 -32.076
  825    HB2  LYS  99           HB2      LYS  99  18.867 -14.118 -32.313
  826    HB3  LYS  99           HB3      LYS  99  18.423 -13.917 -30.619
  827    HG2  LYS  99           HG2      LYS  99  17.699 -16.287 -30.504
  828    HG3  LYS  99           HG3      LYS  99  18.096 -16.500 -32.221
  829    HD2  LYS  99           HD2      LYS  99  20.460 -15.975 -31.766
  830    HD3  LYS  99           HD3      LYS  99  20.087 -15.745 -30.044
  831    HE2  LYS  99           HE2      LYS  99  19.299 -18.095 -29.899
  832    HE3  LYS  99           HE3      LYS  99  19.638 -18.323 -31.618
  833    HZ1  LYS  99           HZ1      LYS  99  21.984 -17.944 -31.152
  834    HZ2  LYS  99           HZ2      LYS  99  21.685 -17.719 -29.559
  835    HZ3  LYS  99           HZ3      LYS  99  21.429 -19.175 -30.244
  836    H    GLU 100           H        GLU 100  15.573 -16.295 -32.554
  837    HA   GLU 100           HA       GLU 100  15.956 -16.240 -35.421
  838    HB2  GLU 100           HB2      GLU 100  15.740 -18.317 -34.070
  839    HB3  GLU 100           HB3      GLU 100  14.088 -17.877 -33.647
  840    HG2  GLU 100           HG2      GLU 100  14.196 -19.606 -35.397
  841    HG3  GLU 100           HG3      GLU 100  13.348 -18.169 -35.934
  842    H    ARG 101           H        ARG 101  14.202 -16.031 -36.963
  843    HA   ARG 101           HA       ARG 101  12.582 -13.678 -36.608
  844    HE   ARG 101           HE       ARG 101  14.743 -16.384 -39.062
  845    HB2  ARG 101           HB2      ARG 101  12.591 -15.925 -38.672
  846    HB3  ARG 101           HB3      ARG 101  11.575 -14.498 -38.819
  847    HG2  ARG 101           HG2      ARG 101  13.281 -13.081 -39.353
  848    HG3  ARG 101           HG3      ARG 101  14.485 -13.918 -38.379
  849    HD2  ARG 101           HD2      ARG 101  13.396 -15.013 -41.002
  850    HD3  ARG 101           HD3      ARG 101  14.880 -14.053 -40.840
  851   HH11  ARG 101          HH21      ARG 101  15.968 -15.261 -42.212
  852   HH12  ARG 101          HH22      ARG 101  17.182 -16.484 -42.288
  853   HH21  ARG 101          HH11      ARG 101  16.240 -17.867 -39.122
  854   HH22  ARG 101          HH12      ARG 101  17.335 -18.084 -40.473
  855    HA   PRO 102           HA       PRO 102   8.868 -15.307 -34.727
  856    HB2  PRO 102           HB2      PRO 102   7.391 -13.976 -37.005
  857    HB3  PRO 102           HB3      PRO 102   7.027 -13.933 -35.252
  858    HG2  PRO 102           HG2      PRO 102   8.270 -11.837 -36.440
  859    HG3  PRO 102           HG3      PRO 102   8.830 -12.422 -34.840
  860    HD2  PRO 102           HD2      PRO 102  10.025 -12.967 -37.563
  861    HD3  PRO 102           HD3      PRO 102  10.840 -12.582 -36.016
  862    H    LYS 103           H        LYS 103   9.196 -15.603 -38.253
  863    HA   LYS 103           HA       LYS 103   8.811 -18.456 -38.120
  864    HB2  LYS 103           HB2      LYS 103   7.114 -18.583 -39.901
  865    HB3  LYS 103           HB3      LYS 103   6.468 -17.823 -38.451
  866    HG2  LYS 103           HG2      LYS 103   6.740 -15.575 -39.510
  867    HG3  LYS 103           HG3      LYS 103   7.365 -16.355 -40.976
  868    HD2  LYS 103           HD2      LYS 103   5.224 -17.576 -41.243
  869    HD3  LYS 103           HD3      LYS 103   4.598 -16.796 -39.773
  870    HE2  LYS 103           HE2      LYS 103   4.898 -14.567 -40.832
  871    HE3  LYS 103           HE3      LYS 103   5.521 -15.341 -42.294
  872    HZ1  LYS 103           HZ1      LYS 103   3.185 -14.789 -42.512
  873    HZ2  LYS 103           HZ2      LYS 103   3.357 -16.407 -42.571
  874    HZ3  LYS 103           HZ3      LYS 103   2.782 -15.690 -41.218
  875    H    LYS 104           H        LYS 104   9.631 -19.443 -40.126
  876    HA   LYS 104           HA       LYS 104  10.716 -17.760 -42.210
  877    HB2  LYS 104           HB2      LYS 104  12.603 -17.729 -40.608
  878    HB3  LYS 104           HB3      LYS 104  12.527 -19.484 -40.450
  879    HG2  LYS 104           HG2      LYS 104  14.388 -18.815 -41.869
  880    HG3  LYS 104           HG3      LYS 104  13.226 -19.773 -42.781
  881    HD2  LYS 104           HD2      LYS 104  12.320 -17.710 -43.822
  882    HD3  LYS 104           HD3      LYS 104  13.448 -16.727 -42.863
  883    HE2  LYS 104           HE2      LYS 104  15.362 -17.850 -43.950
  884    HE3  LYS 104           HE3      LYS 104  14.262 -18.908 -44.840
  885    HZ1  LYS 104           HZ1      LYS 104  15.012 -17.069 -46.204
  886    HZ2  LYS 104           HZ2      LYS 104  13.402 -16.962 -45.994
  887    HZ3  LYS 104           HZ3      LYS 104  14.406 -15.965 -45.172
  Start of MODEL   19
    1    HA   MET   1           HA       MET   1   0.213 -17.980   1.835
    2    H1   MET   1           H1       MET   1  -0.437 -15.771   3.660
    3    H2   MET   1           H2       MET   1  -1.387 -17.085   3.386
    4    H3   MET   1           H3       MET   1   0.077 -17.255   4.101
    5    HB2  MET   1           HB2      MET   1  -0.703 -15.130   1.235
    6    HB3  MET   1           HB3      MET   1   0.079 -16.171   0.053
    7    HG2  MET   1           HG2      MET   1  -2.560 -16.725   1.449
    8    HG3  MET   1           HG3      MET   1  -2.339 -16.230  -0.219
    9    HE1  MET   1           HE1      MET   1  -1.555 -17.750  -2.176
   10    HE2  MET   1           HE2      MET   1   0.011 -18.045  -1.384
   11    HE3  MET   1           HE3      MET   1  -0.950 -19.409  -1.987
   12    H    GLU   2           H        GLU   2   2.247 -17.876   0.801
   13    HA   GLU   2           HA       GLU   2   4.077 -15.692   1.320
   14    HB2  GLU   2           HB2      GLU   2   5.829 -17.090   2.302
   15    HB3  GLU   2           HB3      GLU   2   4.422 -17.015   3.356
   16    HG2  GLU   2           HG2      GLU   2   3.705 -19.276   2.521
   17    HG3  GLU   2           HG3      GLU   2   5.166 -19.352   1.539
   18    H    MET   3           H        MET   3   6.154 -16.143   0.037
   19    HA   MET   3           HA       MET   3   5.487 -17.083  -2.593
   20    HB2  MET   3           HB2      MET   3   7.854 -16.625  -3.063
   21    HB3  MET   3           HB3      MET   3   7.053 -15.253  -2.321
   22    HG2  MET   3           HG2      MET   3   8.905 -17.217  -0.904
   23    HG3  MET   3           HG3      MET   3   9.383 -15.653  -1.508
   24    HE1  MET   3           HE1      MET   3   8.434 -13.259  -0.431
   25    HE2  MET   3           HE2      MET   3   6.747 -13.816  -0.518
   26    HE3  MET   3           HE3      MET   3   7.412 -13.217   1.013
   27    H    LEU   4           H        LEU   4   6.510 -18.826  -3.765
   28    HA   LEU   4           HA       LEU   4   7.308 -21.121  -2.047
   29    HG   LEU   4           HG       LEU   4   4.170 -20.432  -2.795
   30    HB2  LEU   4           HB2      LEU   4   5.650 -21.210  -4.590
   31    HB3  LEU   4           HB3      LEU   4   6.159 -22.588  -3.626
   32   HD11  LEU   4          HD11      LEU   4   2.535 -22.249  -2.891
   33   HD12  LEU   4          HD12      LEU   4   3.351 -22.082  -4.451
   34   HD13  LEU   4          HD13      LEU   4   3.804 -23.406  -3.359
   35   HD21  LEU   4          HD21      LEU   4   5.353 -21.145  -0.784
   36   HD22  LEU   4          HD22      LEU   4   3.744 -21.857  -0.794
   37   HD23  LEU   4          HD23      LEU   4   5.153 -22.857  -1.223
   38    HA   PRO   5           HA       PRO   5  10.938 -21.172  -4.590
   39    HB2  PRO   5           HB2      PRO   5  10.687 -24.178  -4.530
   40    HB3  PRO   5           HB3      PRO   5  12.120 -23.148  -4.205
   41    HG2  PRO   5           HG2      PRO   5  10.737 -24.223  -2.154
   42    HG3  PRO   5           HG3      PRO   5  11.312 -22.525  -2.080
   43    HD2  PRO   5           HD2      PRO   5   8.536 -23.538  -2.739
   44    HD3  PRO   5           HD3      PRO   5   9.040 -22.176  -1.691
   45    H    ASN   6           H        ASN   6  11.256 -20.825  -6.638
   46    HA   ASN   6           HA       ASN   6  10.706 -22.725  -8.719
   47    HB2  ASN   6           HB2      ASN   6   8.503 -21.531  -8.756
   48    HB3  ASN   6           HB3      ASN   6   9.348 -19.979  -8.828
   49   HD21  ASN   6          HD22      ASN   6   9.742 -19.178 -10.893
   50   HD22  ASN   6          HD21      ASN   6   9.770 -20.186 -12.343
   51    H    GLN   7           H        GLN   7  12.271 -22.206 -10.450
   52    HA   GLN   7           HA       GLN   7  14.508 -20.792  -9.409
   53    HB2  GLN   7           HB2      GLN   7  14.446 -22.831 -10.947
   54    HB3  GLN   7           HB3      GLN   7  14.161 -21.714 -12.290
   55    HG2  GLN   7           HG2      GLN   7  16.313 -20.597 -11.824
   56    HG3  GLN   7           HG3      GLN   7  16.546 -21.584 -10.381
   57   HE21  GLN   7          HE21      GLN   7  18.587 -21.565 -12.019
   58   HE22  GLN   7          HE22      GLN   7  18.715 -23.042 -12.966
   59    H    THR   8           H        THR   8  11.816 -19.486 -11.002
   60    HA   THR   8           HA       THR   8  13.304 -17.058 -11.866
   61    HB   THR   8           HB       THR   8  10.835 -18.274 -13.163
   62    HG1  THR   8           HG1      THR   8  12.637 -19.571 -13.555
   63   HG21  THR   8          HG21      THR   8  10.967 -15.856 -13.533
   64   HG22  THR   8          HG22      THR   8  12.644 -16.002 -14.077
   65   HG23  THR   8          HG23      THR   8  11.320 -16.741 -15.014
   66    H    ILE   9           H        ILE   9  12.304 -15.112 -11.331
   67    HA   ILE   9           HA       ILE   9   9.738 -15.203  -9.861
   68    HB   ILE   9           HB       ILE   9  10.454 -13.927  -8.070
   69   HG12  ILE   9          HG12      ILE   9  12.887 -13.174  -9.683
   70   HG13  ILE   9          HG13      ILE   9  11.585 -12.138  -9.129
   71   HG21  ILE   9          HG21      ILE   9  11.304 -16.263  -7.938
   72   HG22  ILE   9          HG22      ILE   9  12.878 -15.710  -8.555
   73   HG23  ILE   9          HG23      ILE   9  12.293 -15.137  -7.002
   74   HD11  ILE   9          HD11      ILE   9  13.496 -11.672  -7.785
   75   HD12  ILE   9          HD12      ILE   9  12.310 -12.510  -6.761
   76   HD13  ILE   9          HD13      ILE   9  13.728 -13.373  -7.363
   77    H    TYR  10           H        TYR  10   8.811 -12.987  -9.722
   78    HA   TYR  10           HA       TYR  10   9.127 -11.490 -12.282
   79    HD1  TYR  10           HD2      TYR  10   7.551 -10.310 -13.683
   80    HD2  TYR  10           HD1      TYR  10   4.549 -11.986 -11.067
   81    HE1  TYR  10           HE2      TYR  10   5.853  -8.812 -14.669
   82    HE2  TYR  10           HE1      TYR  10   2.849 -10.494 -12.047
   83    HH   TYR  10           HH       TYR  10   2.396  -8.880 -13.648
   84    HB2  TYR  10           HB2      TYR  10   7.284 -13.056 -12.451
   85    HB3  TYR  10           HB3      TYR  10   6.738 -12.683 -10.830
   86    H    ILE  11           H        ILE  11   9.104  -9.300 -11.975
   87    HA   ILE  11           HA       ILE  11   8.857  -8.248  -9.192
   88    HB   ILE  11           HB       ILE  11  10.876  -7.747 -11.417
   89   HG12  ILE  11          HG12      ILE  11  11.328  -8.525  -8.505
   90   HG13  ILE  11          HG13      ILE  11  11.202  -9.705  -9.810
   91   HG21  ILE  11          HG21      ILE  11  10.278  -5.538 -10.476
   92   HG22  ILE  11          HG22      ILE  11  10.607  -6.141  -8.837
   93   HG23  ILE  11          HG23      ILE  11  11.908  -5.991 -10.043
   94   HD11  ILE  11          HD11      ILE  11  13.511  -9.382  -9.336
   95   HD12  ILE  11          HD12      ILE  11  13.182  -8.644 -10.918
   96   HD13  ILE  11          HD13      ILE  11  13.385  -7.622  -9.473
   97    H    ASN  12           H        ASN  12   7.847  -6.265  -9.006
   98    HA   ASN  12           HA       ASN  12   6.793  -4.831 -11.347
   99    HB2  ASN  12           HB2      ASN  12   5.223  -6.723  -9.747
  100    HB3  ASN  12           HB3      ASN  12   4.634  -5.098  -9.462
  101   HD21  ASN  12          HD22      ASN  12   5.811  -7.048 -12.286
  102   HD22  ASN  12          HD21      ASN  12   4.519  -6.563 -13.363
  103    H    ASN  13           H        ASN  13   5.560  -2.864 -10.474
  104    HA   ASN  13           HA       ASN  13   5.824  -0.825  -9.631
  105    HB2  ASN  13           HB2      ASN  13   4.826  -2.041  -7.621
  106    HB3  ASN  13           HB3      ASN  13   6.459  -2.082  -6.948
  107   HD21  ASN  13          HD22      ASN  13   6.676  -0.442  -5.422
  108   HD22  ASN  13          HD21      ASN  13   5.903   1.130  -5.538
  109    H    LEU  14           H        LEU  14   8.116  -2.041 -10.839
  110    HA   LEU  14           HA       LEU  14  10.568  -1.239  -9.473
  111    HG   LEU  14           HG       LEU  14  12.266  -2.892 -10.519
  112    HB2  LEU  14           HB2      LEU  14   9.974  -3.040 -11.386
  113    HB3  LEU  14           HB3      LEU  14  10.248  -1.669 -12.447
  114   HD11  LEU  14          HD11      LEU  14  13.258  -3.840 -12.503
  115   HD12  LEU  14          HD12      LEU  14  11.570  -4.313 -12.443
  116   HD13  LEU  14          HD13      LEU  14  12.084  -3.024 -13.555
  117   HD21  LEU  14          HD21      LEU  14  13.944  -1.546 -11.838
  118   HD22  LEU  14          HD22      LEU  14  12.594  -0.640 -12.547
  119   HD23  LEU  14          HD23      LEU  14  12.908  -0.580 -10.794
  120    H    ASN  15           H        ASN  15  11.649   0.825  -9.912
  121    HA   ASN  15           HA       ASN  15   9.918   2.981 -10.761
  122    HB2  ASN  15           HB2      ASN  15  11.744   3.273  -9.104
  123    HB3  ASN  15           HB3      ASN  15  12.937   3.056 -10.390
  124   HD21  ASN  15          HD22      ASN  15  12.343   5.479  -8.665
  125   HD22  ASN  15          HD21      ASN  15  11.937   6.749  -9.788
  126    H    GLU  16           H        GLU  16   9.304   3.220 -12.796
  127    HA   GLU  16           HA       GLU  16  10.331   1.919 -15.006
  128    HB2  GLU  16           HB2      GLU  16   8.896   3.412 -16.323
  129    HB3  GLU  16           HB3      GLU  16   8.072   2.795 -14.888
  130    HG2  GLU  16           HG2      GLU  16   8.504   4.975 -13.729
  131    HG3  GLU  16           HG3      GLU  16   9.309   5.575 -15.179
  132    H    LYS  17           H        LYS  17  11.634   4.929 -13.640
  133    HA   LYS  17           HA       LYS  17  12.705   5.911 -16.081
  134    HB2  LYS  17           HB2      LYS  17  13.936   7.439 -14.852
  135    HB3  LYS  17           HB3      LYS  17  12.475   7.169 -13.906
  136    HG2  LYS  17           HG2      LYS  17  13.861   5.539 -12.472
  137    HG3  LYS  17           HG3      LYS  17  15.283   6.093 -13.373
  138    HD2  LYS  17           HD2      LYS  17  14.841   8.415 -12.694
  139    HD3  LYS  17           HD3      LYS  17  13.407   7.887 -11.785
  140    HE2  LYS  17           HE2      LYS  17  14.821   6.479 -10.325
  141    HE3  LYS  17           HE3      LYS  17  16.257   6.911 -11.263
  142    HZ1  LYS  17           HZ1      LYS  17  16.091   8.236  -9.251
  143    HZ2  LYS  17           HZ2      LYS  17  15.967   9.208 -10.549
  144    HZ3  LYS  17           HZ3      LYS  17  14.635   8.829  -9.683
  145    H    ILE  18           H        ILE  18  13.759   3.310 -13.990
  146    HA   ILE  18           HA       ILE  18  16.532   3.322 -14.618
  147    HB   ILE  18           HB       ILE  18  14.680   1.093 -13.672
  148   HG12  ILE  18          HG12      ILE  18  14.554   2.945 -12.110
  149   HG13  ILE  18          HG13      ILE  18  15.493   1.660 -11.395
  150   HG21  ILE  18          HG21      ILE  18  16.779   0.138 -14.454
  151   HG22  ILE  18          HG22      ILE  18  17.705   1.271 -13.448
  152   HG23  ILE  18          HG23      ILE  18  16.677   0.037 -12.696
  153   HD11  ILE  18          HD11      ILE  18  17.589   2.944 -11.910
  154   HD12  ILE  18          HD12      ILE  18  16.600   4.238 -12.616
  155   HD13  ILE  18          HD13      ILE  18  16.451   3.858 -10.903
  156    H    LYS  19           H        LYS  19  17.653   2.564 -16.288
  157    HA   LYS  19           HA       LYS  19  16.260   1.642 -18.710
  158    HB2  LYS  19           HB2      LYS  19  19.223   1.994 -18.066
  159    HB3  LYS  19           HB3      LYS  19  18.566   1.727 -19.682
  160    HG2  LYS  19           HG2      LYS  19  17.468   3.877 -19.702
  161    HG3  LYS  19           HG3      LYS  19  17.772   4.126 -17.987
  162    HD2  LYS  19           HD2      LYS  19  20.311   3.970 -18.599
  163    HD3  LYS  19           HD3      LYS  19  19.769   4.195 -20.263
  164    HE2  LYS  19           HE2      LYS  19  20.396   6.339 -19.338
  165    HE3  LYS  19           HE3      LYS  19  18.645   6.330 -19.574
  166    HZ1  LYS  19           HZ1      LYS  19  19.329   7.251 -17.410
  167    HZ2  LYS  19           HZ2      LYS  19  18.390   5.923 -17.202
  168    HZ3  LYS  19           HZ3      LYS  19  19.995   5.811 -16.968
  169    H    LYS  20           H        LYS  20  17.175  -0.360 -19.877
  170    HA   LYS  20           HA       LYS  20  16.919  -2.683 -18.269
  171    HB2  LYS  20           HB2      LYS  20  16.569  -2.649 -20.732
  172    HB3  LYS  20           HB3      LYS  20  18.311  -2.379 -20.978
  173    HG2  LYS  20           HG2      LYS  20  18.824  -4.560 -19.933
  174    HG3  LYS  20           HG3      LYS  20  17.109  -4.804 -19.567
  175    HD2  LYS  20           HD2      LYS  20  16.605  -4.815 -21.988
  176    HD3  LYS  20           HD3      LYS  20  18.320  -4.583 -22.366
  177    HE2  LYS  20           HE2      LYS  20  18.927  -6.727 -21.655
  178    HE3  LYS  20           HE3      LYS  20  17.564  -6.855 -20.537
  179    HZ1  LYS  20           HZ1      LYS  20  16.084  -7.180 -22.343
  180    HZ2  LYS  20           HZ2      LYS  20  17.273  -6.984 -23.476
  181    HZ3  LYS  20           HZ3      LYS  20  17.292  -8.278 -22.480
  182    H    GLU  21           H        GLU  21  19.875  -1.054 -19.508
  183    HA   GLU  21           HA       GLU  21  21.715  -2.929 -18.456
  184    HB2  GLU  21           HB2      GLU  21  22.292  -1.345 -20.171
  185    HB3  GLU  21           HB3      GLU  21  21.933   0.034 -19.123
  186    HG2  GLU  21           HG2      GLU  21  23.814  -0.482 -17.669
  187    HG3  GLU  21           HG3      GLU  21  24.127  -1.997 -18.529
  188    H    GLU  22           H        GLU  22  20.288   0.030 -17.018
  189    HA   GLU  22           HA       GLU  22  21.881  -0.008 -14.645
  190    HB2  GLU  22           HB2      GLU  22  19.173   1.208 -15.272
  191    HB3  GLU  22           HB3      GLU  22  20.089   1.545 -13.792
  192    HG2  GLU  22           HG2      GLU  22  21.912   2.527 -15.053
  193    HG3  GLU  22           HG3      GLU  22  21.181   2.075 -16.591
  194    H    LEU  23           H        LEU  23  18.641  -1.324 -15.436
  195    HA   LEU  23           HA       LEU  23  18.028  -2.495 -12.916
  196    HG   LEU  23           HG       LEU  23  15.279  -4.266 -15.057
  197    HB2  LEU  23           HB2      LEU  23  16.332  -2.237 -14.560
  198    HB3  LEU  23           HB3      LEU  23  17.255  -3.039 -15.810
  199   HD11  LEU  23          HD11      LEU  23  17.696  -5.942 -14.392
  200   HD12  LEU  23          HD12      LEU  23  16.137  -6.441 -15.039
  201   HD13  LEU  23          HD13      LEU  23  17.237  -5.478 -16.042
  202   HD21  LEU  23          HD21      LEU  23  16.777  -4.700 -12.441
  203   HD22  LEU  23          HD22      LEU  23  15.431  -3.584 -12.653
  204   HD23  LEU  23          HD23      LEU  23  15.177  -5.333 -12.877
  205    H    LYS  24           H        LYS  24  19.748  -3.868 -15.782
  206    HA   LYS  24           HA       LYS  24  20.156  -6.410 -14.648
  207    HB2  LYS  24           HB2      LYS  24  20.413  -5.776 -17.063
  208    HB3  LYS  24           HB3      LYS  24  21.934  -4.966 -16.666
  209    HG2  LYS  24           HG2      LYS  24  22.852  -7.162 -15.859
  210    HG3  LYS  24           HG3      LYS  24  21.302  -7.923 -16.241
  211    HD2  LYS  24           HD2      LYS  24  22.844  -8.431 -18.000
  212    HD3  LYS  24           HD3      LYS  24  21.617  -7.331 -18.644
  213    HE2  LYS  24           HE2      LYS  24  23.196  -5.425 -18.401
  214    HE3  LYS  24           HE3      LYS  24  24.400  -6.504 -17.685
  215    HZ1  LYS  24           HZ1      LYS  24  23.371  -6.713 -20.458
  216    HZ2  LYS  24           HZ2      LYS  24  24.831  -6.134 -20.028
  217    HZ3  LYS  24           HZ3      LYS  24  24.486  -7.705 -19.789
  218    H    LYS  25           H        LYS  25  22.365  -3.562 -14.652
  219    HA   LYS  25           HA       LYS  25  24.408  -4.818 -13.098
  220    HB2  LYS  25           HB2      LYS  25  23.610  -1.889 -13.427
  221    HB3  LYS  25           HB3      LYS  25  25.033  -2.402 -12.532
  222    HG2  LYS  25           HG2      LYS  25  24.555  -3.001 -15.481
  223    HG3  LYS  25           HG3      LYS  25  25.499  -1.651 -14.878
  224    HD2  LYS  25           HD2      LYS  25  26.119  -4.602 -14.455
  225    HD3  LYS  25           HD3      LYS  25  26.908  -3.548 -15.613
  226    HE2  LYS  25           HE2      LYS  25  27.012  -3.217 -12.576
  227    HE3  LYS  25           HE3      LYS  25  28.254  -3.983 -13.562
  228    HZ1  LYS  25           HZ1      LYS  25  28.592  -1.869 -14.698
  229    HZ2  LYS  25           HZ2      LYS  25  27.458  -1.136 -13.773
  230    HZ3  LYS  25           HZ3      LYS  25  28.825  -1.704 -13.098
  231    H    SER  26           H        SER  26  21.512  -2.918 -12.067
  232    HA   SER  26           HA       SER  26  22.231  -2.898  -9.329
  233    HG   SER  26           HG       SER  26  20.686  -1.144 -11.383
  234    HB2  SER  26           HB2      SER  26  19.477  -2.766 -10.600
  235    HB3  SER  26           HB3      SER  26  19.883  -2.301  -8.930
  236    H    LEU  27           H        LEU  27  20.220  -5.230 -11.163
  237    HA   LEU  27           HA       LEU  27  19.583  -6.919  -8.943
  238    HG   LEU  27           HG       LEU  27  17.880  -6.209 -11.296
  239    HB2  LEU  27           HB2      LEU  27  19.946  -7.486 -11.903
  240    HB3  LEU  27           HB3      LEU  27  19.477  -8.741 -10.760
  241   HD11  LEU  27          HD11      LEU  27  16.303  -7.684 -12.466
  242   HD12  LEU  27          HD12      LEU  27  17.903  -7.800 -13.201
  243   HD13  LEU  27          HD13      LEU  27  17.337  -9.089 -12.123
  244   HD21  LEU  27          HD21      LEU  27  17.271  -8.673  -9.631
  245   HD22  LEU  27          HD22      LEU  27  17.384  -6.978  -9.078
  246   HD23  LEU  27          HD23      LEU  27  16.053  -7.472 -10.115
  247    H    TYR  28           H        TYR  28  22.349  -7.062 -11.286
  248    HA   TYR  28           HA       TYR  28  23.527  -9.276  -9.972
  249    HD1  TYR  28           HD2      TYR  28  24.128 -10.660 -12.557
  250    HD2  TYR  28           HD1      TYR  28  27.205  -8.396 -10.548
  251    HE1  TYR  28           HE2      TYR  28  25.631 -12.629 -12.655
  252    HE2  TYR  28           HE1      TYR  28  28.711 -10.357 -10.632
  253    HH   TYR  28           HH       TYR  28  28.959 -12.582 -11.295
  254    HB2  TYR  28           HB2      TYR  28  23.965  -8.239 -12.336
  255    HB3  TYR  28           HB3      TYR  28  25.179  -7.273 -11.506
  256    H    ALA  29           H        ALA  29  23.673  -5.835  -9.170
  257    HA   ALA  29           HA       ALA  29  25.987  -6.060  -7.463
  258    HB1  ALA  29           HB1      ALA  29  23.830  -3.908  -7.612
  259    HB2  ALA  29           HB2      ALA  29  25.390  -3.773  -6.780
  260    HB3  ALA  29           HB3      ALA  29  25.347  -3.939  -8.544
  261    H    ILE  30           H        ILE  30  22.421  -6.071  -6.835
  262    HA   ILE  30           HA       ILE  30  23.086  -6.676  -3.974
  263    HB   ILE  30           HB       ILE  30  20.863  -5.523  -3.503
  264   HG12  ILE  30          HG12      ILE  30  21.507  -3.973  -6.029
  265   HG13  ILE  30          HG13      ILE  30  20.207  -5.177  -5.915
  266   HG21  ILE  30          HG21      ILE  30  23.114  -4.780  -2.768
  267   HG22  ILE  30          HG22      ILE  30  23.331  -3.900  -4.298
  268   HG23  ILE  30          HG23      ILE  30  22.092  -3.401  -3.126
  269   HD11  ILE  30          HD11      ILE  30  19.337  -2.911  -5.658
  270   HD12  ILE  30          HD12      ILE  30  19.117  -3.823  -4.148
  271   HD13  ILE  30          HD13      ILE  30  20.402  -2.599  -4.293
  272    H    PHE  31           H        PHE  31  20.689  -7.511  -6.531
  273    HA   PHE  31           HA       PHE  31  19.310  -9.353  -4.772
  274    HD1  PHE  31           HD1      PHE  31  18.235  -6.888  -6.506
  275    HD2  PHE  31           HD2      PHE  31  16.618 -10.871  -6.833
  276    HE1  PHE  31           HE1      PHE  31  15.937  -5.984  -6.305
  277    HE2  PHE  31           HE2      PHE  31  14.326  -9.957  -6.589
  278    HZ   PHE  31           HZ       PHE  31  13.979  -7.513  -6.351
  279    HB2  PHE  31           HB2      PHE  31  19.424  -9.068  -7.766
  280    HB3  PHE  31           HB3      PHE  31  18.895 -10.579  -7.073
  281    H    SER  32           H        SER  32  22.249  -9.675  -6.845
  282    HA   SER  32           HA       SER  32  22.803 -12.332  -6.516
  283    HG   SER  32           HG       SER  32  24.805 -10.167  -8.400
  284    HB2  SER  32           HB2      SER  32  24.696  -9.967  -6.338
  285    HB3  SER  32           HB3      SER  32  25.253 -11.643  -6.440
  286    H    GLN  33           H        GLN  33  22.960  -9.907  -3.948
  287    HA   GLN  33           HA       GLN  33  24.717 -11.441  -2.234
  288    HB2  GLN  33           HB2      GLN  33  22.900  -9.084  -1.566
  289    HB3  GLN  33           HB3      GLN  33  24.169  -9.754  -0.539
  290    HG2  GLN  33           HG2      GLN  33  25.872  -9.220  -2.294
  291    HG3  GLN  33           HG3      GLN  33  24.606  -8.503  -3.287
  292   HE21  GLN  33          HE22      GLN  33  25.399  -6.380  -3.330
  293   HE22  GLN  33          HE21      GLN  33  25.554  -5.394  -1.888
  294    H    PHE  34           H        PHE  34  21.411 -11.818  -3.039
  295    HA   PHE  34           HA       PHE  34  20.992 -13.537  -0.647
  296    HD1  PHE  34           HD1      PHE  34  20.330 -12.067   1.420
  297    HD2  PHE  34           HD2      PHE  34  19.281  -9.570  -1.942
  298    HE1  PHE  34           HE1      PHE  34  21.024 -10.052   2.692
  299    HE2  PHE  34           HE2      PHE  34  19.962  -7.565  -0.664
  300    HZ   PHE  34           HZ       PHE  34  20.839  -7.797   1.656
  301    HB2  PHE  34           HB2      PHE  34  18.867 -11.884  -2.060
  302    HB3  PHE  34           HB3      PHE  34  18.669 -12.798  -0.570
  303    H    GLY  35           H        GLY  35  20.698 -13.204  -4.132
  304    HA2  GLY  35           HA2      GLY  35  20.626 -16.109  -4.278
  305    HA3  GLY  35           HA3      GLY  35  19.233 -15.291  -5.025
  306    H    GLN  36           H        GLN  36  22.544 -16.135  -5.395
  307    HA   GLN  36           HA       GLN  36  23.362 -14.132  -7.185
  308    HB2  GLN  36           HB2      GLN  36  24.604 -16.267  -6.068
  309    HB3  GLN  36           HB3      GLN  36  24.458 -16.833  -7.724
  310    HG2  GLN  36           HG2      GLN  36  25.675 -14.169  -6.819
  311    HG3  GLN  36           HG3      GLN  36  26.586 -15.616  -7.220
  312   HE21  GLN  36          HE22      GLN  36  25.181 -12.685  -8.603
  313   HE22  GLN  36          HE21      GLN  36  25.575 -13.123 -10.237
  314    H    ILE  37           H        ILE  37  23.176 -13.771  -9.240
  315    HA   ILE  37           HA       ILE  37  20.734 -14.470 -10.522
  316    HB   ILE  37           HB       ILE  37  23.227 -12.975 -11.458
  317   HG12  ILE  37          HG12      ILE  37  22.324 -11.955  -9.387
  318   HG13  ILE  37          HG13      ILE  37  22.208 -10.904 -10.778
  319   HG21  ILE  37          HG21      ILE  37  21.908 -13.451 -13.412
  320   HG22  ILE  37          HG22      ILE  37  20.416 -12.906 -12.614
  321   HG23  ILE  37          HG23      ILE  37  21.720 -11.756 -13.011
  322   HD11  ILE  37          HD11      ILE  37  19.824 -11.301 -10.966
  323   HD12  ILE  37          HD12      ILE  37  19.882 -12.517  -9.661
  324   HD13  ILE  37          HD13      ILE  37  20.224 -10.813  -9.314
  325    H    LEU  38           H        LEU  38  20.381 -15.621 -12.468
  326    HA   LEU  38           HA       LEU  38  22.698 -17.014 -13.689
  327    HG   LEU  38           HG       LEU  38  20.820 -18.879 -15.455
  328    HB2  LEU  38           HB2      LEU  38  21.281 -18.609 -12.447
  329    HB3  LEU  38           HB3      LEU  38  19.860 -18.041 -13.328
  330   HD11  LEU  38          HD11      LEU  38  23.228 -18.710 -15.009
  331   HD12  LEU  38          HD12      LEU  38  23.097 -19.891 -13.685
  332   HD13  LEU  38          HD13      LEU  38  22.818 -20.385 -15.369
  333   HD21  LEU  38          HD21      LEU  38  20.578 -21.275 -14.949
  334   HD22  LEU  38          HD22      LEU  38  20.777 -20.939 -13.212
  335   HD23  LEU  38          HD23      LEU  38  19.365 -20.315 -14.089
  336    H    ASP  39           H        ASP  39  19.460 -15.405 -14.152
  337    HA   ASP  39           HA       ASP  39  20.556 -14.160 -16.506
  338    HB2  ASP  39           HB2      ASP  39  19.727 -16.398 -17.430
  339    HB3  ASP  39           HB3      ASP  39  18.101 -15.895 -16.989
  340    H    ILE  40           H        ILE  40  18.852 -12.575 -17.453
  341    HA   ILE  40           HA       ILE  40  16.917 -11.595 -15.425
  342    HB   ILE  40           HB       ILE  40  19.366 -10.141 -16.523
  343   HG12  ILE  40          HG12      ILE  40  18.327 -10.475 -13.676
  344   HG13  ILE  40          HG13      ILE  40  19.573 -11.482 -14.390
  345   HG21  ILE  40          HG21      ILE  40  16.970  -8.878 -15.112
  346   HG22  ILE  40          HG22      ILE  40  18.491  -8.049 -15.524
  347   HG23  ILE  40          HG23      ILE  40  17.453  -8.603 -16.804
  348   HD11  ILE  40          HD11      ILE  40  19.903  -8.502 -13.952
  349   HD12  ILE  40          HD12      ILE  40  20.498  -9.772 -12.899
  350   HD13  ILE  40          HD13      ILE  40  21.120  -9.643 -14.560
  351    H    VAL  41           H        VAL  41  15.199 -10.449 -16.389
  352    HA   VAL  41           HA       VAL  41  15.248 -10.021 -19.324
  353    HB   VAL  41           HB       VAL  41  13.061 -11.460 -17.786
  354   HG11  VAL  41          HG11      VAL  41  12.057 -10.049 -19.510
  355   HG12  VAL  41          HG12      VAL  41  13.194 -10.666 -20.723
  356   HG13  VAL  41          HG13      VAL  41  11.965 -11.737 -20.002
  357   HG21  VAL  41          HG21      VAL  41  14.963 -12.490 -19.923
  358   HG22  VAL  41          HG22      VAL  41  14.882 -13.011 -18.227
  359   HG23  VAL  41          HG23      VAL  41  13.548 -13.370 -19.317
  360    H    ALA  42           H        ALA  42  15.200  -7.876 -19.357
  361    HA   ALA  42           HA       ALA  42  12.787  -6.489 -18.514
  362    HB1  ALA  42           HB1      ALA  42  15.603  -5.504 -17.840
  363    HB2  ALA  42           HB2      ALA  42  14.118  -4.540 -17.702
  364    HB3  ALA  42           HB3      ALA  42  14.338  -5.965 -16.674
  365    H    LEU  43           H        LEU  43  12.902  -4.257 -19.799
  366    HA   LEU  43           HA       LEU  43  14.483  -4.434 -22.265
  367    HG   LEU  43           HG       LEU  43  12.550  -3.697 -24.549
  368    HB2  LEU  43           HB2      LEU  43  12.275  -5.849 -22.417
  369    HB3  LEU  43           HB3      LEU  43  11.473  -4.278 -22.452
  370   HD11  LEU  43          HD11      LEU  43  13.968  -6.391 -24.294
  371   HD12  LEU  43          HD12      LEU  43  13.895  -5.429 -25.787
  372   HD13  LEU  43          HD13      LEU  43  14.740  -4.789 -24.383
  373   HD21  LEU  43          HD21      LEU  43  11.412  -6.532 -24.592
  374   HD22  LEU  43          HD22      LEU  43  10.457  -5.042 -24.551
  375   HD23  LEU  43          HD23      LEU  43  11.464  -5.395 -25.962
  376    H    LYS  44           H        LYS  44  14.209  -2.449 -23.597
  377    HA   LYS  44           HA       LYS  44  14.287  -0.142 -21.902
  378    HB2  LYS  44           HB2      LYS  44  15.621  -0.693 -24.055
  379    HB3  LYS  44           HB3      LYS  44  14.170  -0.293 -24.959
  380    HG2  LYS  44           HG2      LYS  44  15.738   1.512 -25.030
  381    HG3  LYS  44           HG3      LYS  44  14.310   2.050 -24.144
  382    HD2  LYS  44           HD2      LYS  44  15.469   2.084 -22.068
  383    HD3  LYS  44           HD3      LYS  44  16.692   0.943 -22.630
  384    HE2  LYS  44           HE2      LYS  44  17.674   3.158 -22.416
  385    HE3  LYS  44           HE3      LYS  44  17.713   2.591 -24.083
  386    HZ1  LYS  44           HZ1      LYS  44  15.812   4.036 -24.554
  387    HZ2  LYS  44           HZ2      LYS  44  15.793   4.579 -23.008
  388    HZ3  LYS  44           HZ3      LYS  44  17.061   4.893 -23.972
  389    H    THR  45           H        THR  45  11.617  -1.607 -23.617
  390    HA   THR  45           HA       THR  45   9.980   0.740 -23.870
  391    HB   THR  45           HB       THR  45   8.190  -1.149 -23.935
  392    HG1  THR  45           HG1      THR  45   8.972  -3.204 -24.115
  393   HG21  THR  45          HG21      THR  45  10.508  -1.266 -25.927
  394   HG22  THR  45          HG22      THR  45   8.852  -1.849 -26.202
  395   HG23  THR  45          HG23      THR  45   9.152  -0.117 -25.981
  396    H    LEU  46           H        LEU  46   8.470   1.540 -22.414
  397    HA   LEU  46           HA       LEU  46   8.797   1.515 -19.667
  398    HG   LEU  46           HG       LEU  46   5.558   1.368 -19.076
  399    HB2  LEU  46           HB2      LEU  46   7.417   3.123 -20.769
  400    HB3  LEU  46           HB3      LEU  46   6.334   1.876 -21.392
  401   HD11  LEU  46          HD11      LEU  46   7.297   3.746 -18.289
  402   HD12  LEU  46          HD12      LEU  46   6.088   2.960 -17.248
  403   HD13  LEU  46          HD13      LEU  46   7.513   2.058 -17.764
  404   HD21  LEU  46          HD21      LEU  46   4.322   2.918 -20.488
  405   HD22  LEU  46          HD22      LEU  46   4.223   3.392 -18.787
  406   HD23  LEU  46          HD23      LEU  46   5.300   4.282 -19.892
  407    H    LYS  47           H        LYS  47   6.706  -0.595 -21.611
  408    HA   LYS  47           HA       LYS  47   5.339  -1.933 -19.632
  409    HB2  LYS  47           HB2      LYS  47   4.905  -1.942 -22.092
  410    HB3  LYS  47           HB3      LYS  47   6.262  -3.054 -22.320
  411    HG2  LYS  47           HG2      LYS  47   5.100  -4.786 -21.016
  412    HG3  LYS  47           HG3      LYS  47   3.797  -3.647 -20.620
  413    HD2  LYS  47           HD2      LYS  47   3.215  -3.487 -23.026
  414    HD3  LYS  47           HD3      LYS  47   4.537  -4.610 -23.421
  415    HE2  LYS  47           HE2      LYS  47   3.469  -6.357 -22.010
  416    HE3  LYS  47           HE3      LYS  47   2.157  -5.240 -21.613
  417    HZ1  LYS  47           HZ1      LYS  47   2.770  -6.244 -24.334
  418    HZ2  LYS  47           HZ2      LYS  47   1.533  -6.736 -23.397
  419    HZ3  LYS  47           HZ3      LYS  47   1.557  -5.212 -23.964
  420    H    MET  48           H        MET  48   8.772  -2.404 -20.389
  421    HA   MET  48           HA       MET  48   8.780  -4.639 -18.446
  422    HB2  MET  48           HB2      MET  48   9.760  -4.681 -21.281
  423    HB3  MET  48           HB3      MET  48  10.614  -5.648 -20.077
  424    HG2  MET  48           HG2      MET  48   7.689  -5.823 -20.840
  425    HG3  MET  48           HG3      MET  48   8.955  -6.995 -21.180
  426    HE1  MET  48           HE1      MET  48  10.323  -6.687 -18.023
  427    HE2  MET  48           HE2      MET  48   9.626  -8.151 -17.320
  428    HE3  MET  48           HE3      MET  48  10.330  -8.199 -18.966
  429    H    ARG  49           H        ARG  49   9.393  -1.781 -18.229
  430    HA   ARG  49           HA       ARG  49  11.883  -2.340 -16.710
  431    HE   ARG  49           HE       ARG  49  13.268   2.155 -17.951
  432    HB2  ARG  49           HB2      ARG  49  12.721  -0.089 -17.008
  433    HB3  ARG  49           HB3      ARG  49  12.597  -0.965 -18.526
  434    HG2  ARG  49           HG2      ARG  49  10.289   0.236 -18.761
  435    HG3  ARG  49           HG3      ARG  49  10.885   1.344 -17.534
  436    HD2  ARG  49           HD2      ARG  49  12.377   0.651 -20.103
  437    HD3  ARG  49           HD3      ARG  49  11.214   1.981 -19.986
  438   HH11  ARG  49          HH21      ARG  49  12.685   2.726 -21.412
  439   HH12  ARG  49          HH22      ARG  49  13.471   4.268 -21.437
  440   HH21  ARG  49          HH11      ARG  49  14.519   4.135 -18.036
  441   HH22  ARG  49          HH12      ARG  49  14.691   4.972 -19.529
  442    H    GLY  50           H        GLY  50   8.610  -1.095 -16.742
  443    HA2  GLY  50           HA2      GLY  50   8.771  -0.145 -13.970
  444    HA3  GLY  50           HA3      GLY  50   7.313  -0.408 -14.949
  445    H    GLN  51           H        GLN  51   8.960  -3.156 -15.490
  446    HA   GLN  51           HA       GLN  51   8.551  -4.719 -13.106
  447    HB2  GLN  51           HB2      GLN  51   7.011  -6.305 -14.288
  448    HB3  GLN  51           HB3      GLN  51   6.284  -4.738 -13.899
  449    HG2  GLN  51           HG2      GLN  51   6.526  -4.036 -16.256
  450    HG3  GLN  51           HG3      GLN  51   7.291  -5.579 -16.644
  451   HE21  GLN  51          HE22      GLN  51   5.344  -5.295 -18.214
  452   HE22  GLN  51          HE21      GLN  51   3.855  -6.107 -17.728
  453    H    ALA  52           H        ALA  52   9.322  -7.041 -13.680
  454    HA   ALA  52           HA       ALA  52  11.118  -7.359 -15.927
  455    HB1  ALA  52           HB1      ALA  52  12.303  -6.835 -13.160
  456    HB2  ALA  52           HB2      ALA  52  13.198  -7.388 -14.591
  457    HB3  ALA  52           HB3      ALA  52  12.468  -5.779 -14.583
  458    H    PHE  53           H        PHE  53  12.486  -9.425 -15.454
  459    HA   PHE  53           HA       PHE  53  11.395 -11.178 -13.347
  460    HD1  PHE  53           HD1      PHE  53  10.071 -10.346 -16.980
  461    HD2  PHE  53           HD2      PHE  53   9.145 -13.601 -14.310
  462    HE1  PHE  53           HE1      PHE  53   7.661 -10.117 -17.538
  463    HE2  PHE  53           HE2      PHE  53   6.748 -13.424 -14.938
  464    HZ   PHE  53           HZ       PHE  53   6.000 -11.679 -16.541
  465    HB2  PHE  53           HB2      PHE  53  11.785 -12.119 -16.216
  466    HB3  PHE  53           HB3      PHE  53  11.395 -13.123 -14.848
  467    H    VAL  54           H        VAL  54  12.987 -12.902 -12.851
  468    HA   VAL  54           HA       VAL  54  15.608 -12.759 -14.080
  469    HB   VAL  54           HB       VAL  54  16.010 -10.913 -12.772
  470   HG11  VAL  54          HG11      VAL  54  14.036 -10.895 -11.287
  471   HG12  VAL  54          HG12      VAL  54  14.751 -12.214 -10.338
  472   HG13  VAL  54          HG13      VAL  54  15.522 -10.620 -10.381
  473   HG21  VAL  54          HG21      VAL  54  17.595 -11.519 -11.013
  474   HG22  VAL  54          HG22      VAL  54  17.053 -13.201 -11.070
  475   HG23  VAL  54          HG23      VAL  54  17.842 -12.473 -12.478
  476    H    ILE  55           H        ILE  55  16.916 -14.463 -13.482
  477    HA   ILE  55           HA       ILE  55  15.495 -16.867 -12.480
  478    HB   ILE  55           HB       ILE  55  17.395 -16.562 -14.856
  479   HG12  ILE  55          HG12      ILE  55  15.489 -17.425 -16.264
  480   HG13  ILE  55          HG13      ILE  55  14.396 -17.105 -14.933
  481   HG21  ILE  55          HG21      ILE  55  16.950 -18.925 -15.304
  482   HG22  ILE  55          HG22      ILE  55  17.623 -18.725 -13.699
  483   HG23  ILE  55          HG23      ILE  55  15.877 -19.012 -13.884
  484   HD11  ILE  55          HD11      ILE  55  14.580 -14.748 -15.261
  485   HD12  ILE  55          HD12      ILE  55  16.115 -14.906 -16.152
  486   HD13  ILE  55          HD13      ILE  55  14.591 -15.406 -16.888
  487    H    PHE  56           H        PHE  56  16.868 -18.181 -11.209
  488    HA   PHE  56           HA       PHE  56  19.492 -16.967 -10.418
  489    HD1  PHE  56           HD1      PHE  56  15.559 -16.646  -9.511
  490    HD2  PHE  56           HD2      PHE  56  19.324 -15.296  -7.930
  491    HE1  PHE  56           HE1      PHE  56  14.660 -14.355  -9.293
  492    HE2  PHE  56           HE2      PHE  56  18.389 -13.014  -7.626
  493    HZ   PHE  56           HZ       PHE  56  16.042 -12.545  -8.311
  494    HB2  PHE  56           HB2      PHE  56  17.335 -18.267  -8.713
  495    HB3  PHE  56           HB3      PHE  56  18.875 -17.652  -8.127
  496    H    LYS  57           H        LYS  57  20.823 -18.564  -9.041
  497    HA   LYS  57           HA       LYS  57  21.535 -20.782 -10.635
  498    HB2  LYS  57           HB2      LYS  57  21.990 -20.573  -7.626
  499    HB3  LYS  57           HB3      LYS  57  22.878 -21.570  -8.766
  500    HG2  LYS  57           HG2      LYS  57  23.003 -18.579  -8.412
  501    HG3  LYS  57           HG3      LYS  57  24.271 -19.773  -8.181
  502    HD2  LYS  57           HD2      LYS  57  24.144 -20.212 -10.721
  503    HD3  LYS  57           HD3      LYS  57  23.116 -18.754 -10.800
  504    HE2  LYS  57           HE2      LYS  57  24.972 -17.563  -9.494
  505    HE3  LYS  57           HE3      LYS  57  25.992 -18.971  -9.803
  506    HZ1  LYS  57           HZ1      LYS  57  26.329 -17.198 -11.386
  507    HZ2  LYS  57           HZ2      LYS  57  25.709 -18.491 -12.197
  508    HZ3  LYS  57           HZ3      LYS  57  24.768 -17.175 -11.807
  509    H    GLU  58           H        GLU  58  19.245 -20.660  -7.868
  510    HA   GLU  58           HA       GLU  58  18.286 -23.352  -8.492
  511    HB2  GLU  58           HB2      GLU  58  20.294 -22.838  -6.453
  512    HB3  GLU  58           HB3      GLU  58  18.797 -23.231  -5.630
  513    HG2  GLU  58           HG2      GLU  58  20.008 -24.937  -7.850
  514    HG3  GLU  58           HG3      GLU  58  20.343 -25.161  -6.137
  515    H    ILE  59           H        ILE  59  16.374 -23.873  -7.177
  516    HA   ILE  59           HA       ILE  59  14.544 -21.694  -7.118
  517    HB   ILE  59           HB       ILE  59  12.926 -23.272  -6.332
  518   HG12  ILE  59          HG12      ILE  59  15.230 -25.169  -5.690
  519   HG13  ILE  59          HG13      ILE  59  14.138 -24.414  -4.534
  520   HG21  ILE  59          HG21      ILE  59  12.955 -24.813  -8.132
  521   HG22  ILE  59          HG22      ILE  59  13.826 -23.390  -8.705
  522   HG23  ILE  59          HG23      ILE  59  14.729 -24.829  -8.213
  523   HD11  ILE  59          HD11      ILE  59  13.425 -26.550  -6.572
  524   HD12  ILE  59          HD12      ILE  59  13.451 -26.683  -4.808
  525   HD13  ILE  59          HD13      ILE  59  12.225 -25.669  -5.595
  526    H    GLY  60           H        GLY  60  16.541 -23.093  -4.525
  527    HA2  GLY  60           HA2      GLY  60  15.190 -21.753  -2.356
  528    HA3  GLY  60           HA3      GLY  60  16.828 -22.437  -2.338
  529    H    SER  61           H        SER  61  17.978 -20.931  -4.489
  530    HA   SER  61           HA       SER  61  18.706 -18.497  -3.196
  531    HG   SER  61           HG       SER  61  20.665 -20.139  -4.168
  532    HB2  SER  61           HB2      SER  61  18.965 -19.064  -6.173
  533    HB3  SER  61           HB3      SER  61  20.073 -18.166  -5.134
  534    H    ALA  62           H        ALA  62  16.498 -19.253  -5.935
  535    HA   ALA  62           HA       ALA  62  15.636 -16.616  -6.483
  536    HB1  ALA  62           HB1      ALA  62  13.674 -17.739  -7.484
  537    HB2  ALA  62           HB2      ALA  62  15.162 -18.606  -7.912
  538    HB3  ALA  62           HB3      ALA  62  14.089 -19.243  -6.647
  539    H    SER  63           H        SER  63  14.290 -19.062  -4.195
  540    HA   SER  63           HA       SER  63  12.141 -17.504  -3.238
  541    HG   SER  63           HG       SER  63  13.053 -20.476  -3.569
  542    HB2  SER  63           HB2      SER  63  13.787 -19.532  -1.659
  543    HB3  SER  63           HB3      SER  63  12.136 -18.997  -1.310
  544    H    ASN  64           H        ASN  64  15.493 -17.765  -2.032
  545    HA   ASN  64           HA       ASN  64  15.054 -16.063   0.207
  546    HB2  ASN  64           HB2      ASN  64  16.909 -17.731  -0.002
  547    HB3  ASN  64           HB3      ASN  64  17.692 -16.665  -1.171
  548   HD21  ASN  64          HD22      ASN  64  19.294 -15.454  -0.188
  549   HD22  ASN  64          HD21      ASN  64  19.250 -14.880   1.476
  550    H    ALA  65           H        ALA  65  16.322 -15.384  -3.072
  551    HA   ALA  65           HA       ALA  65  16.842 -12.620  -2.772
  552    HB1  ALA  65           HB1      ALA  65  16.520 -12.526  -5.217
  553    HB2  ALA  65           HB2      ALA  65  17.486 -13.941  -4.775
  554    HB3  ALA  65           HB3      ALA  65  15.773 -14.132  -5.220
  555    H    LEU  66           H        LEU  66  13.875 -14.274  -3.937
  556    HA   LEU  66           HA       LEU  66  12.255 -12.038  -4.315
  557    HG   LEU  66           HG       LEU  66  10.018 -12.983  -5.329
  558    HB2  LEU  66           HB2      LEU  66  11.901 -14.455  -4.960
  559    HB3  LEU  66           HB3      LEU  66  11.398 -14.796  -3.318
  560   HD11  LEU  66          HD11      LEU  66   9.781 -15.256  -5.961
  561   HD12  LEU  66          HD12      LEU  66   9.500 -15.784  -4.298
  562   HD13  LEU  66          HD13      LEU  66   8.267 -14.831  -5.147
  563   HD21  LEU  66          HD21      LEU  66   8.074 -13.011  -3.725
  564   HD22  LEU  66          HD22      LEU  66   9.173 -13.680  -2.498
  565   HD23  LEU  66          HD23      LEU  66   9.439 -12.060  -3.173
  566    H    ARG  67           H        ARG  67  12.377 -14.153  -1.375
  567    HA   ARG  67           HA       ARG  67  10.500 -12.579   0.032
  568    HE   ARG  67           HE       ARG  67  12.276 -15.792   4.132
  569    HB2  ARG  67           HB2      ARG  67  11.041 -14.931   0.506
  570    HB3  ARG  67           HB3      ARG  67  12.637 -14.493   1.079
  571    HG2  ARG  67           HG2      ARG  67  10.331 -13.082   2.408
  572    HG3  ARG  67           HG3      ARG  67  10.390 -14.820   2.654
  573    HD2  ARG  67           HD2      ARG  67  12.715 -12.952   3.276
  574    HD3  ARG  67           HD3      ARG  67  11.540 -13.533   4.449
  575   HH11  ARG  67          HH21      ARG  67  14.588 -13.349   2.859
  576   HH12  ARG  67          HH22      ARG  67  15.819 -14.529   2.607
  577   HH21  ARG  67          HH11      ARG  67  14.045 -17.274   3.829
  578   HH22  ARG  67          HH12      ARG  67  15.544 -16.677   3.181
  579    H    THR  68           H        THR  68  14.138 -12.376   0.008
  580    HA   THR  68           HA       THR  68  14.179 -10.461   2.160
  581    HB   THR  68           HB       THR  68  16.290 -10.820  -0.009
  582    HG1  THR  68           HG1      THR  68  16.050 -12.790   0.783
  583   HG21  THR  68          HG21      THR  68  16.728  -8.896   1.442
  584   HG22  THR  68          HG22      THR  68  16.395  -9.866   2.895
  585   HG23  THR  68          HG23      THR  68  17.816 -10.213   1.894
  586    H    MET  69           H        MET  69  14.089 -10.134  -1.421
  587    HA   MET  69           HA       MET  69  14.374  -7.241  -1.221
  588    HB2  MET  69           HB2      MET  69  13.937  -9.070  -3.612
  589    HB3  MET  69           HB3      MET  69  14.293  -7.345  -3.691
  590    HG2  MET  69           HG2      MET  69  16.096  -9.523  -2.551
  591    HG3  MET  69           HG3      MET  69  16.332  -8.662  -4.051
  592    HE1  MET  69           HE1      MET  69  17.278  -6.140  -4.225
  593    HE2  MET  69           HE2      MET  69  15.781  -5.645  -3.403
  594    HE3  MET  69           HE3      MET  69  17.362  -5.064  -2.825
  595    H    GLN  70           H        GLN  70  11.693  -9.332  -1.001
  596    HA   GLN  70           HA       GLN  70   9.631  -7.896  -2.190
  597    HB2  GLN  70           HB2      GLN  70   9.516 -10.160  -1.053
  598    HB3  GLN  70           HB3      GLN  70   9.622  -9.347   0.503
  599    HG2  GLN  70           HG2      GLN  70   7.367  -9.952   0.131
  600    HG3  GLN  70           HG3      GLN  70   7.438  -8.195  -0.028
  601   HE21  GLN  70          HE22      GLN  70   6.508 -11.149  -1.583
  602   HE22  GLN  70          HE21      GLN  70   6.209 -10.505  -3.185
  603    H    GLY  71           H        GLY  71   8.899  -5.846  -1.928
  604    HA2  GLY  71           HA2      GLY  71   8.309  -3.880  -0.948
  605    HA3  GLY  71           HA3      GLY  71   8.630  -4.580   0.640
  606    H    PHE  72           H        PHE  72  11.477  -4.964  -1.220
  607    HA   PHE  72           HA       PHE  72  12.809  -3.057   0.486
  608    HD1  PHE  72           HD1      PHE  72  15.267  -4.307   1.533
  609    HD2  PHE  72           HD2      PHE  72  15.588  -3.036  -2.575
  610    HE1  PHE  72           HE1      PHE  72  17.483  -3.297   2.013
  611    HE2  PHE  72           HE2      PHE  72  17.798  -2.013  -2.087
  612    HZ   PHE  72           HZ       PHE  72  18.749  -2.145   0.208
  613    HB2  PHE  72           HB2      PHE  72  13.783  -5.222  -0.237
  614    HB3  PHE  72           HB3      PHE  72  13.869  -4.625  -1.896
  615    HA   PRO  73           HA       PRO  73  12.634   0.335  -2.542
  616    HB2  PRO  73           HB2      PRO  73  14.226   2.174  -1.355
  617    HB3  PRO  73           HB3      PRO  73  12.621   1.727  -0.708
  618    HG2  PRO  73           HG2      PRO  73  15.329   0.681   0.187
  619    HG3  PRO  73           HG3      PRO  73  13.992   1.305   1.204
  620    HD2  PRO  73           HD2      PRO  73  14.382  -1.368   0.724
  621    HD3  PRO  73           HD3      PRO  73  12.751  -0.669   0.948
  622    H    PHE  74           H        PHE  74  13.638  -1.212  -4.008
  623    HA   PHE  74           HA       PHE  74  16.455  -1.554  -4.409
  624    HD1  PHE  74           HD2      PHE  74  17.122  -3.757  -5.869
  625    HD2  PHE  74           HD1      PHE  74  14.669  -1.431  -8.544
  626    HE1  PHE  74           HE2      PHE  74  18.351  -4.693  -7.815
  627    HE2  PHE  74           HE1      PHE  74  15.899  -2.366 -10.482
  628    HZ   PHE  74           HZ       PHE  74  17.702  -4.037 -10.127
  629    HB2  PHE  74           HB2      PHE  74  14.702  -2.963  -5.347
  630    HB3  PHE  74           HB3      PHE  74  14.061  -1.617  -6.282
  631    H    TYR  75           H        TYR  75  14.152   0.901  -5.326
  632    HA   TYR  75           HA       TYR  75  16.155   2.925  -5.709
  633    HD1  TYR  75           HD2      TYR  75  17.123   4.539  -7.671
  634    HD2  TYR  75           HD1      TYR  75  16.183   0.541  -8.997
  635    HE1  TYR  75           HE2      TYR  75  19.339   4.385  -8.748
  636    HE2  TYR  75           HE1      TYR  75  18.403   0.375 -10.079
  637    HH   TYR  75           HH       TYR  75  20.786   3.077 -10.006
  638    HB2  TYR  75           HB2      TYR  75  14.445   1.937  -8.011
  639    HB3  TYR  75           HB3      TYR  75  14.745   3.655  -7.874
  640    H    ASP  76           H        ASP  76  14.175   4.868  -6.513
  641    HA   ASP  76           HA       ASP  76  12.976   5.402  -4.020
  642    HB2  ASP  76           HB2      ASP  76  13.789   7.044  -5.728
  643    HB3  ASP  76           HB3      ASP  76  12.381   6.662  -6.720
  644    H    LYS  77           H        LYS  77  11.950   2.822  -5.288
  645    HA   LYS  77           HA       LYS  77   9.190   3.271  -4.541
  646    HB2  LYS  77           HB2      LYS  77   9.917   1.880  -7.167
  647    HB3  LYS  77           HB3      LYS  77   8.374   1.698  -6.335
  648    HG2  LYS  77           HG2      LYS  77   8.083   4.223  -6.500
  649    HG3  LYS  77           HG3      LYS  77   9.483   4.231  -7.594
  650    HD2  LYS  77           HD2      LYS  77   8.281   2.626  -9.094
  651    HD3  LYS  77           HD3      LYS  77   6.904   2.644  -7.976
  652    HE2  LYS  77           HE2      LYS  77   6.731   5.138  -8.302
  653    HE3  LYS  77           HE3      LYS  77   7.988   5.031  -9.538
  654    HZ1  LYS  77           HZ1      LYS  77   5.339   3.696  -9.646
  655    HZ2  LYS  77           HZ2      LYS  77   5.781   4.999 -10.512
  656    HZ3  LYS  77           HZ3      LYS  77   6.489   3.560 -10.801
  657    HA   PRO  78           HA       PRO  78  10.434  -0.595  -2.559
  658    HB2  PRO  78           HB2      PRO  78   8.029  -1.443  -1.568
  659    HB3  PRO  78           HB3      PRO  78   8.956  -0.089  -0.850
  660    HG2  PRO  78           HG2      PRO  78   6.617   0.058  -2.770
  661    HG3  PRO  78           HG3      PRO  78   6.894   1.011  -1.279
  662    HD2  PRO  78           HD2      PRO  78   7.494   1.958  -3.785
  663    HD3  PRO  78           HD3      PRO  78   8.456   2.403  -2.345
  664    H    MET  79           H        MET  79  10.758  -2.516  -3.572
  665    HA   MET  79           HA       MET  79   9.522  -3.218  -6.057
  666    HB2  MET  79           HB2      MET  79  11.062  -4.869  -4.003
  667    HB3  MET  79           HB3      MET  79  10.654  -5.442  -5.626
  668    HG2  MET  79           HG2      MET  79  12.292  -2.940  -5.095
  669    HG3  MET  79           HG3      MET  79  12.990  -4.537  -5.309
  670    HE1  MET  79           HE1      MET  79  14.280  -4.785  -7.236
  671    HE2  MET  79           HE2      MET  79  12.963  -5.898  -7.659
  672    HE3  MET  79           HE3      MET  79  13.638  -4.803  -8.890
  673    H    GLN  80           H        GLN  80   8.016  -4.875  -6.530
  674    HA   GLN  80           HA       GLN  80   6.642  -6.236  -4.265
  675    HB2  GLN  80           HB2      GLN  80   5.376  -5.038  -6.778
  676    HB3  GLN  80           HB3      GLN  80   4.551  -6.121  -5.658
  677    HG2  GLN  80           HG2      GLN  80   5.673  -3.387  -4.872
  678    HG3  GLN  80           HG3      GLN  80   4.017  -3.680  -5.372
  679   HE21  GLN  80          HE22      GLN  80   6.411  -4.381  -2.788
  680   HE22  GLN  80          HE21      GLN  80   5.210  -4.799  -1.581
  681    H    ILE  81           H        ILE  81   6.821  -8.433  -4.590
  682    HA   ILE  81           HA       ILE  81   7.730  -9.335  -7.276
  683    HB   ILE  81           HB       ILE  81   9.011 -10.349  -4.733
  684   HG12  ILE  81          HG12      ILE  81   9.869  -7.843  -6.228
  685   HG13  ILE  81          HG13      ILE  81   9.442  -8.002  -4.514
  686   HG21  ILE  81          HG21      ILE  81  10.049 -10.106  -7.588
  687   HG22  ILE  81          HG22      ILE  81  10.827 -10.965  -6.249
  688   HG23  ILE  81          HG23      ILE  81   9.325 -11.567  -6.923
  689   HD11  ILE  81          HD11      ILE  81  11.459  -9.430  -4.179
  690   HD12  ILE  81          HD12      ILE  81  11.946  -9.057  -5.854
  691   HD13  ILE  81          HD13      ILE  81  11.799  -7.755  -4.674
  692    H    ALA  82           H        ALA  82   7.349 -11.525  -7.740
  693    HA   ALA  82           HA       ALA  82   5.901 -13.219  -5.827
  694    HB1  ALA  82           HB1      ALA  82   4.079 -12.082  -7.085
  695    HB2  ALA  82           HB2      ALA  82   4.833 -12.572  -8.621
  696    HB3  ALA  82           HB3      ALA  82   4.176 -13.799  -7.518
  697    H    TYR  83           H        TYR  83   5.882 -15.506  -6.726
  698    HA   TYR  83           HA       TYR  83   8.417 -16.062  -8.151
  699    HD1  TYR  83           HD1      TYR  83   5.875 -16.633  -4.993
  700    HD2  TYR  83           HD2      TYR  83   6.040 -19.778  -7.944
  701    HE1  TYR  83           HE1      TYR  83   3.684 -17.475  -4.207
  702    HE2  TYR  83           HE2      TYR  83   3.869 -20.656  -7.129
  703    HH   TYR  83           HH       TYR  83   2.007 -19.062  -4.500
  704    HB2  TYR  83           HB2      TYR  83   7.952 -18.397  -7.578
  705    HB3  TYR  83           HB3      TYR  83   8.053 -17.368  -6.168
  706    H    SER  84           H        SER  84   8.437 -16.862 -10.264
  707    HA   SER  84           HA       SER  84   6.015 -16.697 -11.862
  708    HG   SER  84           HG       SER  84   7.857 -15.234 -12.894
  709    HB2  SER  84           HB2      SER  84   8.734 -17.905 -12.540
  710    HB3  SER  84           HB3      SER  84   7.505 -17.322 -13.677
  711    H    LYS  85           H        LYS  85   5.132 -18.663 -13.043
  712    HA   LYS  85           HA       LYS  85   5.811 -21.263 -11.915
  713    HB2  LYS  85           HB2      LYS  85   3.641 -21.855 -11.061
  714    HB3  LYS  85           HB3      LYS  85   4.331 -20.545 -10.141
  715    HG2  LYS  85           HG2      LYS  85   2.257 -20.053 -12.330
  716    HG3  LYS  85           HG3      LYS  85   1.792 -20.553 -10.722
  717    HD2  LYS  85           HD2      LYS  85   3.395 -18.018 -11.256
  718    HD3  LYS  85           HD3      LYS  85   1.636 -18.094 -11.137
  719    HE2  LYS  85           HE2      LYS  85   1.759 -18.961  -8.852
  720    HE3  LYS  85           HE3      LYS  85   3.526 -19.026  -8.940
  721    HZ1  LYS  85           HZ1      LYS  85   2.687 -17.058  -7.780
  722    HZ2  LYS  85           HZ2      LYS  85   3.625 -16.680  -9.063
  723    HZ3  LYS  85           HZ3      LYS  85   1.983 -16.513  -9.151
  724    H    SER  86           H        SER  86   3.718 -19.425 -14.194
  725    HA   SER  86           HA       SER  86   2.508 -21.589 -15.427
  726    HG   SER  86           HG       SER  86   1.404 -18.202 -15.964
  727    HB2  SER  86           HB2      SER  86   3.399 -19.023 -16.793
  728    HB3  SER  86           HB3      SER  86   2.004 -20.039 -17.197
  729    H    ASP  87           H        ASP  87   3.301 -23.249 -16.627
  730    HA   ASP  87           HA       ASP  87   5.981 -23.795 -16.818
  731    HB2  ASP  87           HB2      ASP  87   4.262 -25.492 -16.983
  732    HB3  ASP  87           HB3      ASP  87   3.733 -24.865 -18.547
  733    H    SER  88           H        SER  88   3.947 -22.629 -19.579
  734    HA   SER  88           HA       SER  88   6.021 -22.564 -21.465
  735    HG   SER  88           HG       SER  88   2.547 -22.380 -22.464
  736    HB2  SER  88           HB2      SER  88   3.636 -20.678 -21.353
  737    HB3  SER  88           HB3      SER  88   4.509 -21.238 -22.790
  738    H    ASP  89           H        ASP  89   5.095 -20.160 -18.988
  739    HA   ASP  89           HA       ASP  89   6.667 -18.035 -20.201
  740    HB2  ASP  89           HB2      ASP  89   4.640 -17.525 -18.898
  741    HB3  ASP  89           HB3      ASP  89   5.402 -18.205 -17.452
  742    H    ILE  90           H        ILE  90   7.096 -20.298 -17.437
  743    HA   ILE  90           HA       ILE  90   9.636 -19.118 -16.733
  744    HB   ILE  90           HB       ILE  90  10.086 -21.055 -15.370
  745   HG12  ILE  90          HG12      ILE  90   7.501 -22.255 -16.411
  746   HG13  ILE  90          HG13      ILE  90   9.122 -22.857 -16.766
  747   HG21  ILE  90          HG21      ILE  90   8.673 -19.160 -14.631
  748   HG22  ILE  90          HG22      ILE  90   7.217 -20.076 -15.071
  749   HG23  ILE  90          HG23      ILE  90   8.278 -20.662 -13.777
  750   HD11  ILE  90          HD11      ILE  90   9.451 -23.280 -14.314
  751   HD12  ILE  90          HD12      ILE  90   7.738 -22.856 -14.060
  752   HD13  ILE  90          HD13      ILE  90   8.164 -24.245 -15.066
  753    H    VAL  91           H        VAL  91   8.753 -21.792 -18.994
  754    HA   VAL  91           HA       VAL  91  11.459 -22.404 -19.615
  755    HB   VAL  91           HB       VAL  91   8.880 -22.760 -21.175
  756   HG11  VAL  91          HG11      VAL  91  10.689 -22.683 -22.839
  757   HG12  VAL  91          HG12      VAL  91  11.662 -23.815 -21.873
  758   HG13  VAL  91          HG13      VAL  91  10.140 -24.346 -22.627
  759   HG21  VAL  91          HG21      VAL  91   9.162 -25.116 -20.527
  760   HG22  VAL  91          HG22      VAL  91  10.714 -24.752 -19.741
  761   HG23  VAL  91          HG23      VAL  91   9.205 -24.121 -19.070
  762    H    ALA  92           H        ALA  92   9.148 -20.009 -21.038
  763    HA   ALA  92           HA       ALA  92  10.912 -18.968 -22.978
  764    HB1  ALA  92           HB1      ALA  92   9.523 -16.936 -22.882
  765    HB2  ALA  92           HB2      ALA  92   8.531 -18.407 -22.957
  766    HB3  ALA  92           HB3      ALA  92   8.725 -17.527 -21.423
  767    H    LYS  93           H        LYS  93  10.580 -18.064 -19.478
  768    HA   LYS  93           HA       LYS  93  12.516 -15.953 -19.694
  769    HB2  LYS  93           HB2      LYS  93  11.137 -17.396 -17.449
  770    HB3  LYS  93           HB3      LYS  93  12.668 -16.637 -17.060
  771    HG2  LYS  93           HG2      LYS  93  10.879 -15.063 -16.603
  772    HG3  LYS  93           HG3      LYS  93  11.887 -14.466 -17.923
  773    HD2  LYS  93           HD2      LYS  93  10.171 -15.338 -19.552
  774    HD3  LYS  93           HD3      LYS  93   9.167 -15.809 -18.169
  775    HE2  LYS  93           HE2      LYS  93   8.877 -13.538 -17.482
  776    HE3  LYS  93           HE3      LYS  93  10.116 -12.961 -18.621
  777    HZ1  LYS  93           HZ1      LYS  93   7.852 -12.618 -19.445
  778    HZ2  LYS  93           HZ2      LYS  93   8.720 -13.611 -20.425
  779    HZ3  LYS  93           HZ3      LYS  93   7.572 -14.245 -19.404
  780    H    ILE  94           H        ILE  94  12.960 -19.442 -18.744
  781    HA   ILE  94           HA       ILE  94  15.752 -18.901 -18.270
  782    HB   ILE  94           HB       ILE  94  16.083 -21.219 -17.905
  783   HG12  ILE  94          HG12      ILE  94  13.336 -21.642 -19.094
  784   HG13  ILE  94          HG13      ILE  94  14.876 -22.227 -19.716
  785   HG21  ILE  94          HG21      ILE  94  14.674 -21.505 -15.993
  786   HG22  ILE  94          HG22      ILE  94  14.934 -19.773 -16.183
  787   HG23  ILE  94          HG23      ILE  94  13.397 -20.485 -16.676
  788   HD11  ILE  94          HD11      ILE  94  15.116 -23.668 -17.682
  789   HD12  ILE  94          HD12      ILE  94  13.472 -23.178 -17.194
  790   HD13  ILE  94          HD13      ILE  94  13.718 -24.069 -18.702
  791    H    LYS  95           H        LYS  95  14.021 -19.689 -21.252
  792    HA   LYS  95           HA       LYS  95  16.689 -20.025 -22.578
  793    HB2  LYS  95           HB2      LYS  95  13.964 -20.874 -23.608
  794    HB3  LYS  95           HB3      LYS  95  15.533 -21.143 -24.375
  795    HG2  LYS  95           HG2      LYS  95  16.119 -22.334 -22.071
  796    HG3  LYS  95           HG3      LYS  95  14.360 -22.474 -21.944
  797    HD2  LYS  95           HD2      LYS  95  16.139 -23.544 -24.173
  798    HD3  LYS  95           HD3      LYS  95  15.340 -24.488 -22.909
  799    HE2  LYS  95           HE2      LYS  95  13.117 -23.779 -23.811
  800    HE3  LYS  95           HE3      LYS  95  13.942 -22.889 -25.102
  801    HZ1  LYS  95           HZ1      LYS  95  14.107 -25.821 -24.687
  802    HZ2  LYS  95           HZ2      LYS  95  13.242 -25.077 -25.849
  803    HZ3  LYS  95           HZ3      LYS  95  14.868 -24.995 -25.875
  804    H    GLY  96           H        GLY  96  14.604 -17.473 -22.108
  805    HA2  GLY  96           HA2      GLY  96  15.620 -15.879 -24.272
  806    HA3  GLY  96           HA3      GLY  96  14.016 -16.538 -24.623
  807    H    THR  97           H        THR  97  12.621 -14.861 -24.315
  808    HA   THR  97           HA       THR  97  12.700 -13.354 -21.732
  809    HB   THR  97           HB       THR  97  12.119 -11.340 -23.155
  810    HG1  THR  97           HG1      THR  97  12.550 -11.513 -25.369
  811   HG21  THR  97          HG21      THR  97  14.383 -10.841 -23.825
  812   HG22  THR  97          HG22      THR  97  14.483 -11.808 -22.345
  813   HG23  THR  97          HG23      THR  97  14.813 -12.560 -23.918
  814    H    PHE  98           H        PHE  98  10.674 -13.663 -24.679
  815    HA   PHE  98           HA       PHE  98   8.345 -14.555 -23.058
  816    HD1  PHE  98           HD2      PHE  98   9.590 -10.827 -23.173
  817    HD2  PHE  98           HD1      PHE  98   5.848 -12.853 -22.447
  818    HE1  PHE  98           HE2      PHE  98   9.241  -9.463 -21.127
  819    HE2  PHE  98           HE1      PHE  98   5.487 -11.461 -20.426
  820    HZ   PHE  98           HZ       PHE  98   7.176  -9.759 -19.770
  821    HB2  PHE  98           HB2      PHE  98   8.452 -12.181 -24.962
  822    HB3  PHE  98           HB3      PHE  98   6.951 -13.008 -24.593
  823    H    LYS  99           H        LYS  99  10.427 -15.715 -24.840
  824    HA   LYS  99           HA       LYS  99   8.819 -17.371 -26.574
  825    HB2  LYS  99           HB2      LYS  99   9.396 -15.449 -28.077
  826    HB3  LYS  99           HB3      LYS  99  11.077 -15.518 -27.550
  827    HG2  LYS  99           HG2      LYS  99  10.920 -16.474 -29.742
  828    HG3  LYS  99           HG3      LYS  99  11.321 -17.746 -28.599
  829    HD2  LYS  99           HD2      LYS  99   8.727 -18.204 -28.563
  830    HD3  LYS  99           HD3      LYS  99   8.690 -17.232 -30.039
  831    HE2  LYS  99           HE2      LYS  99  10.175 -18.764 -31.171
  832    HE3  LYS  99           HE3      LYS  99  10.622 -19.540 -29.631
  833    HZ1  LYS  99           HZ1      LYS  99   9.033 -20.883 -30.892
  834    HZ2  LYS  99           HZ2      LYS  99   8.484 -20.434 -29.412
  835    HZ3  LYS  99           HZ3      LYS  99   7.903 -19.703 -30.778
  836    H    GLU 100           H        GLU 100  10.044 -19.416 -26.749
  837    HA   GLU 100           HA       GLU 100  12.079 -19.674 -24.676
  838    HB2  GLU 100           HB2      GLU 100  11.894 -22.031 -25.035
  839    HB3  GLU 100           HB3      GLU 100  10.316 -21.304 -24.831
  840    HG2  GLU 100           HG2      GLU 100  11.320 -21.816 -27.641
  841    HG3  GLU 100           HG3      GLU 100  10.782 -23.169 -26.655
  842    H    ARG 101           H        ARG 101  12.987 -17.973 -26.733
  843    HA   ARG 101           HA       ARG 101  15.431 -19.347 -27.563
  844    HE   ARG 101           HE       ARG 101  13.021 -21.757 -31.385
  845    HB2  ARG 101           HB2      ARG 101  13.683 -17.765 -29.512
  846    HB3  ARG 101           HB3      ARG 101  15.319 -18.348 -29.838
  847    HG2  ARG 101           HG2      ARG 101  14.554 -20.676 -29.743
  848    HG3  ARG 101           HG3      ARG 101  12.904 -20.137 -29.356
  849    HD2  ARG 101           HD2      ARG 101  12.809 -18.877 -31.489
  850    HD3  ARG 101           HD3      ARG 101  14.434 -19.450 -31.904
  851   HH11  ARG 101          HH11      ARG 101  12.607 -19.042 -33.700
  852   HH12  ARG 101          HH12      ARG 101  11.817 -20.036 -34.871
  853   HH21  ARG 101          HH21      ARG 101  11.967 -23.024 -32.975
  854   HH22  ARG 101          HH22      ARG 101  11.452 -22.324 -34.459
  855    HA   PRO 102           HA       PRO 102  16.990 -15.365 -26.170
  856    HB2  PRO 102           HB2      PRO 102  18.798 -15.492 -28.589
  857    HB3  PRO 102           HB3      PRO 102  19.211 -15.080 -26.896
  858    HG2  PRO 102           HG2      PRO 102  19.759 -17.549 -27.872
  859    HG3  PRO 102           HG3      PRO 102  19.066 -17.369 -26.227
  860    HD2  PRO 102           HD2      PRO 102  17.646 -18.116 -28.790
  861    HD3  PRO 102           HD3      PRO 102  17.471 -18.805 -27.147
  862    H    LYS 103           H        LYS 103  16.271 -15.771 -29.619
  863    HA   LYS 103           HA       LYS 103  14.568 -13.422 -29.622
  864    HB2  LYS 103           HB2      LYS 103  16.820 -12.570 -30.392
  865    HB3  LYS 103           HB3      LYS 103  16.784 -13.745 -31.714
  866    HG2  LYS 103           HG2      LYS 103  14.735 -12.676 -32.613
  867    HG3  LYS 103           HG3      LYS 103  14.725 -11.527 -31.270
  868    HD2  LYS 103           HD2      LYS 103  16.937 -11.785 -33.359
  869    HD3  LYS 103           HD3      LYS 103  15.623 -10.601 -33.402
  870    HE2  LYS 103           HE2      LYS 103  16.391  -9.668 -31.221
  871    HE3  LYS 103           HE3      LYS 103  17.739 -10.814 -31.213
  872    HZ1  LYS 103           HZ1      LYS 103  17.310  -8.707 -33.250
  873    HZ2  LYS 103           HZ2      LYS 103  18.418  -8.665 -32.058
  874    HZ3  LYS 103           HZ3      LYS 103  18.553  -9.769 -33.247
  875    H    LYS 104           H        LYS 104  12.904 -13.777 -31.248
  876    HA   LYS 104           HA       LYS 104  12.207 -16.472 -31.597
  877    HB2  LYS 104           HB2      LYS 104  10.413 -15.698 -33.050
  878    HB3  LYS 104           HB3      LYS 104  10.531 -14.748 -31.571
  879    HG2  LYS 104           HG2      LYS 104  11.688 -12.925 -32.871
  880    HG3  LYS 104           HG3      LYS 104  11.522 -13.903 -34.334
  881    HD2  LYS 104           HD2      LYS 104   9.800 -12.244 -34.337
  882    HD3  LYS 104           HD3      LYS 104   9.049 -13.830 -34.105
  883    HE2  LYS 104           HE2      LYS 104   8.867 -13.386 -31.665
  884    HE3  LYS 104           HE3      LYS 104   9.674 -11.828 -31.880
  885    HZ1  LYS 104           HZ1      LYS 104   7.798 -11.123 -33.248
  886    HZ2  LYS 104           HZ2      LYS 104   7.053 -12.565 -33.053
  887    HZ3  LYS 104           HZ3      LYS 104   7.277 -11.580 -31.776
  Start of MODEL   20
    1    HA   MET   1           HA       MET   1   7.443 -18.002   3.535
    2    H1   MET   1           H1       MET   1   6.393 -17.267   5.530
    3    H2   MET   1           H2       MET   1   5.534 -18.648   5.661
    4    H3   MET   1           H3       MET   1   7.171 -18.684   5.809
    5    HB2  MET   1           HB2      MET   1   7.185 -20.487   4.266
    6    HB3  MET   1           HB3      MET   1   5.574 -20.403   3.552
    7    HG2  MET   1           HG2      MET   1   7.168 -21.335   1.981
    8    HG3  MET   1           HG3      MET   1   6.605 -19.784   1.369
    9    HE1  MET   1           HE1      MET   1   9.178 -21.467   0.347
   10    HE2  MET   1           HE2      MET   1   8.698 -19.928  -0.403
   11    HE3  MET   1           HE3      MET   1  10.375 -20.175   0.116
   12    H    GLU   2           H        GLU   2   6.427 -17.494   1.446
   13    HA   GLU   2           HA       GLU   2   3.523 -16.931   1.452
   14    HB2  GLU   2           HB2      GLU   2   4.526 -14.876   2.375
   15    HB3  GLU   2           HB3      GLU   2   5.675 -14.813   1.040
   16    HG2  GLU   2           HG2      GLU   2   3.713 -14.573  -0.552
   17    HG3  GLU   2           HG3      GLU   2   2.648 -14.502   0.853
   18    H    MET   3           H        MET   3   6.553 -16.373  -0.317
   19    HA   MET   3           HA       MET   3   5.487 -16.917  -2.924
   20    HB2  MET   3           HB2      MET   3   7.825 -16.894  -3.626
   21    HB3  MET   3           HB3      MET   3   7.459 -15.510  -2.617
   22    HG2  MET   3           HG2      MET   3   8.983 -18.017  -1.801
   23    HG3  MET   3           HG3      MET   3   9.681 -16.452  -2.157
   24    HE1  MET   3           HE1      MET   3   9.341 -14.262  -0.576
   25    HE2  MET   3           HE2      MET   3   7.578 -14.466  -0.524
   26    HE3  MET   3           HE3      MET   3   8.497 -14.305   0.985
   27    H    LEU   4           H        LEU   4   6.376 -18.677  -4.336
   28    HA   LEU   4           HA       LEU   4   6.523 -21.289  -2.921
   29    HG   LEU   4           HG       LEU   4   3.690 -19.890  -3.803
   30    HB2  LEU   4           HB2      LEU   4   5.188 -20.668  -5.587
   31    HB3  LEU   4           HB3      LEU   4   5.328 -22.251  -4.829
   32   HD11  LEU   4          HD11      LEU   4   2.766 -21.019  -5.794
   33   HD12  LEU   4          HD12      LEU   4   2.832 -22.581  -4.948
   34   HD13  LEU   4          HD13      LEU   4   1.760 -21.286  -4.364
   35   HD21  LEU   4          HD21      LEU   4   4.474 -21.145  -1.869
   36   HD22  LEU   4          HD22      LEU   4   2.770 -21.496  -2.137
   37   HD23  LEU   4          HD23      LEU   4   4.000 -22.686  -2.624
   38    HA   PRO   5           HA       PRO   5  10.508 -21.259  -4.973
   39    HB2  PRO   5           HB2      PRO   5   9.992 -24.241  -5.000
   40    HB3  PRO   5           HB3      PRO   5  11.522 -23.358  -4.673
   41    HG2  PRO   5           HG2      PRO   5  10.060 -24.198  -2.586
   42    HG3  PRO   5           HG3      PRO   5  10.704 -22.519  -2.601
   43    HD2  PRO   5           HD2      PRO   5   7.899 -23.461  -3.274
   44    HD3  PRO   5           HD3      PRO   5   8.423 -22.061  -2.287
   45    H    ASN   6           H        ASN   6  11.101 -20.897  -6.938
   46    HA   ASN   6           HA       ASN   6  10.533 -22.592  -9.189
   47    HB2  ASN   6           HB2      ASN   6   8.536 -21.036  -9.250
   48    HB3  ASN   6           HB3      ASN   6   9.640 -19.658  -9.217
   49   HD21  ASN   6          HD22      ASN   6   9.732 -18.757 -11.312
   50   HD22  ASN   6          HD21      ASN   6   9.742 -19.719 -12.761
   51    H    GLN   7           H        GLN   7  12.238 -22.008 -10.868
   52    HA   GLN   7           HA       GLN   7  14.576 -20.941  -9.576
   53    HB2  GLN   7           HB2      GLN   7  14.474 -22.764 -11.340
   54    HB3  GLN   7           HB3      GLN   7  14.228 -21.490 -12.550
   55    HG2  GLN   7           HG2      GLN   7  16.398 -20.490 -11.958
   56    HG3  GLN   7           HG3      GLN   7  16.594 -21.624 -10.620
   57   HE21  GLN   7          HE21      GLN   7  18.669 -21.518 -12.128
   58   HE22  GLN   7          HE22      GLN   7  18.799 -22.864 -13.257
   59    H    THR   8           H        THR   8  11.977 -19.328 -11.081
   60    HA   THR   8           HA       THR   8  13.599 -16.911 -11.649
   61    HB   THR   8           HB       THR   8  11.314 -18.115 -13.247
   62    HG1  THR   8           HG1      THR   8  12.799 -18.830 -14.643
   63   HG21  THR   8          HG21      THR   8  11.380 -15.691 -13.577
   64   HG22  THR   8          HG22      THR   8  13.122 -15.741 -13.866
   65   HG23  THR   8          HG23      THR   8  12.002 -16.495 -15.022
   66    H    ILE   9           H        ILE   9  12.587 -14.957 -11.256
   67    HA   ILE   9           HA       ILE   9   9.987 -15.008  -9.828
   68    HB   ILE   9           HB       ILE   9  10.723 -13.683  -8.076
   69   HG12  ILE   9          HG12      ILE   9  13.197 -13.064  -9.684
   70   HG13  ILE   9          HG13      ILE   9  11.918 -11.957  -9.215
   71   HG21  ILE   9          HG21      ILE   9  11.524 -16.047  -7.932
   72   HG22  ILE   9          HG22      ILE   9  13.116 -15.514  -8.529
   73   HG23  ILE   9          HG23      ILE   9  12.509 -14.927  -6.989
   74   HD11  ILE   9          HD11      ILE   9  13.806 -11.487  -7.830
   75   HD12  ILE   9          HD12      ILE   9  12.565 -12.244  -6.809
   76   HD13  ILE   9          HD13      ILE   9  13.972 -13.176  -7.334
   77    H    TYR  10           H        TYR  10   9.149 -12.703  -9.677
   78    HA   TYR  10           HA       TYR  10   9.493 -11.242 -12.246
   79    HD1  TYR  10           HD2      TYR  10   8.104 -10.581 -14.094
   80    HD2  TYR  10           HD1      TYR  10   4.991 -11.212 -11.170
   81    HE1  TYR  10           HE2      TYR  10   6.560  -9.200 -15.442
   82    HE2  TYR  10           HE1      TYR  10   3.451  -9.814 -12.500
   83    HH   TYR  10           HH       TYR  10   3.134  -8.674 -14.492
   84    HB2  TYR  10           HB2      TYR  10   7.681 -12.861 -12.471
   85    HB3  TYR  10           HB3      TYR  10   6.988 -12.369 -10.934
   86    H    ILE  11           H        ILE  11   9.919  -9.214 -11.722
   87    HA   ILE  11           HA       ILE  11   9.261  -8.120  -9.021
   88    HB   ILE  11           HB       ILE  11  11.348  -7.397 -11.132
   89   HG12  ILE  11          HG12      ILE  11  11.791  -8.380  -8.278
   90   HG13  ILE  11          HG13      ILE  11  11.755  -9.470  -9.662
   91   HG21  ILE  11          HG21      ILE  11  12.184  -5.703  -9.557
   92   HG22  ILE  11          HG22      ILE  11  10.526  -5.349 -10.005
   93   HG23  ILE  11          HG23      ILE  11  10.868  -6.077  -8.418
   94   HD11  ILE  11          HD11      ILE  11  13.670  -8.235 -10.670
   95   HD12  ILE  11          HD12      ILE  11  13.790  -7.279  -9.170
   96   HD13  ILE  11          HD13      ILE  11  14.027  -9.036  -9.127
   97    H    ASN  12           H        ASN  12   7.858  -6.330  -8.998
   98    HA   ASN  12           HA       ASN  12   6.851  -5.400 -11.640
   99    HB2  ASN  12           HB2      ASN  12   5.616  -7.415 -10.404
  100    HB3  ASN  12           HB3      ASN  12   4.912  -6.117  -9.439
  101   HD21  ASN  12          HD22      ASN  12   5.571  -7.142 -12.813
  102   HD22  ASN  12          HD21      ASN  12   4.232  -6.317 -13.563
  103    H    ASN  13           H        ASN  13   8.369  -4.022  -9.238
  104    HA   ASN  13           HA       ASN  13   6.871  -1.592  -9.657
  105    HB2  ASN  13           HB2      ASN  13   5.840  -2.549  -7.549
  106    HB3  ASN  13           HB3      ASN  13   7.413  -2.348  -6.764
  107   HD21  ASN  13          HD21      ASN  13   6.971  -0.613  -5.323
  108   HD22  ASN  13          HD22      ASN  13   6.259   0.904  -5.836
  109    H    LEU  14           H        LEU  14   9.173  -2.198 -10.805
  110    HA   LEU  14           HA       LEU  14  11.494  -1.064  -9.406
  111    HG   LEU  14           HG       LEU  14  11.841  -3.425 -10.506
  112    HB2  LEU  14           HB2      LEU  14  10.820  -1.724 -12.294
  113    HB3  LEU  14           HB3      LEU  14  12.241  -0.781 -11.917
  114   HD11  LEU  14          HD11      LEU  14  13.041  -3.103 -13.282
  115   HD12  LEU  14          HD12      LEU  14  13.013  -4.586 -12.292
  116   HD13  LEU  14          HD13      LEU  14  11.504  -3.910 -12.903
  117   HD21  LEU  14          HD21      LEU  14  14.267  -3.415 -10.446
  118   HD22  LEU  14          HD22      LEU  14  14.312  -1.898 -11.380
  119   HD23  LEU  14          HD23      LEU  14  13.610  -1.934  -9.746
  120    H    ASN  15           H        ASN  15  12.299   1.039  -9.711
  121    HA   ASN  15           HA       ASN  15  10.326   3.135 -10.072
  122    HB2  ASN  15           HB2      ASN  15  12.322   3.306  -8.576
  123    HB3  ASN  15           HB3      ASN  15  13.367   3.343  -9.993
  124   HD21  ASN  15          HD22      ASN  15  12.660   5.384  -7.779
  125   HD22  ASN  15          HD21      ASN  15  12.229   6.827  -8.681
  126    H    GLU  16           H        GLU  16   9.624   3.841 -11.951
  127    HA   GLU  16           HA       GLU  16  10.071   2.811 -14.419
  128    HB2  GLU  16           HB2      GLU  16   8.194   4.248 -13.662
  129    HB3  GLU  16           HB3      GLU  16   9.246   5.664 -13.745
  130    HG2  GLU  16           HG2      GLU  16   9.488   5.327 -16.202
  131    HG3  GLU  16           HG3      GLU  16   8.445   3.907 -16.105
  132    H    LYS  17           H        LYS  17  12.028   5.440 -12.959
  133    HA   LYS  17           HA       LYS  17  13.154   6.343 -15.402
  134    HB2  LYS  17           HB2      LYS  17  14.651   7.620 -14.103
  135    HB3  LYS  17           HB3      LYS  17  13.133   7.565 -13.212
  136    HG2  LYS  17           HG2      LYS  17  14.185   5.658 -11.818
  137    HG3  LYS  17           HG3      LYS  17  15.712   6.041 -12.627
  138    HD2  LYS  17           HD2      LYS  17  15.577   8.370 -11.815
  139    HD3  LYS  17           HD3      LYS  17  14.044   8.002 -10.997
  140    HE2  LYS  17           HE2      LYS  17  15.175   6.327  -9.577
  141    HE3  LYS  17           HE3      LYS  17  16.703   6.613 -10.423
  142    HZ1  LYS  17           HZ1      LYS  17  15.261   8.636  -8.801
  143    HZ2  LYS  17           HZ2      LYS  17  16.606   7.839  -8.341
  144    HZ3  LYS  17           HZ3      LYS  17  16.674   8.888  -9.583
  145    H    ILE  18           H        ILE  18  13.858   3.440 -13.612
  146    HA   ILE  18           HA       ILE  18  16.675   3.313 -14.198
  147    HB   ILE  18           HB       ILE  18  14.658   1.250 -13.221
  148   HG12  ILE  18          HG12      ILE  18  14.844   3.104 -11.664
  149   HG13  ILE  18          HG13      ILE  18  15.609   1.683 -10.984
  150   HG21  ILE  18          HG21      ILE  18  17.684   1.047 -13.119
  151   HG22  ILE  18          HG22      ILE  18  16.531  -0.069 -12.371
  152   HG23  ILE  18          HG23      ILE  18  16.597   0.074 -14.129
  153   HD11  ILE  18          HD11      ILE  18  17.085   4.053 -12.247
  154   HD12  ILE  18          HD12      ILE  18  16.865   3.765 -10.532
  155   HD13  ILE  18          HD13      ILE  18  17.846   2.639 -11.483
  156    H    LYS  19           H        LYS  19  17.603   2.875 -16.052
  157    HA   LYS  19           HA       LYS  19  16.166   1.866 -18.366
  158    HB2  LYS  19           HB2      LYS  19  19.144   2.254 -17.785
  159    HB3  LYS  19           HB3      LYS  19  18.488   1.828 -19.369
  160    HG2  LYS  19           HG2      LYS  19  17.219   3.926 -19.470
  161    HG3  LYS  19           HG3      LYS  19  17.779   4.380 -17.852
  162    HD2  LYS  19           HD2      LYS  19  20.130   4.366 -18.659
  163    HD3  LYS  19           HD3      LYS  19  19.557   3.965 -20.295
  164    HE2  LYS  19           HE2      LYS  19  18.228   6.063 -20.340
  165    HE3  LYS  19           HE3      LYS  19  18.766   6.450 -18.703
  166    HZ1  LYS  19           HZ1      LYS  19  21.036   6.592 -19.549
  167    HZ2  LYS  19           HZ2      LYS  19  20.543   6.231 -21.067
  168    HZ3  LYS  19           HZ3      LYS  19  20.068   7.619 -20.360
  169    H    LYS  20           H        LYS  20  16.933  -0.113 -19.562
  170    HA   LYS  20           HA       LYS  20  16.728  -2.523 -18.108
  171    HB2  LYS  20           HB2      LYS  20  16.438  -2.219 -20.606
  172    HB3  LYS  20           HB3      LYS  20  18.205  -2.048 -20.743
  173    HG2  LYS  20           HG2      LYS  20  18.461  -4.369 -19.804
  174    HG3  LYS  20           HG3      LYS  20  16.707  -4.489 -19.675
  175    HD2  LYS  20           HD2      LYS  20  17.421  -5.675 -21.639
  176    HD3  LYS  20           HD3      LYS  20  16.538  -4.237 -22.166
  177    HE2  LYS  20           HE2      LYS  20  18.686  -3.073 -22.617
  178    HE3  LYS  20           HE3      LYS  20  19.582  -4.471 -22.008
  179    HZ1  LYS  20           HZ1      LYS  20  17.842  -4.479 -24.412
  180    HZ2  LYS  20           HZ2      LYS  20  19.470  -4.478 -24.414
  181    HZ3  LYS  20           HZ3      LYS  20  18.668  -5.773 -23.844
  182    H    GLU  21           H        GLU  21  19.609  -0.795 -19.292
  183    HA   GLU  21           HA       GLU  21  21.579  -2.606 -18.450
  184    HB2  GLU  21           HB2      GLU  21  21.887  -0.842 -20.077
  185    HB3  GLU  21           HB3      GLU  21  21.597   0.408 -18.865
  186    HG2  GLU  21           HG2      GLU  21  23.630  -0.201 -17.649
  187    HG3  GLU  21           HG3      GLU  21  23.905  -1.581 -18.722
  188    H    GLU  22           H        GLU  22  20.065   0.154 -16.728
  189    HA   GLU  22           HA       GLU  22  21.771  -0.047 -14.421
  190    HB2  GLU  22           HB2      GLU  22  19.103   1.302 -14.918
  191    HB3  GLU  22           HB3      GLU  22  20.006   1.448 -13.398
  192    HG2  GLU  22           HG2      GLU  22  21.905   2.434 -14.538
  193    HG3  GLU  22           HG3      GLU  22  21.135   2.237 -16.117
  194    H    LEU  23           H        LEU  23  18.551  -1.355 -15.278
  195    HA   LEU  23           HA       LEU  23  17.975  -2.551 -12.752
  196    HG   LEU  23           HG       LEU  23  15.183  -4.306 -14.944
  197    HB2  LEU  23           HB2      LEU  23  16.175  -2.323 -14.227
  198    HB3  LEU  23           HB3      LEU  23  17.056  -2.918 -15.617
  199   HD11  LEU  23          HD11      LEU  23  17.114  -5.327 -16.146
  200   HD12  LEU  23          HD12      LEU  23  17.684  -5.951 -14.592
  201   HD13  LEU  23          HD13      LEU  23  16.115  -6.448 -15.200
  202   HD21  LEU  23          HD21      LEU  23  15.352  -3.920 -12.501
  203   HD22  LEU  23          HD22      LEU  23  15.193  -5.639 -12.913
  204   HD23  LEU  23          HD23      LEU  23  16.766  -4.969 -12.436
  205    H    LYS  24           H        LYS  24  19.646  -3.987 -15.672
  206    HA   LYS  24           HA       LYS  24  20.083  -6.409 -14.202
  207    HB2  LYS  24           HB2      LYS  24  21.522  -7.156 -15.934
  208    HB3  LYS  24           HB3      LYS  24  20.099  -6.391 -16.640
  209    HG2  LYS  24           HG2      LYS  24  21.422  -4.411 -17.212
  210    HG3  LYS  24           HG3      LYS  24  22.857  -5.101 -16.424
  211    HD2  LYS  24           HD2      LYS  24  22.777  -7.021 -18.012
  212    HD3  LYS  24           HD3      LYS  24  21.406  -6.254 -18.845
  213    HE2  LYS  24           HE2      LYS  24  22.813  -4.293 -19.384
  214    HE3  LYS  24           HE3      LYS  24  24.162  -4.984 -18.473
  215    HZ1  LYS  24           HZ1      LYS  24  22.985  -6.180 -20.918
  216    HZ2  LYS  24           HZ2      LYS  24  24.401  -5.377 -20.841
  217    HZ3  LYS  24           HZ3      LYS  24  24.238  -6.802 -20.072
  218    H    LYS  25           H        LYS  25  22.130  -3.526 -14.607
  219    HA   LYS  25           HA       LYS  25  24.390  -4.436 -13.175
  220    HB2  LYS  25           HB2      LYS  25  24.423  -2.372 -14.414
  221    HB3  LYS  25           HB3      LYS  25  23.116  -1.679 -13.445
  222    HG2  LYS  25           HG2      LYS  25  24.501  -1.502 -11.501
  223    HG3  LYS  25           HG3      LYS  25  25.806  -2.447 -12.263
  224    HD2  LYS  25           HD2      LYS  25  26.119  -0.635 -13.929
  225    HD3  LYS  25           HD3      LYS  25  24.817   0.299 -13.153
  226    HE2  LYS  25           HE2      LYS  25  26.101   0.304 -11.021
  227    HE3  LYS  25           HE3      LYS  25  27.388  -0.631 -11.786
  228    HZ1  LYS  25           HZ1      LYS  25  27.915   1.721 -11.742
  229    HZ2  LYS  25           HZ2      LYS  25  27.763   1.241 -13.290
  230    HZ3  LYS  25           HZ3      LYS  25  26.572   2.108 -12.578
  231    H    SER  26           H        SER  26  21.416  -2.821 -11.894
  232    HA   SER  26           HA       SER  26  22.316  -2.837  -9.214
  233    HG   SER  26           HG       SER  26  20.614  -1.107 -11.194
  234    HB2  SER  26           HB2      SER  26  19.477  -2.715 -10.275
  235    HB3  SER  26           HB3      SER  26  20.028  -2.215  -8.657
  236    H    LEU  27           H        LEU  27  20.261  -5.123 -11.005
  237    HA   LEU  27           HA       LEU  27  19.648  -6.884  -8.861
  238    HG   LEU  27           HG       LEU  27  17.758  -6.221 -10.907
  239    HB2  LEU  27           HB2      LEU  27  19.900  -7.143 -11.866
  240    HB3  LEU  27           HB3      LEU  27  19.663  -8.581 -10.901
  241   HD11  LEU  27          HD11      LEU  27  16.290  -7.762 -12.200
  242   HD12  LEU  27          HD12      LEU  27  17.810  -7.445 -13.041
  243   HD13  LEU  27          HD13      LEU  27  17.583  -8.986 -12.198
  244   HD21  LEU  27          HD21      LEU  27  16.212  -7.887  -9.830
  245   HD22  LEU  27          HD22      LEU  27  17.602  -8.974  -9.622
  246   HD23  LEU  27          HD23      LEU  27  17.551  -7.379  -8.822
  247    H    TYR  28           H        TYR  28  22.381  -7.021 -11.240
  248    HA   TYR  28           HA       TYR  28  23.619  -9.265 -10.023
  249    HD1  TYR  28           HD2      TYR  28  25.010 -10.713 -11.935
  250    HD2  TYR  28           HD1      TYR  28  27.187  -7.137 -10.878
  251    HE1  TYR  28           HE2      TYR  28  27.109 -12.022 -11.860
  252    HE2  TYR  28           HE1      TYR  28  29.293  -8.438 -10.797
  253    HH   TYR  28           HH       TYR  28  29.408 -11.970 -11.479
  254    HB2  TYR  28           HB2      TYR  28  24.079  -8.384 -12.309
  255    HB3  TYR  28           HB3      TYR  28  24.885  -6.989 -11.602
  256    H    ALA  29           H        ALA  29  23.906  -5.756  -9.338
  257    HA   ALA  29           HA       ALA  29  26.121  -5.903  -7.611
  258    HB1  ALA  29           HB1      ALA  29  25.284  -3.797  -8.578
  259    HB2  ALA  29           HB2      ALA  29  23.830  -3.896  -7.555
  260    HB3  ALA  29           HB3      ALA  29  25.425  -3.700  -6.813
  261    H    ILE  30           H        ILE  30  22.582  -6.174  -6.818
  262    HA   ILE  30           HA       ILE  30  23.463  -7.023  -4.077
  263    HB   ILE  30           HB       ILE  30  21.332  -5.926  -3.281
  264   HG12  ILE  30          HG12      ILE  30  21.661  -4.174  -5.741
  265   HG13  ILE  30          HG13      ILE  30  20.386  -5.389  -5.553
  266   HG21  ILE  30          HG21      ILE  30  22.577  -3.850  -2.831
  267   HG22  ILE  30          HG22      ILE  30  23.675  -5.218  -2.779
  268   HG23  ILE  30          HG23      ILE  30  23.652  -4.164  -4.209
  269   HD11  ILE  30          HD11      ILE  30  19.563  -4.180  -3.531
  270   HD12  ILE  30          HD12      ILE  30  20.800  -2.928  -3.793
  271   HD13  ILE  30          HD13      ILE  30  19.537  -3.172  -4.992
  272    H    PHE  31           H        PHE  31  20.787  -7.597  -6.442
  273    HA   PHE  31           HA       PHE  31  19.450  -9.435  -4.687
  274    HD1  PHE  31           HD1      PHE  31  18.386  -6.825  -6.233
  275    HD2  PHE  31           HD2      PHE  31  16.551 -10.707  -6.609
  276    HE1  PHE  31           HE1      PHE  31  16.144  -5.812  -5.908
  277    HE2  PHE  31           HE2      PHE  31  14.323  -9.691  -6.285
  278    HZ   PHE  31           HZ       PHE  31  14.111  -7.240  -5.957
  279    HB2  PHE  31           HB2      PHE  31  19.387  -8.964  -7.645
  280    HB3  PHE  31           HB3      PHE  31  18.805 -10.497  -7.051
  281    H    SER  32           H        SER  32  22.178  -9.976  -7.012
  282    HA   SER  32           HA       SER  32  22.300 -12.759  -6.675
  283    HG   SER  32           HG       SER  32  24.233 -11.514  -9.253
  284    HB2  SER  32           HB2      SER  32  24.492 -10.718  -7.159
  285    HB3  SER  32           HB3      SER  32  24.769 -12.473  -7.182
  286    H    GLN  33           H        GLN  33  23.284 -10.251  -4.324
  287    HA   GLN  33           HA       GLN  33  24.938 -12.010  -2.748
  288    HB2  GLN  33           HB2      GLN  33  23.473  -9.481  -1.876
  289    HB3  GLN  33           HB3      GLN  33  24.760 -10.314  -1.012
  290    HG2  GLN  33           HG2      GLN  33  26.307  -9.872  -2.955
  291    HG3  GLN  33           HG3      GLN  33  25.026  -8.927  -3.712
  292   HE21  GLN  33          HE22      GLN  33  25.828  -6.803  -3.595
  293   HE22  GLN  33          HE21      GLN  33  26.336  -6.049  -2.099
  294    H    PHE  34           H        PHE  34  21.547 -11.968  -3.270
  295    HA   PHE  34           HA       PHE  34  21.045 -13.432  -0.726
  296    HD1  PHE  34           HD2      PHE  34  20.259 -11.948   1.225
  297    HD2  PHE  34           HD1      PHE  34  19.825  -9.477  -2.284
  298    HE1  PHE  34           HE2      PHE  34  21.018  -9.970   2.518
  299    HE2  PHE  34           HE1      PHE  34  20.588  -7.508  -0.993
  300    HZ   PHE  34           HZ       PHE  34  21.187  -7.746   1.414
  301    HB2  PHE  34           HB2      PHE  34  19.128 -11.746  -2.373
  302    HB3  PHE  34           HB3      PHE  34  18.756 -12.571  -0.866
  303    H    GLY  35           H        GLY  35  21.674 -14.187  -3.879
  304    HA2  GLY  35           HA2      GLY  35  20.637 -16.757  -3.521
  305    HA3  GLY  35           HA3      GLY  35  19.432 -15.895  -4.484
  306    H    GLN  36           H        GLN  36  22.695 -14.964  -5.166
  307    HA   GLN  36           HA       GLN  36  23.638 -14.751  -7.142
  308    HB2  GLN  36           HB2      GLN  36  24.851 -16.565  -6.090
  309    HB3  GLN  36           HB3      GLN  36  23.822 -17.760  -6.889
  310    HG2  GLN  36           HG2      GLN  36  26.019 -17.442  -8.033
  311    HG3  GLN  36           HG3      GLN  36  24.657 -17.103  -9.086
  312   HE21  GLN  36          HE22      GLN  36  24.679 -15.119 -10.201
  313   HE22  GLN  36          HE21      GLN  36  25.681 -13.759  -9.753
  314    H    ILE  37           H        ILE  37  22.602 -13.894  -8.764
  315    HA   ILE  37           HA       ILE  37  20.461 -15.048 -10.239
  316    HB   ILE  37           HB       ILE  37  22.450 -12.810 -10.751
  317   HG12  ILE  37          HG12      ILE  37  19.496 -12.849  -9.960
  318   HG13  ILE  37          HG13      ILE  37  20.821 -12.615  -8.823
  319   HG21  ILE  37          HG21      ILE  37  20.005 -13.508 -12.420
  320   HG22  ILE  37          HG22      ILE  37  20.959 -12.020 -12.535
  321   HG23  ILE  37          HG23      ILE  37  21.706 -13.528 -12.958
  322   HD11  ILE  37          HD11      ILE  37  19.873 -10.501  -9.305
  323   HD12  ILE  37          HD12      ILE  37  21.497 -10.558 -10.025
  324   HD13  ILE  37          HD13      ILE  37  20.048 -10.731 -11.047
  325    H    LEU  38           H        LEU  38  20.435 -15.884 -12.298
  326    HA   LEU  38           HA       LEU  38  22.922 -17.032 -13.438
  327    HG   LEU  38           HG       LEU  38  21.179 -18.784 -15.495
  328    HB2  LEU  38           HB2      LEU  38  21.462 -18.757 -12.451
  329    HB3  LEU  38           HB3      LEU  38  20.083 -18.136 -13.363
  330   HD11  LEU  38          HD11      LEU  38  23.348 -19.951 -13.683
  331   HD12  LEU  38          HD12      LEU  38  23.174 -20.285 -15.421
  332   HD13  LEU  38          HD13      LEU  38  23.557 -18.652 -14.878
  333   HD21  LEU  38          HD21      LEU  38  20.994 -21.017 -13.431
  334   HD22  LEU  38          HD22      LEU  38  19.643 -20.320 -14.351
  335   HD23  LEU  38          HD23      LEU  38  20.914 -21.214 -15.198
  336    H    ASP  39           H        ASP  39  19.699 -15.417 -14.042
  337    HA   ASP  39           HA       ASP  39  20.856 -14.168 -16.393
  338    HB2  ASP  39           HB2      ASP  39  20.126 -16.347 -17.361
  339    HB3  ASP  39           HB3      ASP  39  18.490 -16.043 -16.799
  340    H    ILE  40           H        ILE  40  19.227 -12.551 -17.376
  341    HA   ILE  40           HA       ILE  40  17.238 -11.545 -15.419
  342    HB   ILE  40           HB       ILE  40  19.604  -9.942 -16.510
  343   HG12  ILE  40          HG12      ILE  40  19.037 -10.799 -13.644
  344   HG13  ILE  40          HG13      ILE  40  20.306 -11.450 -14.684
  345   HG21  ILE  40          HG21      ILE  40  17.302  -9.110 -14.693
  346   HG22  ILE  40          HG22      ILE  40  18.715  -8.098 -15.091
  347   HG23  ILE  40          HG23      ILE  40  17.600  -8.546 -16.352
  348   HD11  ILE  40          HD11      ILE  40  21.379  -9.203 -14.763
  349   HD12  ILE  40          HD12      ILE  40  20.203  -8.659 -13.534
  350   HD13  ILE  40          HD13      ILE  40  21.348  -9.945 -13.159
  351    H    VAL  41           H        VAL  41  15.544 -10.433 -16.496
  352    HA   VAL  41           HA       VAL  41  15.894  -9.713 -19.344
  353    HB   VAL  41           HB       VAL  41  13.559 -11.388 -18.326
  354   HG11  VAL  41          HG11      VAL  41  14.300 -10.474 -21.143
  355   HG12  VAL  41          HG12      VAL  41  12.940 -11.535 -20.716
  356   HG13  VAL  41          HG13      VAL  41  12.945  -9.860 -20.169
  357   HG21  VAL  41          HG21      VAL  41  14.382 -13.196 -19.805
  358   HG22  VAL  41          HG22      VAL  41  15.869 -12.269 -20.100
  359   HG23  VAL  41          HG23      VAL  41  15.485 -12.878 -18.471
  360    H    ALA  42           H        ALA  42  15.371  -7.613 -19.446
  361    HA   ALA  42           HA       ALA  42  12.792  -6.676 -18.522
  362    HB1  ALA  42           HB1      ALA  42  13.698  -4.620 -17.504
  363    HB2  ALA  42           HB2      ALA  42  14.260  -6.044 -16.617
  364    HB3  ALA  42           HB3      ALA  42  15.357  -5.209 -17.745
  365    H    LEU  43           H        LEU  43  12.665  -4.254 -19.560
  366    HA   LEU  43           HA       LEU  43  14.161  -4.048 -22.064
  367    HG   LEU  43           HG       LEU  43  11.617  -5.308 -24.453
  368    HB2  LEU  43           HB2      LEU  43  11.758  -5.552 -22.034
  369    HB3  LEU  43           HB3      LEU  43  11.236  -3.970 -22.524
  370   HD11  LEU  43          HD11      LEU  43  14.014  -3.428 -24.331
  371   HD12  LEU  43          HD12      LEU  43  13.197  -4.047 -25.768
  372   HD13  LEU  43          HD13      LEU  43  12.332  -2.944 -24.703
  373   HD21  LEU  43          HD21      LEU  43  13.705  -6.406 -25.012
  374   HD22  LEU  43          HD22      LEU  43  14.481  -5.790 -23.539
  375   HD23  LEU  43          HD23      LEU  43  13.150  -6.956 -23.422
  376    H    LYS  44           H        LYS  44  13.819  -1.931 -23.040
  377    HA   LYS  44           HA       LYS  44  13.041   0.143 -21.122
  378    HB2  LYS  44           HB2      LYS  44  14.006   0.265 -24.021
  379    HB3  LYS  44           HB3      LYS  44  13.684   1.677 -23.007
  380    HG2  LYS  44           HG2      LYS  44  15.429   1.003 -21.413
  381    HG3  LYS  44           HG3      LYS  44  15.728  -0.482 -22.323
  382    HD2  LYS  44           HD2      LYS  44  17.454   1.115 -22.847
  383    HD3  LYS  44           HD3      LYS  44  16.458   0.834 -24.282
  384    HE2  LYS  44           HE2      LYS  44  15.218   2.955 -23.816
  385    HE3  LYS  44           HE3      LYS  44  16.228   3.225 -22.392
  386    HZ1  LYS  44           HZ1      LYS  44  17.031   4.461 -24.303
  387    HZ2  LYS  44           HZ2      LYS  44  18.152   3.357 -23.880
  388    HZ3  LYS  44           HZ3      LYS  44  17.206   3.109 -25.190
  389    H    THR  45           H        THR  45  11.255  -1.686 -23.474
  390    HA   THR  45           HA       THR  45   9.397   0.358 -24.263
  391    HB   THR  45           HB       THR  45   7.977  -1.797 -24.672
  392    HG1  THR  45           HG1      THR  45   9.104  -3.687 -24.612
  393   HG21  THR  45          HG21      THR  45   9.279  -2.339 -26.704
  394   HG22  THR  45          HG22      THR  45   9.181  -0.588 -26.467
  395   HG23  THR  45          HG23      THR  45  10.680  -1.452 -26.064
  396    H    LEU  46           H        LEU  46   7.324   0.756 -23.376
  397    HA   LEU  46           HA       LEU  46   7.343   1.297 -20.696
  398    HG   LEU  46           HG       LEU  46   4.341   1.046 -19.998
  399    HB2  LEU  46           HB2      LEU  46   5.833   2.318 -22.354
  400    HB3  LEU  46           HB3      LEU  46   4.930   0.804 -22.471
  401   HD11  LEU  46          HD11      LEU  46   6.128   2.590 -19.288
  402   HD12  LEU  46          HD12      LEU  46   5.515   3.836 -20.400
  403   HD13  LEU  46          HD13      LEU  46   4.543   3.311 -19.008
  404   HD21  LEU  46          HD21      LEU  46   3.431   3.237 -21.887
  405   HD22  LEU  46          HD22      LEU  46   2.769   1.587 -21.752
  406   HD23  LEU  46          HD23      LEU  46   2.601   2.713 -20.399
  407    H    LYS  47           H        LYS  47   5.981  -1.637 -22.211
  408    HA   LYS  47           HA       LYS  47   4.590  -2.674 -20.043
  409    HB2  LYS  47           HB2      LYS  47   4.534  -3.502 -22.382
  410    HB3  LYS  47           HB3      LYS  47   6.138  -4.218 -22.172
  411    HG2  LYS  47           HG2      LYS  47   5.275  -5.756 -20.466
  412    HG3  LYS  47           HG3      LYS  47   3.681  -4.994 -20.525
  413    HD2  LYS  47           HD2      LYS  47   5.022  -6.404 -22.876
  414    HD3  LYS  47           HD3      LYS  47   3.891  -7.182 -21.759
  415    HE2  LYS  47           HE2      LYS  47   2.107  -5.617 -22.387
  416    HE3  LYS  47           HE3      LYS  47   3.208  -4.748 -23.465
  417    HZ1  LYS  47           HZ1      LYS  47   2.394  -7.588 -23.808
  418    HZ2  LYS  47           HZ2      LYS  47   1.822  -6.316 -24.667
  419    HZ3  LYS  47           HZ3      LYS  47   3.386  -6.746 -24.808
  420    H    MET  48           H        MET  48   8.103  -2.566 -20.448
  421    HA   MET  48           HA       MET  48   8.467  -4.211 -17.969
  422    HB2  MET  48           HB2      MET  48  10.236  -3.997 -20.405
  423    HB3  MET  48           HB3      MET  48  10.637  -4.871 -18.925
  424    HG2  MET  48           HG2      MET  48   8.327  -5.478 -20.808
  425    HG3  MET  48           HG3      MET  48   9.832  -6.376 -20.707
  426    HE1  MET  48           HE1      MET  48   9.536  -8.247 -17.291
  427    HE2  MET  48           HE2      MET  48  10.350  -8.269 -18.881
  428    HE3  MET  48           HE3      MET  48  10.489  -6.851 -17.822
  429    H    ARG  49           H        ARG  49   8.305  -1.094 -18.857
  430    HA   ARG  49           HA       ARG  49  10.806  -0.091 -17.690
  431    HE   ARG  49           HE       ARG  49  10.469   2.541 -20.977
  432    HB2  ARG  49           HB2      ARG  49   9.508   0.852 -19.671
  433    HB3  ARG  49           HB3      ARG  49   8.296   1.406 -18.509
  434    HG2  ARG  49           HG2      ARG  49  10.131   2.750 -17.374
  435    HG3  ARG  49           HG3      ARG  49  11.245   2.230 -18.643
  436    HD2  ARG  49           HD2      ARG  49   8.671   3.815 -19.042
  437    HD3  ARG  49           HD3      ARG  49  10.311   4.486 -19.072
  438   HH11  ARG  49          HH21      ARG  49   8.183   5.238 -20.565
  439   HH12  ARG  49          HH22      ARG  49   7.842   5.366 -22.249
  440   HH21  ARG  49          HH11      ARG  49  10.076   2.724 -23.121
  441   HH22  ARG  49          HH12      ARG  49   8.970   3.900 -23.778
  442    H    GLY  50           H        GLY  50   9.910  -1.642 -15.794
  443    HA2  GLY  50           HA2      GLY  50   9.308  -0.390 -13.445
  444    HA3  GLY  50           HA3      GLY  50   7.716  -0.517 -14.205
  445    H    GLN  51           H        GLN  51   9.048  -3.171 -15.498
  446    HA   GLN  51           HA       GLN  51   8.945  -4.893 -13.119
  447    HB2  GLN  51           HB2      GLN  51   7.315  -6.423 -14.194
  448    HB3  GLN  51           HB3      GLN  51   6.629  -4.845 -13.784
  449    HG2  GLN  51           HG2      GLN  51   6.700  -4.140 -16.104
  450    HG3  GLN  51           HG3      GLN  51   7.552  -5.623 -16.564
  451   HE21  GLN  51          HE22      GLN  51   6.221  -7.125 -17.514
  452   HE22  GLN  51          HE21      GLN  51   4.595  -7.490 -16.954
  453    H    ALA  52           H        ALA  52   9.736  -7.099 -13.601
  454    HA   ALA  52           HA       ALA  52  11.439  -7.447 -15.952
  455    HB1  ALA  52           HB1      ALA  52  12.649  -6.964 -13.188
  456    HB2  ALA  52           HB2      ALA  52  13.531  -7.482 -14.637
  457    HB3  ALA  52           HB3      ALA  52  12.793  -5.873 -14.588
  458    H    PHE  53           H        PHE  53  12.640  -9.484 -15.747
  459    HA   PHE  53           HA       PHE  53  11.598 -11.390 -13.702
  460    HD1  PHE  53           HD1      PHE  53   9.675 -13.594 -14.548
  461    HD2  PHE  53           HD2      PHE  53  10.422 -10.628 -17.584
  462    HE1  PHE  53           HE1      PHE  53   7.255 -13.576 -15.130
  463    HE2  PHE  53           HE2      PHE  53   8.000 -10.589 -18.142
  464    HZ   PHE  53           HZ       PHE  53   6.417 -12.072 -16.923
  465    HB2  PHE  53           HB2      PHE  53  12.253 -11.980 -16.616
  466    HB3  PHE  53           HB3      PHE  53  11.930 -13.188 -15.393
  467    H    VAL  54           H        VAL  54  13.223 -12.833 -12.918
  468    HA   VAL  54           HA       VAL  54  15.890 -12.703 -14.048
  469    HB   VAL  54           HB       VAL  54  16.219 -10.808 -12.819
  470   HG11  VAL  54          HG11      VAL  54  14.951 -11.969 -10.324
  471   HG12  VAL  54          HG12      VAL  54  15.662 -10.365 -10.498
  472   HG13  VAL  54          HG13      VAL  54  14.189 -10.757 -11.379
  473   HG21  VAL  54          HG21      VAL  54  17.784 -11.342 -11.031
  474   HG22  VAL  54          HG22      VAL  54  17.201 -13.016 -10.986
  475   HG23  VAL  54          HG23      VAL  54  18.007 -12.399 -12.432
  476    H    ILE  55           H        ILE  55  17.058 -14.448 -13.594
  477    HA   ILE  55           HA       ILE  55  15.587 -16.806 -12.546
  478    HB   ILE  55           HB       ILE  55  17.614 -16.579 -14.816
  479   HG12  ILE  55          HG12      ILE  55  15.751 -17.289 -16.362
  480   HG13  ILE  55          HG13      ILE  55  14.599 -16.888 -15.113
  481   HG21  ILE  55          HG21      ILE  55  17.642 -18.765 -13.717
  482   HG22  ILE  55          HG22      ILE  55  15.882 -18.915 -13.927
  483   HG23  ILE  55          HG23      ILE  55  16.967 -18.911 -15.333
  484   HD11  ILE  55          HD11      ILE  55  14.914 -15.212 -16.975
  485   HD12  ILE  55          HD12      ILE  55  15.037 -14.538 -15.360
  486   HD13  ILE  55          HD13      ILE  55  16.513 -14.851 -16.307
  487    H    PHE  56           H        PHE  56  16.879 -18.150 -11.191
  488    HA   PHE  56           HA       PHE  56  19.529 -17.023 -10.370
  489    HD1  PHE  56           HD1      PHE  56  15.762 -16.295  -9.541
  490    HD2  PHE  56           HD2      PHE  56  19.547 -15.506  -7.631
  491    HE1  PHE  56           HE1      PHE  56  15.117 -13.933  -9.212
  492    HE2  PHE  56           HE2      PHE  56  18.852 -13.154  -7.224
  493    HZ   PHE  56           HZ       PHE  56  16.641 -12.360  -8.055
  494    HB2  PHE  56           HB2      PHE  56  17.257 -18.154  -8.715
  495    HB3  PHE  56           HB3      PHE  56  18.834 -17.764  -8.067
  496    H    LYS  57           H        LYS  57  20.701 -18.546  -8.905
  497    HA   LYS  57           HA       LYS  57  21.637 -20.789 -10.203
  498    HB2  LYS  57           HB2      LYS  57  22.714 -19.519  -8.351
  499    HB3  LYS  57           HB3      LYS  57  21.500 -20.130  -7.229
  500    HG2  LYS  57           HG2      LYS  57  23.541 -21.229  -6.855
  501    HG3  LYS  57           HG3      LYS  57  22.389 -22.410  -7.454
  502    HD2  LYS  57           HD2      LYS  57  24.423 -21.074  -9.295
  503    HD3  LYS  57           HD3      LYS  57  24.856 -22.453  -8.280
  504    HE2  LYS  57           HE2      LYS  57  23.041 -23.804  -9.318
  505    HE3  LYS  57           HE3      LYS  57  22.676 -22.468 -10.409
  506    HZ1  LYS  57           HZ1      LYS  57  24.936 -22.665 -11.295
  507    HZ2  LYS  57           HZ2      LYS  57  25.260 -23.912 -10.288
  508    HZ3  LYS  57           HZ3      LYS  57  24.134 -24.075 -11.451
  509    H    GLU  58           H        GLU  58  19.027 -20.681  -7.685
  510    HA   GLU  58           HA       GLU  58  18.149 -23.390  -8.365
  511    HB2  GLU  58           HB2      GLU  58  20.132 -23.700  -6.873
  512    HB3  GLU  58           HB3      GLU  58  19.377 -22.677  -5.652
  513    HG2  GLU  58           HG2      GLU  58  17.588 -24.295  -5.328
  514    HG3  GLU  58           HG3      GLU  58  18.171 -25.266  -6.688
  515    H    ILE  59           H        ILE  59  16.092 -23.858  -7.290
  516    HA   ILE  59           HA       ILE  59  14.359 -21.658  -7.240
  517    HB   ILE  59           HB       ILE  59  12.641 -23.214  -6.645
  518   HG12  ILE  59          HG12      ILE  59  14.831 -25.197  -5.861
  519   HG13  ILE  59          HG13      ILE  59  13.663 -24.441  -4.778
  520   HG21  ILE  59          HG21      ILE  59  12.775 -24.682  -8.475
  521   HG22  ILE  59          HG22      ILE  59  13.807 -23.326  -8.933
  522   HG23  ILE  59          HG23      ILE  59  14.541 -24.832  -8.372
  523   HD11  ILE  59          HD11      ILE  59  12.935 -26.676  -5.176
  524   HD12  ILE  59          HD12      ILE  59  11.812 -25.601  -6.033
  525   HD13  ILE  59          HD13      ILE  59  13.061 -26.495  -6.931
  526    H    GLY  60           H        GLY  60  15.997 -23.227  -4.480
  527    HA2  GLY  60           HA2      GLY  60  14.437 -21.875  -2.455
  528    HA3  GLY  60           HA3      GLY  60  16.009 -22.673  -2.241
  529    H    SER  61           H        SER  61  17.515 -21.203  -4.171
  530    HA   SER  61           HA       SER  61  18.220 -18.873  -2.683
  531    HG   SER  61           HG       SER  61  20.747 -20.699  -4.448
  532    HB2  SER  61           HB2      SER  61  19.005 -19.564  -5.542
  533    HB3  SER  61           HB3      SER  61  19.904 -18.614  -4.344
  534    H    ALA  62           H        ALA  62  16.395 -19.395  -5.743
  535    HA   ALA  62           HA       ALA  62  15.819 -16.699  -6.382
  536    HB1  ALA  62           HB1      ALA  62  13.882 -17.652  -7.580
  537    HB2  ALA  62           HB2      ALA  62  15.296 -18.693  -7.830
  538    HB3  ALA  62           HB3      ALA  62  14.039 -19.161  -6.674
  539    H    SER  63           H        SER  63  13.991 -19.036  -4.317
  540    HA   SER  63           HA       SER  63  11.952 -17.255  -3.534
  541    HG   SER  63           HG       SER  63  12.533 -20.328  -3.905
  542    HB2  SER  63           HB2      SER  63  13.122 -19.541  -1.893
  543    HB3  SER  63           HB3      SER  63  11.519 -18.812  -1.714
  544    H    ASN  64           H        ASN  64  15.155 -17.845  -2.062
  545    HA   ASN  64           HA       ASN  64  14.714 -16.163   0.197
  546    HB2  ASN  64           HB2      ASN  64  16.537 -17.856   0.068
  547    HB3  ASN  64           HB3      ASN  64  17.376 -16.843  -1.115
  548   HD21  ASN  64          HD22      ASN  64  18.601 -15.081  -0.346
  549   HD22  ASN  64          HD21      ASN  64  18.642 -14.596   1.344
  550    H    ALA  65           H        ALA  65  16.203 -15.444  -2.995
  551    HA   ALA  65           HA       ALA  65  16.818 -12.731  -2.507
  552    HB1  ALA  65           HB1      ALA  65  16.794 -12.510  -4.957
  553    HB2  ALA  65           HB2      ALA  65  17.592 -14.025  -4.494
  554    HB3  ALA  65           HB3      ALA  65  15.927 -14.048  -5.127
  555    H    LEU  66           H        LEU  66  13.874 -14.215  -3.919
  556    HA   LEU  66           HA       LEU  66  12.308 -11.938  -4.320
  557    HG   LEU  66           HG       LEU  66  10.109 -12.809  -5.404
  558    HB2  LEU  66           HB2      LEU  66  11.941 -14.368  -4.969
  559    HB3  LEU  66           HB3      LEU  66  11.348 -14.671  -3.353
  560   HD11  LEU  66          HD11      LEU  66   9.871 -15.057  -6.138
  561   HD12  LEU  66          HD12      LEU  66   9.507 -15.640  -4.511
  562   HD13  LEU  66          HD13      LEU  66   8.325 -14.646  -5.383
  563   HD21  LEU  66          HD21      LEU  66   9.079 -13.634  -2.666
  564   HD22  LEU  66          HD22      LEU  66   9.452 -11.982  -3.218
  565   HD23  LEU  66          HD23      LEU  66   8.091 -12.847  -3.916
  566    H    ARG  67           H        ARG  67  12.385 -14.054  -1.399
  567    HA   ARG  67           HA       ARG  67  10.571 -12.524   0.121
  568    HE   ARG  67           HE       ARG  67  14.048 -13.562   2.656
  569    HB2  ARG  67           HB2      ARG  67  11.324 -14.890   0.620
  570    HB3  ARG  67           HB3      ARG  67  12.932 -14.296   0.964
  571    HG2  ARG  67           HG2      ARG  67  11.495 -12.809   2.793
  572    HG3  ARG  67           HG3      ARG  67  10.443 -14.202   2.624
  573    HD2  ARG  67           HD2      ARG  67  11.971 -14.569   4.458
  574    HD3  ARG  67           HD3      ARG  67  12.401 -15.693   3.157
  575   HH11  ARG  67          HH21      ARG  67  13.505 -15.473   5.599
  576   HH12  ARG  67          HH22      ARG  67  15.086 -15.195   6.227
  577   HH21  ARG  67          HH11      ARG  67  16.118 -13.229   3.435
  578   HH22  ARG  67          HH12      ARG  67  16.618 -13.870   4.970
  579    H    THR  68           H        THR  68  14.191 -12.389   0.040
  580    HA   THR  68           HA       THR  68  14.268 -10.553   2.246
  581    HB   THR  68           HB       THR  68  16.474 -11.158   0.235
  582    HG1  THR  68           HG1      THR  68  15.925 -13.090   0.946
  583   HG21  THR  68          HG21      THR  68  17.927 -10.851   2.255
  584   HG22  THR  68          HG22      THR  68  17.095  -9.363   1.781
  585   HG23  THR  68          HG23      THR  68  16.506 -10.306   3.169
  586    H    MET  69           H        MET  69  14.016 -10.120  -1.274
  587    HA   MET  69           HA       MET  69  14.620  -7.247  -0.992
  588    HB2  MET  69           HB2      MET  69  14.218  -8.999  -3.438
  589    HB3  MET  69           HB3      MET  69  14.654  -7.294  -3.448
  590    HG2  MET  69           HG2      MET  69  16.311  -9.571  -2.285
  591    HG3  MET  69           HG3      MET  69  16.643  -8.694  -3.761
  592    HE1  MET  69           HE1      MET  69  17.667  -5.107  -2.368
  593    HE2  MET  69           HE2      MET  69  17.618  -6.113  -3.825
  594    HE3  MET  69           HE3      MET  69  16.105  -5.641  -3.019
  595    H    GLN  70           H        GLN  70  11.686  -9.227  -1.241
  596    HA   GLN  70           HA       GLN  70  10.103  -7.193  -2.445
  597    HB2  GLN  70           HB2      GLN  70   8.155  -8.198  -1.360
  598    HB3  GLN  70           HB3      GLN  70   9.143  -9.372  -2.226
  599    HG2  GLN  70           HG2      GLN  70   9.913 -10.376  -0.258
  600    HG3  GLN  70           HG3      GLN  70   9.434  -9.022   0.770
  601   HE21  GLN  70          HE22      GLN  70   7.789 -11.268  -1.618
  602   HE22  GLN  70          HE21      GLN  70   6.414 -11.569  -0.557
  603    H    GLY  71           H        GLY  71   9.069  -5.426  -1.718
  604    HA2  GLY  71           HA2      GLY  71   8.533  -3.658  -0.391
  605    HA3  GLY  71           HA3      GLY  71   9.054  -4.559   1.036
  606    H    PHE  72           H        PHE  72  11.796  -4.735  -0.853
  607    HA   PHE  72           HA       PHE  72  13.168  -2.821   0.754
  608    HD1  PHE  72           HD1      PHE  72  15.720  -3.722   1.487
  609    HD2  PHE  72           HD2      PHE  72  15.670  -2.755  -2.715
  610    HE1  PHE  72           HE1      PHE  72  17.950  -2.654   1.704
  611    HE2  PHE  72           HE2      PHE  72  17.913  -1.694  -2.493
  612    HZ   PHE  72           HZ       PHE  72  19.048  -1.639  -0.285
  613    HB2  PHE  72           HB2      PHE  72  14.179  -4.879  -0.188
  614    HB3  PHE  72           HB3      PHE  72  14.020  -4.216  -1.813
  615    HA   PRO  73           HA       PRO  73  12.371   0.694  -2.005
  616    HB2  PRO  73           HB2      PRO  73  13.813   2.645  -0.812
  617    HB3  PRO  73           HB3      PRO  73  12.335   1.947  -0.086
  618    HG2  PRO  73           HG2      PRO  73  15.220   1.219   0.534
  619    HG3  PRO  73           HG3      PRO  73  13.899   1.589   1.688
  620    HD2  PRO  73           HD2      PRO  73  14.592  -0.973   0.973
  621    HD3  PRO  73           HD3      PRO  73  12.912  -0.514   1.378
  622    H    PHE  74           H        PHE  74  13.419  -0.523  -3.726
  623    HA   PHE  74           HA       PHE  74  16.244  -0.826  -3.955
  624    HD1  PHE  74           HD2      PHE  74  16.898  -3.206  -4.994
  625    HD2  PHE  74           HD1      PHE  74  15.032  -1.044  -8.227
  626    HE1  PHE  74           HE2      PHE  74  18.300  -4.430  -6.638
  627    HE2  PHE  74           HE1      PHE  74  16.473  -2.240  -9.853
  628    HZ   PHE  74           HZ       PHE  74  18.046  -3.995  -9.064
  629    HB2  PHE  74           HB2      PHE  74  14.499  -2.245  -4.936
  630    HB3  PHE  74           HB3      PHE  74  14.061  -0.974  -6.068
  631    H    TYR  75           H        TYR  75  14.007   1.517  -5.396
  632    HA   TYR  75           HA       TYR  75  16.110   3.528  -5.505
  633    HD1  TYR  75           HD2      TYR  75  17.519   4.940  -7.382
  634    HD2  TYR  75           HD1      TYR  75  16.532   0.908  -8.563
  635    HE1  TYR  75           HE2      TYR  75  19.867   4.574  -8.057
  636    HE2  TYR  75           HE1      TYR  75  18.879   0.528  -9.235
  637    HH   TYR  75           HH       TYR  75  21.410   3.078  -8.935
  638    HB2  TYR  75           HB2      TYR  75  14.760   2.490  -8.008
  639    HB3  TYR  75           HB3      TYR  75  15.159   4.197  -7.872
  640    H    ASP  76           H        ASP  76  14.726   3.688  -3.632
  641    HA   ASP  76           HA       ASP  76  13.235   4.653  -2.315
  642    HB2  ASP  76           HB2      ASP  76  13.673   6.705  -3.532
  643    HB3  ASP  76           HB3      ASP  76  12.429   6.310  -4.719
  644    H    LYS  77           H        LYS  77  11.837   3.445  -5.353
  645    HA   LYS  77           HA       LYS  77   9.175   3.149  -4.296
  646    HB2  LYS  77           HB2      LYS  77  10.556   1.699  -6.605
  647    HB3  LYS  77           HB3      LYS  77   8.835   1.627  -6.250
  648    HG2  LYS  77           HG2      LYS  77  10.393   4.099  -7.113
  649    HG3  LYS  77           HG3      LYS  77   9.274   3.143  -8.089
  650    HD2  LYS  77           HD2      LYS  77   7.411   3.772  -6.547
  651    HD3  LYS  77           HD3      LYS  77   8.540   4.817  -5.652
  652    HE2  LYS  77           HE2      LYS  77   9.005   6.096  -7.729
  653    HE3  LYS  77           HE3      LYS  77   7.868   5.071  -8.616
  654    HZ1  LYS  77           HZ1      LYS  77   6.839   7.140  -7.927
  655    HZ2  LYS  77           HZ2      LYS  77   6.098   5.901  -7.174
  656    HZ3  LYS  77           HZ3      LYS  77   7.149   6.850  -6.356
  657    HA   PRO  78           HA       PRO  78  10.277  -0.557  -1.918
  658    HB2  PRO  78           HB2      PRO  78   7.783  -1.299  -1.066
  659    HB3  PRO  78           HB3      PRO  78   8.704   0.052  -0.338
  660    HG2  PRO  78           HG2      PRO  78   6.497   0.194  -2.405
  661    HG3  PRO  78           HG3      PRO  78   6.724   1.209  -0.948
  662    HD2  PRO  78           HD2      PRO  78   7.496   1.994  -3.466
  663    HD3  PRO  78           HD3      PRO  78   8.379   2.502  -1.994
  664    H    MET  79           H        MET  79  10.784  -2.345  -3.072
  665    HA   MET  79           HA       MET  79   9.670  -3.017  -5.565
  666    HB2  MET  79           HB2      MET  79  11.213  -4.670  -3.529
  667    HB3  MET  79           HB3      MET  79  10.859  -5.246  -5.165
  668    HG2  MET  79           HG2      MET  79  12.284  -2.621  -4.628
  669    HG3  MET  79           HG3      MET  79  13.136  -4.149  -4.767
  670    HE1  MET  79           HE1      MET  79  13.159  -5.622  -7.134
  671    HE2  MET  79           HE2      MET  79  13.870  -4.514  -8.329
  672    HE3  MET  79           HE3      MET  79  14.435  -4.482  -6.646
  673    H    GLN  80           H        GLN  80   8.287  -4.689  -6.243
  674    HA   GLN  80           HA       GLN  80   6.682  -6.128  -4.205
  675    HB2  GLN  80           HB2      GLN  80   5.638  -4.804  -6.757
  676    HB3  GLN  80           HB3      GLN  80   4.730  -5.930  -5.739
  677    HG2  GLN  80           HG2      GLN  80   4.849  -4.351  -3.835
  678    HG3  GLN  80           HG3      GLN  80   5.821  -3.239  -4.794
  679   HE21  GLN  80          HE22      GLN  80   4.514  -1.454  -5.163
  680   HE22  GLN  80          HE21      GLN  80   2.891  -1.543  -5.795
  681    H    ILE  81           H        ILE  81   6.778  -8.327  -4.700
  682    HA   ILE  81           HA       ILE  81   7.923  -9.112  -7.296
  683    HB   ILE  81           HB       ILE  81   9.179 -10.136  -4.733
  684   HG12  ILE  81          HG12      ILE  81  10.065  -7.612  -6.165
  685   HG13  ILE  81          HG13      ILE  81   9.608  -7.849  -4.459
  686   HG21  ILE  81          HG21      ILE  81  11.012 -10.750  -6.271
  687   HG22  ILE  81          HG22      ILE  81   9.511 -11.337  -6.955
  688   HG23  ILE  81          HG23      ILE  81  10.231  -9.869  -7.598
  689   HD11  ILE  81          HD11      ILE  81  11.618  -9.310  -4.175
  690   HD12  ILE  81          HD12      ILE  81  12.124  -8.837  -5.815
  691   HD13  ILE  81          HD13      ILE  81  11.971  -7.609  -4.555
  692    H    ALA  82           H        ALA  82   7.528 -11.278  -7.796
  693    HA   ALA  82           HA       ALA  82   6.130 -13.056  -5.925
  694    HB1  ALA  82           HB1      ALA  82   4.273 -11.839  -7.067
  695    HB2  ALA  82           HB2      ALA  82   4.966 -12.277  -8.647
  696    HB3  ALA  82           HB3      ALA  82   4.335 -13.538  -7.569
  697    H    TYR  83           H        TYR  83   5.888 -15.259  -7.178
  698    HA   TYR  83           HA       TYR  83   8.422 -15.902  -8.538
  699    HD1  TYR  83           HD2      TYR  83   6.084 -16.836  -5.412
  700    HD2  TYR  83           HD1      TYR  83   4.898 -18.471  -9.216
  701    HE1  TYR  83           HE2      TYR  83   3.778 -17.163  -4.549
  702    HE2  TYR  83           HE1      TYR  83   2.608 -18.834  -8.359
  703    HH   TYR  83           HH       TYR  83   1.624 -17.907  -5.029
  704    HB2  TYR  83           HB2      TYR  83   7.309 -18.203  -8.630
  705    HB3  TYR  83           HB3      TYR  83   7.766 -17.579  -7.061
  706    H    SER  84           H        SER  84   8.497 -16.485 -10.825
  707    HA   SER  84           HA       SER  84   6.514 -15.108 -12.435
  708    HG   SER  84           HG       SER  84   9.389 -17.412 -13.920
  709    HB2  SER  84           HB2      SER  84   7.993 -15.907 -14.292
  710    HB3  SER  84           HB3      SER  84   8.892 -15.073 -13.010
  711    H    LYS  85           H        LYS  85   6.761 -18.300 -11.198
  712    HA   LYS  85           HA       LYS  85   6.015 -19.930 -13.266
  713    HB2  LYS  85           HB2      LYS  85   6.839 -20.481 -10.926
  714    HB3  LYS  85           HB3      LYS  85   5.165 -20.362 -10.375
  715    HG2  LYS  85           HG2      LYS  85   4.509 -22.252 -11.733
  716    HG3  LYS  85           HG3      LYS  85   6.046 -22.228 -12.608
  717    HD2  LYS  85           HD2      LYS  85   6.043 -24.056 -11.012
  718    HD3  LYS  85           HD3      LYS  85   7.270 -22.868 -10.573
  719    HE2  LYS  85           HE2      LYS  85   5.660 -21.919  -8.863
  720    HE3  LYS  85           HE3      LYS  85   4.521 -23.201  -9.292
  721    HZ1  LYS  85           HZ1      LYS  85   5.740 -23.872  -7.379
  722    HZ2  LYS  85           HZ2      LYS  85   6.279 -24.803  -8.598
  723    HZ3  LYS  85           HZ3      LYS  85   7.195 -23.554  -8.040
  724    H    SER  86           H        SER  86   3.795 -17.861 -11.427
  725    HA   SER  86           HA       SER  86   1.361 -19.064 -12.445
  726    HG   SER  86           HG       SER  86   1.980 -16.089  -9.764
  727    HB2  SER  86           HB2      SER  86   0.488 -16.863 -11.324
  728    HB3  SER  86           HB3      SER  86   1.155 -18.153 -10.326
  729    H    ASP  87           H        ASP  87   2.991 -18.642 -14.607
  730    HA   ASP  87           HA       ASP  87   3.270 -16.188 -15.781
  731    HB2  ASP  87           HB2      ASP  87   4.352 -18.180 -16.609
  732    HB3  ASP  87           HB3      ASP  87   2.806 -18.871 -17.108
  733    H    SER  88           H        SER  88   0.446 -18.397 -16.417
  734    HA   SER  88           HA       SER  88  -0.819 -16.627 -18.210
  735    HG   SER  88           HG       SER  88  -1.575 -20.163 -17.973
  736    HB2  SER  88           HB2      SER  88  -2.140 -18.679 -16.404
  737    HB3  SER  88           HB3      SER  88  -2.724 -18.082 -17.971
  738    H    ASP  89           H        ASP  89  -0.803 -16.617 -14.647
  739    HA   ASP  89           HA       ASP  89  -3.217 -14.975 -14.443
  740    HB2  ASP  89           HB2      ASP  89  -2.605 -16.466 -12.593
  741    HB3  ASP  89           HB3      ASP  89  -1.074 -15.608 -12.389
  742    H    ILE  90           H        ILE  90   0.327 -14.446 -14.164
  743    HA   ILE  90           HA       ILE  90   0.010 -11.607 -13.796
  744    HB   ILE  90           HB       ILE  90   2.373 -11.376 -14.236
  745   HG12  ILE  90          HG12      ILE  90   2.434 -14.345 -14.855
  746   HG13  ILE  90          HG13      ILE  90   2.660 -13.053 -16.044
  747   HG21  ILE  90          HG21      ILE  90   1.796 -13.798 -12.477
  748   HG22  ILE  90          HG22      ILE  90   3.116 -12.628 -12.287
  749   HG23  ILE  90          HG23      ILE  90   1.447 -12.112 -12.031
  750   HD11  ILE  90          HD11      ILE  90   4.803 -13.965 -15.449
  751   HD12  ILE  90          HD12      ILE  90   4.694 -12.312 -14.814
  752   HD13  ILE  90          HD13      ILE  90   4.514 -13.710 -13.724
  753    H    VAL  91           H        VAL  91   0.286 -13.632 -16.737
  754    HA   VAL  91           HA       VAL  91   0.382 -11.418 -18.514
  755    HB   VAL  91           HB       VAL  91  -0.435 -14.318 -18.786
  756   HG11  VAL  91          HG11      VAL  91  -0.492 -12.194 -20.960
  757   HG12  VAL  91          HG12      VAL  91  -0.400 -13.947 -21.256
  758   HG13  VAL  91          HG13      VAL  91  -1.815 -13.266 -20.449
  759   HG21  VAL  91          HG21      VAL  91   2.008 -13.664 -18.547
  760   HG22  VAL  91          HG22      VAL  91   1.637 -14.452 -20.082
  761   HG23  VAL  91          HG23      VAL  91   1.847 -12.688 -20.014
  762    H    ALA  92           H        ALA  92  -2.414 -13.168 -17.013
  763    HA   ALA  92           HA       ALA  92  -4.394 -11.616 -18.336
  764    HB1  ALA  92           HB1      ALA  92  -5.911 -12.378 -16.588
  765    HB2  ALA  92           HB2      ALA  92  -4.898 -13.719 -17.153
  766    HB3  ALA  92           HB3      ALA  92  -4.553 -12.932 -15.594
  767    H    LYS  93           H        LYS  93  -2.388 -10.891 -15.425
  768    HA   LYS  93           HA       LYS  93  -3.863  -8.481 -14.801
  769    HB2  LYS  93           HB2      LYS  93  -0.926  -9.065 -14.222
  770    HB3  LYS  93           HB3      LYS  93  -1.884  -7.768 -13.538
  771    HG2  LYS  93           HG2      LYS  93  -2.223 -10.737 -13.021
  772    HG3  LYS  93           HG3      LYS  93  -1.631  -9.511 -11.914
  773    HD2  LYS  93           HD2      LYS  93  -3.882  -8.422 -11.938
  774    HD3  LYS  93           HD3      LYS  93  -4.475  -9.725 -12.998
  775    HE2  LYS  93           HE2      LYS  93  -3.862 -11.406 -11.285
  776    HE3  LYS  93           HE3      LYS  93  -3.281 -10.120 -10.221
  777    HZ1  LYS  93           HZ1      LYS  93  -6.084 -10.438 -11.132
  778    HZ2  LYS  93           HZ2      LYS  93  -5.522 -10.795  -9.646
  779    HZ3  LYS  93           HZ3      LYS  93  -5.546  -9.246 -10.149
  780    H    ILE  94           H        ILE  94  -0.876  -8.980 -16.815
  781    HA   ILE  94           HA       ILE  94  -0.856  -6.111 -17.294
  782    HB   ILE  94           HB       ILE  94   1.248  -6.383 -18.337
  783   HG12  ILE  94          HG12      ILE  94   0.829  -9.385 -18.205
  784   HG13  ILE  94          HG13      ILE  94   0.878  -8.408 -19.669
  785   HG21  ILE  94          HG21      ILE  94   2.486  -7.136 -16.444
  786   HG22  ILE  94          HG22      ILE  94   0.987  -6.452 -15.825
  787   HG23  ILE  94          HG23      ILE  94   1.186  -8.218 -15.911
  788   HD11  ILE  94          HD11      ILE  94   3.252  -7.784 -19.120
  789   HD12  ILE  94          HD12      ILE  94   3.192  -8.947 -17.770
  790   HD13  ILE  94          HD13      ILE  94   2.995  -9.513 -19.434
  791    H    LYS  95           H        LYS  95  -2.150  -8.771 -19.178
  792    HA   LYS  95           HA       LYS  95  -2.550  -6.809 -21.412
  793    HB2  LYS  95           HB2      LYS  95  -0.914  -8.601 -21.951
  794    HB3  LYS  95           HB3      LYS  95  -2.165  -9.820 -21.737
  795    HG2  LYS  95           HG2      LYS  95  -2.642  -7.489 -23.629
  796    HG3  LYS  95           HG3      LYS  95  -1.542  -8.768 -24.119
  797    HD2  LYS  95           HD2      LYS  95  -3.268 -10.459 -23.966
  798    HD3  LYS  95           HD3      LYS  95  -4.429  -9.291 -23.304
  799    HE2  LYS  95           HE2      LYS  95  -4.402  -7.981 -25.347
  800    HE3  LYS  95           HE3      LYS  95  -3.116  -8.980 -26.038
  801    HZ1  LYS  95           HZ1      LYS  95  -5.764 -10.103 -25.310
  802    HZ2  LYS  95           HZ2      LYS  95  -5.423  -9.540 -26.819
  803    HZ3  LYS  95           HZ3      LYS  95  -4.609 -10.803 -26.214
  804    H    GLY  96           H        GLY  96  -3.911  -9.905 -20.122
  805    HA2  GLY  96           HA2      GLY  96  -6.131  -9.242 -18.899
  806    HA3  GLY  96           HA3      GLY  96  -6.649  -8.747 -20.506
  807    H    THR  97           H        THR  97  -5.834 -10.553 -22.221
  808    HA   THR  97           HA       THR  97  -7.402 -12.855 -21.949
  809    HB   THR  97           HB       THR  97  -4.920 -12.466 -23.665
  810    HG1  THR  97           HG1      THR  97  -7.513 -11.377 -24.012
  811   HG21  THR  97          HG21      THR  97  -7.573 -13.847 -24.265
  812   HG22  THR  97          HG22      THR  97  -6.230 -13.615 -25.409
  813   HG23  THR  97          HG23      THR  97  -6.007 -14.650 -23.997
  814    H    PHE  98           H        PHE  98  -6.810 -15.066 -21.514
  815    HA   PHE  98           HA       PHE  98  -5.188 -15.410 -19.257
  816    HD1  PHE  98           HD2      PHE  98  -6.212 -17.106 -17.514
  817    HD2  PHE  98           HD1      PHE  98  -4.832 -19.468 -20.853
  818    HE1  PHE  98           HE2      PHE  98  -5.435 -18.869 -15.951
  819    HE2  PHE  98           HE1      PHE  98  -4.054 -21.223 -19.285
  820    HZ   PHE  98           HZ       PHE  98  -4.360 -20.934 -16.832
  821    HB2  PHE  98           HB2      PHE  98  -7.102 -16.844 -19.956
  822    HB3  PHE  98           HB3      PHE  98  -6.122 -17.505 -21.258
  823    H    LYS  99           H        LYS  99  -4.346 -15.750 -22.668
  824    HA   LYS  99           HA       LYS  99  -1.501 -16.001 -21.884
  825    HB2  LYS  99           HB2      LYS  99  -2.705 -17.194 -24.416
  826    HB3  LYS  99           HB3      LYS  99  -1.019 -17.238 -23.946
  827    HG2  LYS  99           HG2      LYS  99  -3.334 -18.790 -22.756
  828    HG3  LYS  99           HG3      LYS  99  -1.954 -19.401 -23.648
  829    HD2  LYS  99           HD2      LYS  99  -2.081 -18.487 -20.776
  830    HD3  LYS  99           HD3      LYS  99  -1.591 -20.037 -21.432
  831    HE2  LYS  99           HE2      LYS  99   0.458 -18.880 -22.423
  832    HE3  LYS  99           HE3      LYS  99  -0.033 -17.419 -21.555
  833    HZ1  LYS  99           HZ1      LYS  99   1.451 -18.472 -20.119
  834    HZ2  LYS  99           HZ2      LYS  99   0.001 -18.911 -19.502
  835    HZ3  LYS  99           HZ3      LYS  99   0.849 -19.978 -20.402
  836    H    GLU 100           H        GLU 100  -0.119 -14.828 -23.480
  837    HA   GLU 100           HA       GLU 100  -1.493 -12.377 -24.308
  838    HB2  GLU 100           HB2      GLU 100   0.521 -12.205 -23.016
  839    HB3  GLU 100           HB3      GLU 100   1.447 -13.121 -24.220
  840    HG2  GLU 100           HG2      GLU 100   1.048 -11.292 -25.876
  841    HG3  GLU 100           HG3      GLU 100   0.026 -10.459 -24.709
  842    H    ARG 101           H        ARG 101  -2.798 -13.369 -25.860
  843    HA   ARG 101           HA       ARG 101  -1.537 -13.627 -28.537
  844    HE   ARG 101           HE       ARG 101  -4.360 -17.129 -26.890
  845    HB2  ARG 101           HB2      ARG 101  -3.858 -15.262 -27.417
  846    HB3  ARG 101           HB3      ARG 101  -3.315 -15.303 -29.095
  847    HG2  ARG 101           HG2      ARG 101  -1.108 -16.181 -28.377
  848    HG3  ARG 101           HG3      ARG 101  -1.647 -16.184 -26.692
  849    HD2  ARG 101           HD2      ARG 101  -2.892 -17.808 -28.947
  850    HD3  ARG 101           HD3      ARG 101  -1.782 -18.414 -27.710
  851   HH11  ARG 101          HH21      ARG 101  -2.475 -20.159 -27.033
  852   HH12  ARG 101          HH22      ARG 101  -3.506 -20.969 -25.912
  853   HH21  ARG 101          HH11      ARG 101  -5.619 -18.105 -25.525
  854   HH22  ARG 101          HH12      ARG 101  -5.399 -19.764 -24.993
  855    HA   PRO 102           HA       PRO 102  -3.979 -10.281 -29.579
  856    HB2  PRO 102           HB2      PRO 102  -5.391 -11.825 -31.768
  857    HB3  PRO 102           HB3      PRO 102  -4.658 -10.192 -31.829
  858    HG2  PRO 102           HG2      PRO 102  -3.299 -12.328 -32.787
  859    HG3  PRO 102           HG3      PRO 102  -2.450 -11.102 -31.792
  860    HD2  PRO 102           HD2      PRO 102  -3.470 -13.818 -30.962
  861    HD3  PRO 102           HD3      PRO 102  -1.939 -12.999 -30.538
  862    H    LYS 103           H        LYS 103  -6.294 -12.980 -30.019
  863    HA   LYS 103           HA       LYS 103  -8.156 -11.843 -28.026
  864    HB2  LYS 103           HB2      LYS 103  -8.913 -12.293 -30.955
  865    HB3  LYS 103           HB3      LYS 103 -10.048 -11.923 -29.652
  866    HG2  LYS 103           HG2      LYS 103  -8.869  -9.745 -29.278
  867    HG3  LYS 103           HG3      LYS 103  -7.905 -10.059 -30.731
  868    HD2  LYS 103           HD2      LYS 103 -10.943  -9.844 -30.637
  869    HD3  LYS 103           HD3      LYS 103  -9.829  -8.569 -31.152
  870    HE2  LYS 103           HE2      LYS 103  -8.993 -10.041 -32.983
  871    HE3  LYS 103           HE3      LYS 103 -10.144 -11.292 -32.496
  872    HZ1  LYS 103           HZ1      LYS 103 -10.997  -9.974 -34.323
  873    HZ2  LYS 103           HZ2      LYS 103 -11.942  -9.746 -33.016
  874    HZ3  LYS 103           HZ3      LYS 103 -10.877  -8.592 -33.472
  875    H    LYS 104           H        LYS 104  -6.596 -14.186 -27.787
  876    HA   LYS 104           HA       LYS 104  -8.585 -16.367 -28.166
  877    HB2  LYS 104           HB2      LYS 104  -6.985 -16.404 -30.061
  878    HB3  LYS 104           HB3      LYS 104  -5.639 -16.538 -28.920
  879    HG2  LYS 104           HG2      LYS 104  -6.579 -18.689 -28.077
  880    HG3  LYS 104           HG3      LYS 104  -7.940 -18.527 -29.203
  881    HD2  LYS 104           HD2      LYS 104  -6.363 -18.599 -31.118
  882    HD3  LYS 104           HD3      LYS 104  -4.998 -18.758 -29.990
  883    HE2  LYS 104           HE2      LYS 104  -5.960 -20.872 -29.117
  884    HE3  LYS 104           HE3      LYS 104  -7.339 -20.707 -30.209
  885    HZ1  LYS 104           HZ1      LYS 104  -5.806 -20.907 -32.078
  886    HZ2  LYS 104           HZ2      LYS 104  -4.525 -21.061 -31.072
  887    HZ3  LYS 104           HZ3      LYS 104  -5.681 -22.206 -31.107