*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   10-MAR-03   1OQK              
*TITLE     STRUCTURE OF MTH11: A HOMOLOGUE OF HUMAN RNASE P PROTEIN              
*TITLE    2 RPP29                                                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HYPOTHETICAL PROTEIN MTH11;                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: METHANOBACTERIUM THERMOAUTOTROPHICUM;           
*SOURCE   3 ORGANISM_COMMON: ARCHAEA;                                            
*SOURCE   4 GENE: MTH11;                                                         
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: MTH11/PET-15B                             
*KEYWDS    OB FOLD, STRUCTURAL GENOMICS                                          
*EXPDTA    NMR, 22 STRUCTURES                                                    
*AUTHOR    W.P.BOOMERSHINE, C.A.MCELROY, H.TSAI, V.GOPALAN, M.P.FOSTER           
*REVDAT   1   13-JAN-04 1OQK    0                                                


noech033103sss

assign ( resid 36 and name HA# ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  18
assign ( resid 36 and name HA# ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  25
assign ( resid 46 and name HB# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  34
assign ( resid 46 and name HB# ) ( resid 46 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  35
assign ( resid 46 and name HB# ) ( resid 23 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  37
assign ( resid 46 and name HB# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  39
assign ( resid 72 and name HA# ) ( resid 71 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  77
assign ( resid 85 and name HD# ) ( resid 88 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  114
assign ( resid 54 and name HD# ) ( resid 54 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  125
assign ( resid 43 and name HD# ) ( resid 43 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  126
assign ( resid 40 and name HB# ) ( resid 47 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  127
assign ( resid 80 and name HD# ) ( resid 81 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  128
assign ( resid 80 and name HD# ) ( resid 80 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  144
assign ( resid 25 and name HD# ) ( resid 64 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  148
assign ( resid 80 and name HD# or resid 43 and name HD# ) ( resid 80 and 
name HB# or resid 43 and name HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  151
assign ( resid 37 and name HD# or resid 22 and name HD# ) ( resid 18 and 
name HA# or resid 35 and name HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  152
assign ( resid 25 and name HD# ) ( resid 31 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  154
assign ( resid 25 and name HD# ) ( resid 25 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  155
assign ( resid 47 and name HD# ) ( resid 47 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  159
assign ( resid 47 and name HD# ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  160
assign ( resid 47 and name HD# ) ( resid 57 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  162
assign ( resid 47 and name HD# ) ( resid 47 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  165
assign ( resid 47 and name HD# ) ( resid 47 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  166
assign ( resid 47 and name HD# ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  167
assign ( resid 47 and name HD# ) ( resid 47 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  168
assign ( resid 74 and name HB# ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  171
assign ( resid 54 and name HD# ) ( resid 50 and name HE1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  177
assign ( resid 43 and name HD# ) ( resid 43 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  178
assign ( resid 80 and name HD# or resid 54 and name HD# ) ( resid 81 and 
name HA or resid 54 and name HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  180
assign ( resid 80 and name HD# ) ( resid 80 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  181
assign ( resid 80 and name HD# or resid 29 and name HD# or resid 22 and name 
HD# ) ( resid 80 and name HG# or resid 29 and name HG# or resid 22 and name 
HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  183
assign ( resid 22 and name HD# ) ( resid 22 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  184
assign ( resid 37 and name HD# ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  185
assign ( resid 85 and name HD# ) ( resid 84 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  186
assign ( resid 85 and name HD# or resid 25 and name HD# ) ( resid 85 and 
name HG# or resid 25 and name HG# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  194
assign ( resid 37 and name HD# ) ( resid 37 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  195
assign ( resid 25 and name HD# ) ( resid 64 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  196
assign ( resid 47 and name HD# ) ( resid 57 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  203
assign ( resid 47 and name HD# ) ( resid 40 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  205
assign ( resid 37 and name HD# or resid 25 and name HD# ) ( resid 37 and 
name HG# or resid 25 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  207
assign ( resid 47 and name HD# or resid 25 and name HD# ) ( resid 39 and 
name HG# or resid 64 and name HG# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  208
assign ( resid 47 and name HD# ) ( resid 42 and name HG21 or resid 57 and 
name HG21 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  210
assign ( resid 68 and name HD# ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  211
assign ( resid 37 and name HD# ) ( resid 20 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  212
assign ( resid 68 and name HD# ) ( resid 72 and name HA# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  214
assign ( resid 25 and name HD# or resid 68 and name HD# or resid 25 and name 
HD# ) ( resid 25 and name HB# or resid 68 and name HB# or resid 64 and name 
HB ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  219
assign ( resid 68 and name HD# or resid 85 and name HD# or resid 68 and name 
HD# ) ( resid 68 and name HG# or resid 85 and name HB# or resid 74 and name 
HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  220
assign ( resid 74 and name HB# ) ( resid 74 and name HG ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  224
assign ( resid 74 and name HB# ) ( resid 68 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  227
assign ( resid 74 and name HB# ) ( resid 74 and name HG ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  228
assign ( resid 74 and name HB# ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  229
assign ( resid 74 and name HB# ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  232
assign ( resid 22 and name HD# ) ( resid 35 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  235
assign ( resid 85 and name HD# ) ( resid 83 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  236
assign ( resid 68 and name HD# ) ( resid 72 and name HA# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  237
assign ( resid 25 and name HD# ) ( resid 64 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  238
assign ( resid 68 and name HD# ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  239
assign ( resid 29 and name HD# ) ( resid 29 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  244
assign ( resid 82 and name HB# ) ( resid 82 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  246
assign ( resid 82 and name HB# ) ( resid 82 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  248
assign ( resid 16 and name HB# ) ( resid 16 and name HG ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  249
assign ( resid 77 and name HB ) ( resid 77 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  258
assign ( resid 77 and name HB ) ( resid 77 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  260
assign ( resid 77 and name HB ) ( resid 77 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  261
assign ( resid 56 and name HB ) ( resid 56 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  264
assign ( resid 5 and name HB# ) ( resid 7 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  267
assign ( resid 5 and name HB# ) ( resid 5 and name HA ) 2.30 0.50 0.50 !FROM 
PEAK NUMBER:  268
assign ( resid 5 and name HB# ) ( resid 5 and name HG ) 2.30 0.50 0.50 !FROM 
PEAK NUMBER:  269
assign ( resid 77 and name HB ) ( resid 77 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  273
assign ( resid 56 and name HB ) ( resid 56 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  274
assign ( resid 56 and name HB ) ( resid 56 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  276
assign ( resid 56 and name HB ) ( resid 56 and name HG2# or resid 56 and 
name HD11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  277
assign ( resid 48 and name HB ) ( resid 48 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  278
assign ( resid 48 and name HB ) ( resid 48 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  279
assign ( resid 96 and name HE# ) ( resid 94 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  290
assign ( resid 78 and name HB# ) ( resid 80 and name HD# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  297
assign ( resid 91 and name HE# ) ( resid 91 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  299
assign ( resid 93 and name HE# or resid 91 and name HE# or resid 93 and name 
HE# ) ( resid 93 and name HD# or resid 91 and name HD# or resid 93 and name 
HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  300
assign ( resid 93 and name HE# ) ( resid 94 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  304
assign ( resid 93 and name HE# ) ( resid 93 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  311
assign ( resid 78 and name HB# ) ( resid 80 and name HD# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  316
assign ( resid 56 and name HB ) ( resid 50 and name HE1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  323
assign ( resid 19 and name HB# ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  336
assign ( resid 19 and name HB# ) ( resid 19 and name HG or resid 68 and name 
HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  337
assign ( resid 78 and name HB# ) ( resid 78 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  344
assign ( resid 91 and name HE# ) ( resid 90 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  349
assign ( resid 78 and name HB# ) ( resid 78 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  351
assign ( resid 52 and name HB# ) ( resid 52 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  378
assign ( resid 51 and name HB# ) ( resid 51 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  380
assign ( resid 52 and name HB# ) ( resid 52 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  382
assign ( resid 94 and name HB# ) ( resid 94 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  392
assign ( resid 10 and name HB# ) ( resid 10 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  415
assign ( resid 10 and name HB# ) ( resid 10 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  418
assign ( resid 6 and name HB ) ( resid 6 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  432
assign ( resid 6 and name HB ) ( resid 6 and name HG2# or resid 6 and name 
HD11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  433
assign ( resid 31 and name HB ) ( resid 31 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  436
assign ( resid 31 and name HB ) ( resid 31 and name HD11 or resid 31 and 
name HG2# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  437
assign ( resid 90 and name HB ) ( resid 90 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  440
assign ( resid 90 and name HB ) ( resid 90 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  441
assign ( resid 11 and name HB ) ( resid 11 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  444
assign ( resid 6 and name HB ) ( resid 6 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  445
assign ( resid 11 and name HB ) ( resid 11 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  446
assign ( resid 90 and name HB ) ( resid 90 and name HG2# or resid 90 and 
name HD11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  452
assign ( resid 34 and name HB ) ( resid 58 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  456
assign ( resid 34 and name HB ) ( resid 34 and name HD11 or resid 23 and 
name HD11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  460
assign ( resid 34 and name HB ) ( resid 34 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  461
assign ( resid 34 and name HB ) ( resid 34 and name HD11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  463
assign ( resid 34 and name HB ) ( resid 23 and name HG11 or resid 48 and 
name HG11 or resid 56 and name HG11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  467
assign ( resid 17 and name HB ) ( resid 17 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  482
assign ( resid 45 and name HB ) ( resid 42 and name HG21 or resid 57 and 
name HG21 ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  493
assign ( resid 45 and name HB ) ( resid 45 and name HG21 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  494
assign ( resid 49 and name HG# or resid 55 and name HG# or resid 49 and name 
HG# ) ( resid 49 and name HB# or resid 55 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  498
assign ( resid 55 and name HG# or resid 49 and name HG# or resid 55 and name 
HG# ) ( resid 55 and name HB# or resid 54 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  499
assign ( resid 49 and name HG# ) ( resid 54 and name HB# or resid 55 and 
name HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  509
assign ( resid 88 and name HG# ) ( resid 88 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  510
assign ( resid 88 and name HG# ) ( resid 88 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  513
assign ( resid 73 and name HG# ) ( resid 73 and name HA or resid 71 and name 
HA or resid 72 and name HA# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  526
assign ( resid 73 and name HG# ) ( resid 71 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  527
assign ( resid 73 and name HG# ) ( resid 73 and name HB# or resid 71 and 
name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  529
assign ( resid 73 and name HG# ) ( resid 69 and name HG1 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  530
assign ( resid 73 and name HG# ) ( resid 71 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  534
assign ( resid 21 and name HB ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  542
assign ( resid 21 and name HB ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  546
assign ( resid 23 and name HB ) ( resid 23 and name HD11 or resid 34 and 
name HD11 ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  551
assign ( resid 71 and name HG# ) ( resid 71 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  554
assign ( resid 71 and name HG# ) ( resid 71 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  558
assign ( resid 71 and name HG# ) ( resid 71 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  559
assign ( resid 71 and name HG# ) ( resid 71 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  561
assign ( resid 71 and name HG# ) ( resid 71 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  562
assign ( resid 32 and name HG# ) ( resid 25 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  566
assign ( resid 32 and name HG# ) ( resid 32 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  568
assign ( resid 58 and name HB ) ( resid 58 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  579
assign ( resid 58 and name HB ) ( resid 56 and name HD11 or resid 34 and 
name HD11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  580
assign ( resid 75 and name HB ) ( resid 75 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  582
assign ( resid 50 and name HB# ) ( resid 50 and name HG# or resid 52 and 
name HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  583
assign ( resid 71 and name HG# ) ( resid 73 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  586
assign ( resid 22 and name HB# ) ( resid 22 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  588
assign ( resid 22 and name HB# ) ( resid 22 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  589
assign ( resid 22 and name HB# or resid 25 and name HB# ) ( resid 22 and 
name HD# or resid 25 and name HD# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  590
assign ( resid 25 and name HB# or resid 22 and name HB# ) ( resid 25 and 
name HD# or resid 66 and name HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  600
assign ( resid 25 and name HB# ) ( resid 64 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  605
assign ( resid 25 and name HB# ) ( resid 25 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  606
assign ( resid 25 and name HB# ) ( resid 64 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  607
assign ( resid 39 and name HB ) ( resid 39 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  618
assign ( resid 39 and name HB ) ( resid 39 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  620
assign ( resid 39 and name HB ) ( resid 39 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  621
assign ( resid 37 and name HB# or resid 64 and name HB ) ( resid 37 and name 
HD# or resid 25 and name HD# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  622
assign ( resid 37 and name HB# or resid 64 and name HB ) ( resid 37 and name 
HG# or resid 25 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  623
assign ( resid 64 and name HB ) ( resid 64 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  643
assign ( resid 64 and name HB ) ( resid 64 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  644
assign ( resid 93 and name HB# ) ( resid 90 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  654
assign ( resid 93 and name HB# or resid 92 and name HB# or resid 64 and name 
HB ) ( resid 93 and name HA or resid 92 and name HA or resid 64 and name HA 
) 2.30 0.50 0.50 !FROM PEAK NUMBER:  656
assign ( resid 93 and name HB# ) ( resid 93 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  657
assign ( resid 93 and name HB# ) ( resid 90 and name HD11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  658
assign ( resid 91 and name HB# ) ( resid 91 and name HA or resid 92 and name 
HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  669
assign ( resid 91 and name HB# ) ( resid 91 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  672
assign ( resid 91 and name HB# or resid 47 and name HB# ) ( resid 90 and 
name HG2# or resid 46 and name HD# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  673
assign ( resid 47 and name HB# or resid 91 and name HB# ) ( resid 47 and 
name HG# or resid 91 and name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  674
assign ( resid 7 and name HB ) ( resid 7 and name HG21 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  681
assign ( resid 4 and name HB# ) ( resid 5 and name HA ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  683
assign ( resid 55 and name HB# or resid 47 and name HB# ) ( resid 55 and 
name HG# or resid 49 and name HG# or resid 40 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  685
assign ( resid 50 and name HG# ) ( resid 50 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  688
assign ( resid 4 and name HB# ) ( resid 5 and name HG ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  697
assign ( resid 41 and name HB# ) ( resid 41 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  709
assign ( resid 68 and name HB# or resid 96 and name HB# ) ( resid 68 and 
name HG# or resid 96 and name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  714
assign ( resid 86 and name HB# ) ( resid 85 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  723
assign ( resid 83 and name HB ) ( resid 83 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  727
assign ( resid 83 and name HB ) ( resid 83 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  728
assign ( resid 68 and name HB# ) ( resid 68 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  736
assign ( resid 68 and name HB# ) ( resid 68 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  737
assign ( resid 86 and name HB# ) ( resid 86 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  743
assign ( resid 59 and name HB# ) ( resid 59 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  747
assign ( resid 86 and name HB# ) ( resid 86 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  755
assign ( resid 86 and name HB# or resid 9 and name HB# ) ( resid 86 and name 
HA or resid 9 and name HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  757
assign ( resid 27 and name HB ) ( resid 27 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  759
assign ( resid 49 and name HB# ) ( resid 55 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  761
assign ( resid 27 and name HB ) ( resid 27 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  762
assign ( resid 49 and name HB# ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  765
assign ( resid 59 and name HB# ) ( resid 59 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  767
assign ( resid 59 and name HB# ) ( resid 59 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  768
assign ( resid 54 and name HB# ) ( resid 54 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  777
assign ( resid 9 and name HB# or resid 70 and name HB# ) ( resid 9 and name 
HA or resid 71 and name HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  787
assign ( resid 54 and name HB# or resid 9 and name HB# ) ( resid 54 and name 
HA or resid 9 and name HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  788
assign ( resid 9 and name HB# ) ( resid 9 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  795
assign ( resid 9 and name HB# or resid 54 and name HB# ) ( resid 9 and name 
HA or resid 54 and name HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  796
assign ( resid 70 and name HB# ) ( resid 71 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  808
assign ( resid 73 and name HB# ) ( resid 73 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  825
assign ( resid 73 and name HB# ) ( resid 73 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  826
assign ( resid 88 and name HB# ) ( resid 88 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  841
assign ( resid 88 and name HB# or resid 87 and name HB# ) ( resid 88 and 
name HG# or resid 87 and name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  842
assign ( resid 87 and name HB# ) ( resid 88 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  845
assign ( resid 43 and name HB# ) ( resid 43 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  847
assign ( resid 87 and name HB# or resid 88 and name HB# ) ( resid 87 and 
name HG# or resid 88 and name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  853
assign ( resid 43 and name HB# ) ( resid 43 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  854
assign ( resid 80 and name HB# ) ( resid 80 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  856
assign ( resid 43 and name HB# ) ( resid 43 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  857
assign ( resid 29 and name HB# ) ( resid 29 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  863
assign ( resid 80 and name HB# or resid 29 and name HB# ) ( resid 80 and 
name HD# or resid 29 and name HD# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  864
assign ( resid 29 and name HB# or resid 80 and name HB# ) ( resid 29 and 
name HG# or resid 80 and name HG# or resid 64 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  866
assign ( resid 43 and name HB# ) ( resid 43 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  867
assign ( resid 35 and name HB# ) ( resid 34 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  872
assign ( resid 87 and name HB# ) ( resid 87 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  885
assign ( resid 87 and name HB# ) ( resid 87 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  886
assign ( resid 29 and name HG# or resid 96 and name HD# ) ( resid 29 and 
name HB# or resid 96 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  917
assign ( resid 96 and name HD# ) ( resid 96 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  923
assign ( resid 29 and name HG# ) ( resid 29 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  934
assign ( resid 91 and name HD# ) ( resid 91 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  935
assign ( resid 93 and name HD# ) ( resid 93 and name HE# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  936
assign ( resid 91 and name HD# ) ( resid 91 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  938
assign ( resid 93 and name HD# or resid 91 and name HD# ) ( resid 93 and 
name HG# or resid 91 and name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  940
assign ( resid 93 and name HD# ) ( resid 93 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  941
assign ( resid 28 and name HB# ) ( resid 26 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  973
assign ( resid 17 and name HG11 ) ( resid 17 and name HD11 or resid 17 and 
name HG2# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  975
assign ( resid 34 and name HG11 ) ( resid 34 and name HB or resid 58 and 
name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  976
assign ( resid 34 and name HG12 ) ( resid 34 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  977
assign ( resid 71 and name HB# ) ( resid 71 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  992
assign ( resid 34 and name HG11 ) ( resid 34 and name HB or resid 58 and 
name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  995
assign ( resid 34 and name HG11 ) ( resid 34 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  997
assign ( resid 34 and name HG11 ) ( resid 34 and name HD11 or resid 23 and 
name HD11 or resid 56 and name HG2# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  998
assign ( resid 34 and name HG12 ) ( resid 34 and name HB or resid 58 and 
name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  999
assign ( resid 34 and name HG12 ) ( resid 58 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1000
assign ( resid 71 and name HB# ) ( resid 71 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1009
assign ( resid 71 and name HB# ) ( resid 71 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1010
assign ( resid 71 and name HB# ) ( resid 71 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1014
assign ( resid 71 and name HB# ) ( resid 71 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1017
assign ( resid 70 and name HA ) ( resid 70 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1026
assign ( resid 54 and name HG# ) ( resid 54 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1032
assign ( resid 70 and name HA ) ( resid 70 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1040
assign ( resid 70 and name HA ) ( resid 71 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1043
assign ( resid 59 and name HG# ) ( resid 59 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1052
assign ( resid 59 and name HG# ) ( resid 59 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1053
assign ( resid 59 and name HG# ) ( resid 59 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1055
assign ( resid 54 and name HG# ) ( resid 54 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1062
assign ( resid 77 and name HG11 ) ( resid 77 and name HD11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1063
assign ( resid 77 and name HG11 ) ( resid 77 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1064
assign ( resid 48 and name HG11 or resid 23 and name HG11 ) ( resid 48 and 
name HD11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1065
assign ( resid 47 and name HG# ) ( resid 47 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1066
assign ( resid 77 and name HG12 ) ( resid 77 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1067
assign ( resid 23 and name HG12 ) ( resid 23 and name HG11 or resid 34 and 
name HG11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1068
assign ( resid 77 and name HG11 ) ( resid 77 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1077
assign ( resid 77 and name HG11 ) ( resid 77 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1078
assign ( resid 77 and name HG11 or resid 56 and name HG11 ) ( resid 77 and 
name HD11 or resid 34 and name HG2# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  
1080
assign ( resid 23 and name HG11 ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1081
assign ( resid 23 and name HG11 ) ( resid 23 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1082
assign ( resid 23 and name HG11 or resid 48 and name HG11 ) ( resid 23 and 
name HG12 or resid 58 and name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1083
assign ( resid 23 and name HG11 or resid 48 and name HG11 ) ( resid 23 and 
name HG2# or resid 48 and name HG2# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  
1084
assign ( resid 22 and name HG# ) ( resid 22 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1085
assign ( resid 77 and name HG12 ) ( resid 77 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1088
assign ( resid 11 and name HG11 or resid 22 and name HG# ) ( resid 11 and 
name HB or resid 22 and name HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1089
assign ( resid 77 and name HG12 ) ( resid 77 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1090
assign ( resid 22 and name HG# ) ( resid 22 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1091
assign ( resid 22 and name HG# ) ( resid 22 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1092
assign ( resid 22 and name HG# ) ( resid 22 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1094
assign ( resid 23 and name HG12 or resid 90 and name HG12 ) ( resid 23 and 
name HD11 or resid 90 and name HD11 or resid 90 and name HG2# ) 2.60 0.80 
0.80 !FROM PEAK NUMBER:  1097
assign ( resid 70 and name HG# ) ( resid 70 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1100
assign ( resid 70 and name HG# ) ( resid 70 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1101
assign ( resid 70 and name HG# ) ( resid 70 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1102
assign ( resid 56 and name HG11 ) ( resid 56 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1105
assign ( resid 56 and name HG11 or resid 23 and name HG11 ) ( resid 56 and 
name HD11 or resid 23 and name HD11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  
1106
assign ( resid 47 and name HG# ) ( resid 57 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1107
assign ( resid 90 and name HG11 ) ( resid 90 and name HD11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1108
assign ( resid 74 and name HG ) ( resid 74 and name HB# or resid 68 and name 
HG# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1110
assign ( resid 11 and name HG11 or resid 77 and name HG12 ) ( resid 11 and 
name HD11 or resid 75 and name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1112
assign ( resid 11 and name HG11 ) ( resid 11 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1113
assign ( resid 56 and name HG12 ) ( resid 48 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1114
assign ( resid 56 and name HG12 ) ( resid 56 and name HG11 or resid 34 and 
name HG11 or resid 48 and name HG11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  
1116
assign ( resid 56 and name HG12 ) ( resid 56 and name HD11 or resid 34 and 
name HD11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1117
assign ( resid 6 and name HG12 ) ( resid 6 and name HD11 or resid 6 and name 
HG2# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1118
assign ( resid 38 and name HA ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1126
assign ( resid 70 and name HG# ) ( resid 70 and name HD# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1132
assign ( resid 70 and name HG# ) ( resid 70 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1133
assign ( resid 70 and name HG# ) ( resid 70 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1137
assign ( resid 54 and name HG# or resid 9 and name HG# ) ( resid 54 and name 
HA or resid 9 and name HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1139
assign ( resid 54 and name HG# ) ( resid 54 and name HD# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1140
assign ( resid 16 and name HG or resid 68 and name HG# ) ( resid 16 and name 
HA or resid 70 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1141
assign ( resid 37 and name HG# ) ( resid 37 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1142
assign ( resid 90 and name HG11 or resid 6 and name HG11 or resid 47 and 
name HG# ) ( resid 90 and name HB or resid 6 and name HB or resid 47 and 
name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1144
assign ( resid 6 and name HG11 ) ( resid 6 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1145
assign ( resid 6 and name HG11 or resid 47 and name HG# or resid 22 and name 
HG# ) ( resid 6 and name HB or resid 47 and name HB# or resid 22 and name 
HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1146
assign ( resid 6 and name HG11 ) ( resid 6 and name HD11 or resid 6 and name 
HG2# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1147
assign ( resid 74 and name HG ) ( resid 74 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1148
assign ( resid 22 and name HG# ) ( resid 35 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1150
assign ( resid 23 and name HG12 ) ( resid 22 and name HG# or resid 46 and 
name HG ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1151
assign ( resid 38 and name HA ) ( resid 39 and name HA or resid 48 and name 
HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1157
assign ( resid 80 and name HG# or resid 9 and name HG# ) ( resid 80 and name 
HD# or resid 9 and name HD# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1162
assign ( resid 80 and name HG# or resid 9 and name HG# ) ( resid 80 and name 
HB# or resid 9 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1163
assign ( resid 9 and name HG# ) ( resid 9 and name HA ) 2.60 0.80 0.80 !FROM 
PEAK NUMBER:  1165
assign ( resid 43 and name HG# or resid 54 and name HG# ) ( resid 43 and 
name HD# or resid 54 and name HD# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1169
assign ( resid 16 and name HG ) ( resid 16 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1170
assign ( resid 37 and name HG# ) ( resid 37 and name HD# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1171
assign ( resid 25 and name HG# or resid 85 and name HG# or resid 25 and name 
HG# ) ( resid 25 and name HD# or resid 85 and name HD# or resid 25 and name 
HD# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1173
assign ( resid 46 and name HG ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1174
assign ( resid 25 and name HG# ) ( resid 25 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1175
assign ( resid 25 and name HG# ) ( resid 64 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1177
assign ( resid 86 and name HA ) ( resid 86 and name HB# or resid 88 and name 
HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1183
assign ( resid 86 and name HA ) ( resid 86 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1184
assign ( resid 19 and name HG ) ( resid 16 and name HG ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1188
assign ( resid 19 and name HG ) ( resid 19 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1189
assign ( resid 77 and name HG11 or resid 16 and name HG ) ( resid 77 and 
name HG12 or resid 16 and name HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1192
assign ( resid 56 and name HG11 or resid 82 and name HG or resid 56 and name 
HG11 ) ( resid 56 and name HD11 or resid 82 and name HD# or resid 56 and 
name HG2# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1193
assign ( resid 25 and name HG# ) ( resid 25 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1194
assign ( resid 20 and name HB# ) ( resid 69 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1202
assign ( resid 82 and name HG ) ( resid 82 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1214
assign ( resid 27 and name HA ) ( resid 27 and name HB or resid 62 and name 
HB ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1226
assign ( resid 27 and name HA ) ( resid 27 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1227
assign ( resid 83 and name HA ) ( resid 82 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1228
assign ( resid 20 and name HB# ) ( resid 19 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1231
assign ( resid 20 and name HB# ) ( resid 36 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1232
assign ( resid 16 and name HG or resid 68 and name HG# ) ( resid 16 and name 
HD# or resid 74 and name HD# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1242
assign ( resid 16 and name HG ) ( resid 16 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1243
assign ( resid 83 and name HA ) ( resid 83 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1248
assign ( resid 20 and name HB# ) ( resid 68 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1249
assign ( resid 20 and name HB# ) ( resid 68 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1250
assign ( resid 20 and name HB# ) ( resid 68 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1251
assign ( resid 17 and name HA ) ( resid 17 and name HB or resid 17 and name 
HG11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1254
assign ( resid 17 and name HA ) ( resid 17 and name HG2# or resid 38 and 
name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1264
assign ( resid 17 and name HA ) ( resid 17 and name HB or resid 17 and name 
HG11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1265
assign ( resid 16 and name HD# ) ( resid 16 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1268
assign ( resid 16 and name HD# ) ( resid 16 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1269
assign ( resid 16 and name HD# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1270
assign ( resid 31 and name HG11 or resid 62 and name HG11 ) ( resid 31 and 
name HD11 or resid 31 and name HG2# or resid 62 and name HG2# ) 2.60 0.80 
0.80 !FROM PEAK NUMBER:  1279
assign ( resid 31 and name HG11 ) ( resid 31 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1280
assign ( resid 31 and name HG12 ) ( resid 31 and name HD11 or resid 31 and 
name HG2# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1284
assign ( resid 31 and name HG12 ) ( resid 31 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1286
assign ( resid 31 and name HG12 ) ( resid 31 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1287
assign ( resid 31 and name HG12 ) ( resid 31 and name HD11 or resid 31 and 
name HG2# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1289
assign ( resid 16 and name HD# ) ( resid 16 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1297
assign ( resid 16 and name HD# ) ( resid 19 and name HD# or resid 46 and 
name HD# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1298
assign ( resid 34 and name HA ) ( resid 35 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1343
assign ( resid 34 and name HA ) ( resid 34 and name HG11 or resid 23 and 
name HG11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1344
assign ( resid 34 and name HA or resid 11 and name HA or resid 34 and name 
HA ) ( resid 34 and name HD11 or resid 11 and name HD11 or resid 56 and name 
HG2# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1345
assign ( resid 34 and name HA ) ( resid 34 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1346
assign ( resid 46 and name HD# ) ( resid 38 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1350
assign ( resid 46 and name HD# ) ( resid 21 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1352
assign ( resid 46 and name HD# ) ( resid 48 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1353
assign ( resid 46 and name HD# ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1355
assign ( resid 46 and name HD# ) ( resid 46 and name HG or resid 46 and name 
HB# or resid 23 and name HG11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1356
assign ( resid 46 and name HD# ) ( resid 21 and name HG# or resid 48 and 
name HD11 ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1357
assign ( resid 64 and name HA ) ( resid 65 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1361
assign ( resid 64 and name HA ) ( resid 64 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1362
assign ( resid 64 and name HA ) ( resid 78 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1363
assign ( resid 64 and name HA ) ( resid 64 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1364
assign ( resid 34 and name HA ) ( resid 34 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1365
assign ( resid 11 and name HA ) ( resid 11 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1366
assign ( resid 11 and name HA ) ( resid 11 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1378
assign ( resid 11 and name HA ) ( resid 11 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1379
assign ( resid 91 and name HG# ) ( resid 91 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1393
assign ( resid 91 and name HG# ) ( resid 91 and name HD# or resid 91 and 
name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1394
assign ( resid 91 and name HG# ) ( resid 91 and name HD# or resid 91 and 
name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1396
assign ( resid 91 and name HG# ) ( resid 91 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1398
assign ( resid 91 and name HG# ) ( resid 91 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1399
assign ( resid 91 and name HG# ) ( resid 91 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1416
assign ( resid 91 and name HG# or resid 93 and name HG# ) ( resid 91 and 
name HA or resid 93 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1417
assign ( resid 93 and name HG# ) ( resid 93 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1418
assign ( resid 93 and name HG# ) ( resid 93 and name HD# or resid 93 and 
name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1419
assign ( resid 5 and name HG or resid 82 and name HD# ) ( resid 5 and name 
HA or resid 82 and name HA ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1421
assign ( resid 82 and name HD# or resid 5 and name HG ) ( resid 82 and name 
HG or resid 5 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1422
assign ( resid 46 and name HD# ) ( resid 48 and name HD11 or resid 21 and 
name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1426
assign ( resid 46 and name HD# ) ( resid 41 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1438
assign ( resid 46 and name HD# ) ( resid 46 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1439
assign ( resid 46 and name HD# ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1440
assign ( resid 46 and name HD# ) ( resid 48 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1442
assign ( resid 46 and name HD# ) ( resid 60 and name HE# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1443
assign ( resid 46 and name HD# ) ( resid 60 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1444
assign ( resid 46 and name HD# ) ( resid 41 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1445
assign ( resid 46 and name HD# ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1446
assign ( resid 74 and name HD# ) ( resid 68 and name HD# or resid 66 and 
name HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1461
assign ( resid 74 and name HD# ) ( resid 68 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1462
assign ( resid 74 and name HD# ) ( resid 74 and name HB# or resid 68 and 
name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1463
assign ( resid 74 and name HD# ) ( resid 74 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1464
assign ( resid 74 and name HD# ) ( resid 74 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1465
assign ( resid 90 and name HA ) ( resid 90 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1475
assign ( resid 90 and name HA ) ( resid 90 and name HB or resid 91 and name 
HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1478
assign ( resid 90 and name HA ) ( resid 90 and name HG2# or resid 90 and 
name HD11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1480
assign ( resid 74 and name HD# ) ( resid 68 and name HD# or resid 66 and 
name HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1499
assign ( resid 74 and name HD# ) ( resid 66 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1500
assign ( resid 74 and name HD# ) ( resid 74 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1501
assign ( resid 74 and name HD# ) ( resid 22 and name HB# or resid 68 and 
name HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1503
assign ( resid 74 and name HD# ) ( resid 74 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1504
assign ( resid 74 and name HD# ) ( resid 74 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1505
assign ( resid 75 and name HA ) ( resid 75 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1511
assign ( resid 75 and name HA ) ( resid 75 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1516
assign ( resid 82 and name HD# ) ( resid 82 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1526
assign ( resid 82 and name HD# ) ( resid 82 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1527
assign ( resid 6 and name HA ) ( resid 6 and name HB ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  1535
assign ( resid 6 and name HA ) ( resid 6 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1536
assign ( resid 6 and name HA ) ( resid 7 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1537
assign ( resid 6 and name HA ) ( resid 6 and name HG2# or resid 6 and name 
HD11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1538
assign ( resid 21 and name HG# ) ( resid 23 and name HD11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1562
assign ( resid 21 and name HG# ) ( resid 21 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1563
assign ( resid 21 and name HG# ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1564
assign ( resid 31 and name HA or resid 69 and name HA ) ( resid 31 and name 
HB or resid 70 and name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1569
assign ( resid 43 and name HA ) ( resid 43 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1573
assign ( resid 21 and name HG# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1576
assign ( resid 31 and name HA ) ( resid 31 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1577
assign ( resid 43 and name HA ) ( resid 43 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1587
assign ( resid 38 and name HG# ) ( resid 38 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1612
assign ( resid 38 and name HG# ) ( resid 38 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1614
assign ( resid 38 and name HG# ) ( resid 46 and name HG ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1615
assign ( resid 38 and name HG# ) ( resid 46 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1619
assign ( resid 38 and name HG# ) ( resid 41 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1620
assign ( resid 63 and name HB1 ) ( resid 26 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1622
assign ( resid 63 and name HB1 ) ( resid 64 and name HG# or resid 58 and 
name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1623
assign ( resid 63 and name HB1 ) ( resid 23 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1624
assign ( resid 63 and name HB1 ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1626
assign ( resid 63 and name HB1 ) ( resid 26 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1638
assign ( resid 38 and name HG# ) ( resid 38 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1646
assign ( resid 38 and name HG# ) ( resid 38 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1647
assign ( resid 38 and name HG# ) ( resid 41 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1648
assign ( resid 38 and name HG# ) ( resid 37 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1650
assign ( resid 38 and name HG# ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1654
assign ( resid 38 and name HG# ) ( resid 21 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1655
assign ( resid 38 and name HG# ) ( resid 46 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1656
assign ( resid 38 and name HG# ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1658
assign ( resid 80 and name HA ) ( resid 80 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1687
assign ( resid 80 and name HA ) ( resid 83 and name HG# or resid 62 and name 
HG12 ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1688
assign ( resid 80 and name HA ) ( resid 80 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1690
assign ( resid 80 and name HA ) ( resid 79 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1691
assign ( resid 19 and name HD# ) ( resid 19 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1706
assign ( resid 19 and name HD# ) ( resid 19 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1707
assign ( resid 19 and name HD# ) ( resid 16 and name HG ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1708
assign ( resid 19 and name HD# ) ( resid 16 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1709
assign ( resid 19 and name HD# ) ( resid 20 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1755
assign ( resid 19 and name HD# ) ( resid 18 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1756
assign ( resid 83 and name HG# ) ( resid 83 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1778
assign ( resid 83 and name HG# ) ( resid 80 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1781
assign ( resid 83 and name HG# ) ( resid 83 and name HB or resid 62 and name 
HB ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1782
assign ( resid 83 and name HG# ) ( resid 80 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1783
assign ( resid 83 and name HG# ) ( resid 82 and name HD# or resid 27 and 
name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1787
assign ( resid 39 and name HG# ) ( resid 47 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1789
assign ( resid 39 and name HG# ) ( resid 39 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1791
assign ( resid 19 and name HD# or resid 39 and name HG# ) ( resid 19 and 
name HB# or resid 55 and name HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1792
assign ( resid 39 and name HG# ) ( resid 49 and name HB# or resid 55 and 
name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1793
assign ( resid 39 and name HG# ) ( resid 47 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1794
assign ( resid 39 and name HG# or resid 19 and name HD# ) ( resid 37 and 
name HG# or resid 48 and name HG11 or resid 37 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1799
assign ( resid 19 and name HD# ) ( resid 19 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1800
assign ( resid 19 and name HD# ) ( resid 19 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1802
assign ( resid 19 and name HD# ) ( resid 19 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1803
assign ( resid 69 and name HG21 ) ( resid 69 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1824
assign ( resid 69 and name HG21 ) ( resid 73 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1825
assign ( resid 69 and name HG21 ) ( resid 70 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1826
assign ( resid 69 and name HG21 ) ( resid 70 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1827
assign ( resid 69 and name HG21 ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1830
assign ( resid 16 and name HD# ) ( resid 19 and name HG ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1831
assign ( resid 29 and name HA ) ( resid 29 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1836
assign ( resid 29 and name HA ) ( resid 29 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1838
assign ( resid 29 and name HA ) ( resid 29 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1839
assign ( resid 16 and name HD# ) ( resid 16 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1845
assign ( resid 16 and name HD# ) ( resid 16 and name HG ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1846
assign ( resid 16 and name HD# ) ( resid 16 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1847
assign ( resid 32 and name HA ) ( resid 32 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1865
assign ( resid 32 and name HA ) ( resid 31 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1866
assign ( resid 32 and name HA ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1867
assign ( resid 32 and name HA ) ( resid 32 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1869
assign ( resid 57 and name HG21 ) ( resid 57 and name HB or resid 45 and 
name HB ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1870
assign ( resid 7 and name HG21 ) ( resid 7 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1901
assign ( resid 7 and name HG21 ) ( resid 5 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1904
assign ( resid 75 and name HG# ) ( resid 75 and name HB or resid 77 and name 
HB ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1911
assign ( resid 75 and name HG# ) ( resid 77 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1912
assign ( resid 83 and name HG# ) ( resid 83 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1925
assign ( resid 45 and name HG21 ) ( resid 45 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1926
assign ( resid 83 and name HG# ) ( resid 83 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1927
assign ( resid 45 and name HG21 or resid 83 and name HG# ) ( resid 47 and 
name HB# or resid 81 and name HB1 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1928
assign ( resid 45 and name HG21 ) ( resid 46 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1929
assign ( resid 83 and name HG# ) ( resid 82 and name HD# or resid 62 and 
name HG2# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1932
assign ( resid 45 and name HG21 ) ( resid 59 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1934
assign ( resid 45 and name HG21 ) ( resid 45 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1935
assign ( resid 64 and name HG# ) ( resid 64 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1937
assign ( resid 75 and name HG# ) ( resid 75 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1938
assign ( resid 75 and name HG# ) ( resid 77 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1939
assign ( resid 27 and name HG# ) ( resid 27 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1942
assign ( resid 27 and name HG# ) ( resid 27 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1943
assign ( resid 58 and name HG# ) ( resid 59 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1948
assign ( resid 58 and name HG# or resid 64 and name HG# ) ( resid 23 and 
name HA or resid 24 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1949
assign ( resid 58 and name HG# ) ( resid 58 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1950
assign ( resid 64 and name HG# or resid 58 and name HG# ) ( resid 63 and 
name HB1 or resid 34 and name HG2# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1957
assign ( resid 58 and name HG# ) ( resid 46 and name HD# or resid 23 and 
name HG2# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1959
assign ( resid 58 and name HG# ) ( resid 32 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1966
assign ( resid 64 and name HG# ) ( resid 64 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1968
assign ( resid 64 and name HG# ) ( resid 64 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1969
assign ( resid 64 and name HG# ) ( resid 24 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1970
assign ( resid 64 and name HG# ) ( resid 78 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1971
assign ( resid 42 and name HG21 ) ( resid 45 and name HG21 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1981
assign ( resid 27 and name HG# ) ( resid 62 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1983
assign ( resid 27 and name HG# ) ( resid 62 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1984
assign ( resid 64 and name HG# ) ( resid 64 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1985
assign ( resid 64 and name HG# ) ( resid 65 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1986
assign ( resid 64 and name HG# ) ( resid 25 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1987
assign ( resid 64 and name HG# ) ( resid 25 and name HB# or resid 25 and 
name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1988
assign ( resid 64 and name HG# ) ( resid 78 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1992
assign ( resid 64 and name HG# ) ( resid 64 and name HB or resid 25 and name 
HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2000
assign ( resid 64 and name HG# ) ( resid 24 and name HB1 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2002
assign ( resid 75 and name HG# ) ( resid 75 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2004
assign ( resid 75 and name HG# ) ( resid 75 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2005
assign ( resid 75 and name HG# ) ( resid 77 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2006
assign ( resid 87 and name HA ) ( resid 87 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2013
assign ( resid 87 and name HA ) ( resid 87 and name HG# or resid 88 and name 
HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2016
assign ( resid 51 and name HA ) ( resid 51 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2037
assign ( resid 54 and name HA ) ( resid 54 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2046
assign ( resid 88 and name HA ) ( resid 88 and name HB# or resid 87 and name 
HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2047
assign ( resid 27 and name HG# ) ( resid 62 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2050
assign ( resid 27 and name HG# ) ( resid 27 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2051
assign ( resid 27 and name HG# ) ( resid 27 and name HB or resid 62 and name 
HB ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2052
assign ( resid 71 and name HA ) ( resid 71 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2055
assign ( resid 54 and name HA ) ( resid 54 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2056
assign ( resid 88 and name HA ) ( resid 88 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2057
assign ( resid 21 and name HG# ) ( resid 21 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2060
assign ( resid 21 and name HG# ) ( resid 38 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2061
assign ( resid 21 and name HG# ) ( resid 23 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2062
assign ( resid 21 and name HG# ) ( resid 48 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2065
assign ( resid 21 and name HG# ) ( resid 46 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2066
assign ( resid 71 and name HA ) ( resid 71 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2069
assign ( resid 71 and name HA ) ( resid 71 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2070
assign ( resid 71 and name HA ) ( resid 71 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2071
assign ( resid 88 and name HA ) ( resid 90 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2073
assign ( resid 21 and name HG# ) ( resid 23 and name HG11 or resid 48 and 
name HG11 or resid 37 and name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2075
assign ( resid 9 and name HA or resid 54 and name HA ) ( resid 9 and name 
HD# or resid 54 and name HD# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2078
assign ( resid 91 and name HA ) ( resid 90 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2079
assign ( resid 93 and name HA ) ( resid 94 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2080
assign ( resid 93 and name HA ) ( resid 93 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2084
assign ( resid 9 and name HA ) ( resid 9 and name HD# ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  2090
assign ( resid 9 and name HA ) ( resid 9 and name HB# ) 2.30 0.50 0.50 !FROM 
PEAK NUMBER:  2091
assign ( resid 9 and name HA ) ( resid 9 and name HB# or resid 9 and name 
HG# or resid 68 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2092
assign ( resid 91 and name HA ) ( resid 90 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2094
assign ( resid 93 and name HA or resid 92 and name HA ) ( resid 93 and name 
HB# or resid 92 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2096
assign ( resid 91 and name HA ) ( resid 91 and name HB# or resid 90 and name 
HB ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2103
assign ( resid 93 and name HA ) ( resid 93 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2108
assign ( resid 41 and name HA or resid 9 and name HA ) ( resid 41 and name 
HB# or resid 68 and name HG# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2112
assign ( resid 91 and name HA or resid 92 and name HA ) ( resid 91 and name 
HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2113
assign ( resid 95 and name HA or resid 73 and name HA or resid 41 and name 
HA ) ( resid 95 and name HG# or resid 73 and name HG# or resid 41 and name 
HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2114
assign ( resid 73 and name HA or resid 95 and name HA ) ( resid 73 and name 
HB# or resid 95 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2115
assign ( resid 91 and name HA or resid 73 and name HA or resid 41 and name 
HA ) ( resid 91 and name HG# or resid 74 and name HB# or resid 46 and name 
HG ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2116
assign ( resid 93 and name HA ) ( resid 91 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2117
assign ( resid 84 and name HB1 ) ( resid 84 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2123
assign ( resid 84 and name HB1 ) ( resid 83 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2124
assign ( resid 93 and name HA ) ( resid 94 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2133
assign ( resid 84 and name HB1 ) ( resid 85 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2135
assign ( resid 39 and name HG# ) ( resid 39 and name HA or resid 48 and name 
HA ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2139
assign ( resid 39 and name HG# ) ( resid 38 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2140
assign ( resid 39 and name HG# ) ( resid 39 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2141
assign ( resid 39 and name HG# ) ( resid 49 and name HB# or resid 55 and 
name HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2142
assign ( resid 39 and name HG# ) ( resid 47 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2143
assign ( resid 39 and name HG# ) ( resid 37 and name HG# or resid 48 and 
name HG11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2144
assign ( resid 39 and name HG# ) ( resid 47 and name HG# or resid 48 and 
name HG11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2145
assign ( resid 39 and name HG# ) ( resid 47 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2146
assign ( resid 30 and name HA or resid 41 and name HA ) ( resid 30 and name 
HB# or resid 40 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2153
assign ( resid 4 and name HA ) ( resid 4 and name HG# ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  2160
assign ( resid 81 and name HB1 ) ( resid 77 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2167
assign ( resid 81 and name HB1 ) ( resid 81 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2168
assign ( resid 81 and name HB1 ) ( resid 80 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2169
assign ( resid 23 and name HG2# ) ( resid 23 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2173
assign ( resid 23 and name HG2# ) ( resid 33 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2174
assign ( resid 23 and name HG2# ) ( resid 32 and name HB# or resid 58 and 
name HB ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2176
assign ( resid 23 and name HG2# ) ( resid 23 and name HG11 or resid 34 and 
name HG11 ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2177
assign ( resid 23 and name HG2# ) ( resid 23 and name HG12 or resid 64 and 
name HG# or resid 58 and name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2178
assign ( resid 23 and name HG2# ) ( resid 23 and name HD11 or resid 34 and 
name HD11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2179
assign ( resid 23 and name HG2# ) ( resid 63 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2180
assign ( resid 4 and name HA ) ( resid 4 and name HB# ) 2.30 0.50 0.50 !FROM 
PEAK NUMBER:  2186
assign ( resid 81 and name HB1 ) ( resid 78 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2190
assign ( resid 23 and name HG2# ) ( resid 34 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2193
assign ( resid 85 and name HA ) ( resid 85 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2199
assign ( resid 5 and name HA or resid 95 and name HA ) ( resid 4 and name HA 
or resid 96 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2200
assign ( resid 5 and name HA or resid 85 and name HA ) ( resid 5 and name 
HB# or resid 85 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2201
assign ( resid 5 and name HA ) ( resid 6 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2202
assign ( resid 5 and name HA ) ( resid 6 and name HA ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  2205
assign ( resid 4 and name HA ) ( resid 4 and name HE1 ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  2208
assign ( resid 16 and name HA ) ( resid 16 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2213
assign ( resid 16 and name HA ) ( resid 16 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2214
assign ( resid 16 and name HA ) ( resid 16 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2216
assign ( resid 16 and name HA ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2218
assign ( resid 96 and name HA ) ( resid 95 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2223
assign ( resid 31 and name HG2# ) ( resid 25 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2230
assign ( resid 34 and name HD11 ) ( resid 34 and name HB or resid 58 and 
name HG# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2231
assign ( resid 62 and name HG2# ) ( resid 62 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2232
assign ( resid 24 and name HB1 ) ( resid 24 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2233
assign ( resid 24 and name HB1 ) ( resid 64 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2234
assign ( resid 24 and name HB1 ) ( resid 64 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2235
assign ( resid 50 and name HE1 ) ( resid 36 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2240
assign ( resid 50 and name HE1 ) ( resid 50 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2244
assign ( resid 50 and name HE1 ) ( resid 50 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2246
assign ( resid 50 and name HE1 ) ( resid 54 and name HB# or resid 56 and 
name HB ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2251
assign ( resid 50 and name HE1 ) ( resid 48 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2252
assign ( resid 50 and name HE1 ) ( resid 56 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2254
assign ( resid 50 and name HE1 ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2255
assign ( resid 17 and name HG2# ) ( resid 17 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2256
assign ( resid 62 and name HG2# ) ( resid 62 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2257
assign ( resid 62 and name HG2# or resid 34 and name HD11 ) ( resid 83 and 
name HG# or resid 56 and name HG12 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2260
assign ( resid 31 and name HG2# ) ( resid 31 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2261
assign ( resid 31 and name HG2# ) ( resid 31 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2262
assign ( resid 6 and name HG2# ) ( resid 6 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2264
assign ( resid 6 and name HG2# ) ( resid 6 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2265
assign ( resid 6 and name HG2# ) ( resid 6 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2266
assign ( resid 24 and name HB1 ) ( resid 22 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2273
assign ( resid 96 and name HA ) ( resid 96 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2274
assign ( resid 96 and name HA ) ( resid 96 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2275
assign ( resid 34 and name HD11 ) ( resid 23 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2278
assign ( resid 90 and name HG2# ) ( resid 88 and name HA or resid 91 and 
name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2279
assign ( resid 17 and name HG2# or resid 90 and name HG2# ) ( resid 17 and 
name HB or resid 17 and name HG11 or resid 91 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2280
assign ( resid 90 and name HG2# ) ( resid 90 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2281
assign ( resid 34 and name HD11 ) ( resid 56 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2282
assign ( resid 34 and name HD11 or resid 90 and name HG2# ) ( resid 34 and 
name HA or resid 90 and name HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2287
assign ( resid 90 and name HG2# ) ( resid 90 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2288
assign ( resid 34 and name HD11 ) ( resid 34 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2289
assign ( resid 31 and name HG2# ) ( resid 31 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2292
assign ( resid 34 and name HD11 or resid 62 and name HG2# or resid 31 and 
name HG2# ) ( resid 34 and name HG12 or resid 62 and name HG11 or resid 31 
and name HG11 ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2293
assign ( resid 24 and name HB1 ) ( resid 64 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2297
assign ( resid 96 and name HA ) ( resid 95 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2301
assign ( resid 82 and name HA ) ( resid 82 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2305
assign ( resid 77 and name HG2# ) ( resid 77 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2314
assign ( resid 34 and name HD11 or resid 90 and name HG2# ) ( resid 34 and 
name HG11 or resid 90 and name HG11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  
2317
assign ( resid 81 and name HA ) ( resid 85 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2322
assign ( resid 24 and name HA ) ( resid 24 and name HB1 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2325
assign ( resid 77 and name HG2# ) ( resid 77 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2326
assign ( resid 77 and name HG2# ) ( resid 77 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2327
assign ( resid 77 and name HG2# ) ( resid 77 and name HG11 or resid 81 and 
name HB1 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2328
assign ( resid 77 and name HG2# ) ( resid 75 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2330
assign ( resid 77 and name HG2# ) ( resid 77 and name HD11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2331
assign ( resid 4 and name HE1 ) ( resid 4 and name HA ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  2342
assign ( resid 4 and name HE1 ) ( resid 4 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2345
assign ( resid 4 and name HE1 ) ( resid 4 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2350
assign ( resid 4 and name HE1 ) ( resid 6 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2357
assign ( resid 11 and name HG2# ) ( resid 11 and name HD11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2365
assign ( resid 11 and name HG2# ) ( resid 11 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2366
assign ( resid 56 and name HG2# ) ( resid 56 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2369
assign ( resid 56 and name HG2# ) ( resid 58 and name HB or resid 50 and 
name HE1 ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2370
assign ( resid 56 and name HG2# ) ( resid 56 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2371
assign ( resid 56 and name HG2# ) ( resid 48 and name HB or resid 56 and 
name HG11 or resid 34 and name HG11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  
2372
assign ( resid 56 and name HG2# ) ( resid 56 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2373
assign ( resid 56 and name HG2# ) ( resid 34 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2375
assign ( resid 56 and name HG2# ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2377
assign ( resid 11 and name HG2# ) ( resid 11 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2379
assign ( resid 52 and name HA ) ( resid 52 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2383
assign ( resid 81 and name HA ) ( resid 80 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2386
assign ( resid 81 and name HA ) ( resid 81 and name HB1 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2389
assign ( resid 52 and name HA ) ( resid 52 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2392
assign ( resid 52 and name HA ) ( resid 50 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2394
assign ( resid 48 and name HG2# ) ( resid 48 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2397
assign ( resid 48 and name HG2# ) ( resid 38 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2398
assign ( resid 48 and name HG2# ) ( resid 36 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2401
assign ( resid 48 and name HG2# ) ( resid 48 and name HB or resid 23 and 
name HG11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2402
assign ( resid 48 and name HG2# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2403
assign ( resid 48 and name HG2# ) ( resid 48 and name HD11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2404
assign ( resid 48 and name HG2# ) ( resid 21 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2405
assign ( resid 84 and name HA ) ( resid 84 and name HB1 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2419
assign ( resid 59 and name HD# ) ( resid 59 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2457
assign ( resid 59 and name HD# ) ( resid 58 and name HG# or resid 59 and 
name HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2458
assign ( resid 59 and name HD# ) ( resid 58 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2459
assign ( resid 59 and name HD# ) ( resid 59 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2475
assign ( resid 59 and name HD# ) ( resid 59 and name HB# or resid 58 and 
name HG# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2476
assign ( resid 59 and name HD# ) ( resid 59 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2488
assign ( resid 59 and name HD# ) ( resid 59 and name HB# or resid 58 and 
name HG# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2489
assign ( resid 31 and name HD11 ) ( resid 31 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2500
assign ( resid 48 and name HD11 ) ( resid 58 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2502
assign ( resid 48 and name HD11 ) ( resid 46 and name HD# or resid 23 and 
name HD11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2503
assign ( resid 48 and name HD11 ) ( resid 46 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2504
assign ( resid 48 and name HD11 ) ( resid 48 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2505
assign ( resid 48 and name HD11 ) ( resid 23 and name HG11 or resid 48 and 
name HG11 or resid 34 and name HG11 or resid 46 and name HB# ) 2.30 0.50 
0.50 !FROM PEAK NUMBER:  2506
assign ( resid 48 and name HD11 ) ( resid 46 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2507
assign ( resid 48 and name HD11 ) ( resid 48 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2509
assign ( resid 70 and name HD# ) ( resid 70 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2512
assign ( resid 31 and name HD11 ) ( resid 31 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2514
assign ( resid 31 and name HD11 or resid 11 and name HD11 ) ( resid 31 and 
name HG12 or resid 11 and name HG11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  
2515
assign ( resid 70 and name HD# ) ( resid 69 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2519
assign ( resid 11 and name HD11 ) ( resid 11 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2531
assign ( resid 56 and name HD11 ) ( resid 56 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2533
assign ( resid 56 and name HD11 ) ( resid 56 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2534
assign ( resid 56 and name HD11 or resid 23 and name HD11 ) ( resid 58 and 
name HB ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2535
assign ( resid 23 and name HD11 ) ( resid 23 and name HG11 or resid 46 and 
name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2536
assign ( resid 56 and name HD11 ) ( resid 56 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2537
assign ( resid 56 and name HD11 ) ( resid 56 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2542
assign ( resid 31 and name HD11 ) ( resid 31 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2543
assign ( resid 23 and name HD11 ) ( resid 23 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2544
assign ( resid 23 and name HD11 ) ( resid 34 and name HB or resid 58 and 
name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2545
assign ( resid 23 and name HD11 ) ( resid 23 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2546
assign ( resid 70 and name HD# ) ( resid 19 and name HG ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2550
assign ( resid 70 and name HD# ) ( resid 69 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2551
assign ( resid 70 and name HD# ) ( resid 70 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2555
assign ( resid 70 and name HD# ) ( resid 69 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2557
assign ( resid 23 and name HD11 ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2562
assign ( resid 23 and name HD11 ) ( resid 23 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2563
assign ( resid 86 and name HD# or resid 70 and name HD# ) ( resid 86 and 
name HG# or resid 70 and name HG# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2566
assign ( resid 70 and name HD# or resid 86 and name HD# ) ( resid 70 and 
name HG# or resid 86 and name HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2568
assign ( resid 86 and name HD# ) ( resid 86 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2570
assign ( resid 70 and name HD# ) ( resid 70 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2571
assign ( resid 77 and name HD11 ) ( resid 77 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2575
assign ( resid 77 and name HD11 ) ( resid 77 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2576
assign ( resid 77 and name HD11 ) ( resid 77 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2580
assign ( resid 77 and name HD11 ) ( resid 77 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2581
assign ( resid 77 and name HD11 ) ( resid 77 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2582
assign ( resid 90 and name HD11 ) ( resid 92 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2595
assign ( resid 90 and name HD11 ) ( resid 90 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2596
assign ( resid 90 and name HD11 ) ( resid 90 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2597
assign ( resid 90 and name HD11 ) ( resid 90 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2599
assign ( resid 90 and name HD11 ) ( resid 90 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2608
assign ( resid 6 and name HD11 ) ( resid 6 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2609
assign ( resid 6 and name HD11 ) ( resid 6 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2611
assign ( resid 6 and name HD11 ) ( resid 6 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2612
assign ( resid 17 and name HD11 ) ( resid 17 and name HG11 or resid 17 and 
name HB ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2622
assign ( resid 17 and name HD11 ) ( resid 17 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2625
assign ( resid 45 and name HA ) ( resid 45 and name HG21 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2795
assign ( resid 21 and name HA ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2819
assign ( resid 21 and name HA ) ( resid 21 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2820
assign ( resid 21 and name HA ) ( resid 21 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2821
assign ( resid 67 and name HA ) ( resid 67 and name HB# or resid 66 and name 
HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2831
assign ( resid 67 and name HA ) ( resid 67 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2832
assign ( resid 67 and name HA ) ( resid 68 and name HB# or resid 21 and name 
HB ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2833
assign ( resid 35 and name HA ) ( resid 35 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2838
assign ( resid 35 and name HA ) ( resid 35 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2839
assign ( resid 47 and name HA ) ( resid 47 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2848
assign ( resid 76 and name HA ) ( resid 76 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2850
assign ( resid 76 and name HA ) ( resid 76 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2853
assign ( resid 55 and name HA ) ( resid 55 and name HG# or resid 49 and name 
HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2856
assign ( resid 55 and name HA ) ( resid 55 and name HB# or resid 49 and name 
HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2857
assign ( resid 55 and name HA ) ( resid 55 and name HB# or resid 54 and name 
HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2858
assign ( resid 37 and name HA ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2863
assign ( resid 37 and name HA ) ( resid 37 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2864
assign ( resid 22 and name HA ) ( resid 22 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2866
assign ( resid 22 and name HA ) ( resid 35 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2867
assign ( resid 22 and name HA ) ( resid 22 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2868
assign ( resid 22 and name HA ) ( resid 23 and name HA or resid 35 and name 
HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2871
assign ( resid 37 and name HA ) ( resid 37 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2875
assign ( resid 22 and name HA ) ( resid 22 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2876
assign ( resid 68 and name HA ) ( resid 68 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2879
assign ( resid 68 and name HA ) ( resid 68 and name HB# or resid 9 and name 
HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2880
assign ( resid 44 and name HA ) ( resid 43 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2884
assign ( resid 44 and name HA ) ( resid 43 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2885
assign ( resid 44 and name HA ) ( resid 44 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2894
assign ( resid 66 and name HA ) ( resid 66 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2903
assign ( resid 63 and name HA ) ( resid 63 and name HB1 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2928
assign ( resid 63 and name HA ) ( resid 80 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2930
assign ( resid 45 and name HA ) ( resid 46 and name HN or resid 42 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3038
assign ( resid 21 and name HA ) ( resid 67 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3058
assign ( resid 21 and name HA ) ( resid 22 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3060
assign ( resid 67 and name HA ) ( resid 68 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3062
assign ( resid 67 and name HA ) ( resid 21 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3063
assign ( resid 35 and name HA ) ( resid 22 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3068
assign ( resid 35 and name HA ) ( resid 36 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3069
assign ( resid 47 and name HA ) ( resid 48 and name HN or resid 58 and name 
HN ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  3076
assign ( resid 76 and name HA ) ( resid 77 and name HN or resid 67 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3078
assign ( resid 76 and name HA ) ( resid 66 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3079
assign ( resid 55 and name HA ) ( resid 56 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3081
assign ( resid 22 and name HA ) ( resid 35 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3083
assign ( resid 37 and name HA ) ( resid 38 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3084
assign ( resid 68 and name HA ) ( resid 74 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3087
assign ( resid 37 and name HA ) ( resid 20 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3088
assign ( resid 68 and name HA ) ( resid 69 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3090
assign ( resid 66 and name HA ) ( resid 67 and name HN or resid 77 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3095
assign ( resid 36 and name HA# ) ( resid 36 and name HN or resid 37 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3146
assign ( resid 61 and name HA# ) ( resid 61 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3147
assign ( resid 72 and name HA# ) ( resid 72 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3154
assign ( resid 72 and name HA# ) ( resid 72 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3157
assign ( resid 33 and name HA# ) ( resid 33 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3164
assign ( resid 53 and name HA# ) ( resid 53 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3165
assign ( resid 54 and name HD# ) ( resid 54 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3172
assign ( resid 43 and name HD# ) ( resid 44 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3179
assign ( resid 74 and name HB# ) ( resid 74 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3186
assign ( resid 29 and name HD# ) ( resid 31 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3192
assign ( resid 22 and name HD# ) ( resid 22 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3193
assign ( resid 25 and name HD# ) ( resid 25 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3196
assign ( resid 47 and name HD# ) ( resid 47 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3197
assign ( resid 68 and name HD# ) ( resid 68 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3198
assign ( resid 68 and name HD# ) ( resid 74 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3199
assign ( resid 47 and name HD# ) ( resid 47 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3201
assign ( resid 78 and name HB# ) ( resid 78 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3218
assign ( resid 44 and name HB# ) ( resid 44 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3220
assign ( resid 51 and name HB# ) ( resid 51 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3241
assign ( resid 52 and name HB# ) ( resid 52 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3242
assign ( resid 6 and name HB ) ( resid 6 and name HN ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  3265
assign ( resid 90 and name HB ) ( resid 90 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3272
assign ( resid 45 and name HB ) ( resid 46 and name HN or resid 42 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3296
assign ( resid 88 and name HG# ) ( resid 88 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3301
assign ( resid 88 and name HG# ) ( resid 87 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3305
assign ( resid 73 and name HG# ) ( resid 73 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3306
assign ( resid 21 and name HB ) ( resid 21 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3308
assign ( resid 32 and name HG# ) ( resid 32 and name HN or resid 25 and name 
HN ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  3322
assign ( resid 32 and name HG# ) ( resid 32 and name HE2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3323
assign ( resid 58 and name HB ) ( resid 58 and name HN or resid 48 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3326
assign ( resid 37 and name HB# ) ( resid 37 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3344
assign ( resid 37 and name HB# ) ( resid 37 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3348
assign ( resid 91 and name HB# ) ( resid 91 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3358
assign ( resid 91 and name HB# ) ( resid 91 and name HN or resid 92 and name 
HN ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  3359
assign ( resid 57 and name HB ) ( resid 57 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3370
assign ( resid 83 and name HB ) ( resid 83 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3372
assign ( resid 68 and name HB# ) ( resid 68 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3373
assign ( resid 27 and name HB ) ( resid 27 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3389
assign ( resid 9 and name HB# ) ( resid 9 and name HN or resid 10 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3399
assign ( resid 88 and name HB# ) ( resid 88 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3428
assign ( resid 87 and name HB# ) ( resid 88 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3429
assign ( resid 80 and name HB# or resid 29 and name HB# ) ( resid 80 and 
name HN or resid 29 and name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3432
assign ( resid 35 and name HB# ) ( resid 35 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3447
assign ( resid 35 and name HB# ) ( resid 35 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3448
assign ( resid 35 and name HB# ) ( resid 22 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3449
assign ( resid 87 and name HB# ) ( resid 87 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3450
assign ( resid 32 and name HB# ) ( resid 32 and name HN or resid 25 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3476
assign ( resid 32 and name HB# ) ( resid 25 and name HN or resid 32 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3477
assign ( resid 54 and name HG# ) ( resid 54 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3497
assign ( resid 23 and name HG11 ) ( resid 23 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3498
assign ( resid 90 and name HG11 or resid 47 and name HG# ) ( resid 90 and 
name HN or resid 40 and name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3507
assign ( resid 38 and name HA ) ( resid 39 and name HN or resid 49 and name 
HN or resid 48 and name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3515
assign ( resid 9 and name HG# or resid 80 and name HG# ) ( resid 9 and name 
HN or resid 81 and name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3516
assign ( resid 68 and name HG# ) ( resid 68 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3518
assign ( resid 43 and name HG# ) ( resid 84 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3528
assign ( resid 37 and name HG# ) ( resid 37 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3529
assign ( resid 25 and name HG# ) ( resid 26 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3530
assign ( resid 6 and name HG11 ) ( resid 6 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3531
assign ( resid 86 and name HA ) ( resid 87 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3537
assign ( resid 43 and name HG# ) ( resid 44 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3538
assign ( resid 68 and name HG# ) ( resid 72 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3539
assign ( resid 37 and name HG# ) ( resid 19 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3541
assign ( resid 27 and name HA ) ( resid 27 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  3549
assign ( resid 20 and name HB# ) ( resid 20 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3550
assign ( resid 20 and name HB# ) ( resid 20 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3551
assign ( resid 20 and name HB# ) ( resid 20 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3552
assign ( resid 83 and name HA ) ( resid 83 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3559
assign ( resid 20 and name HB# ) ( resid 37 and name HA or resid 21 and name 
HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3560
assign ( resid 17 and name HA ) ( resid 18 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3562
assign ( resid 34 and name HA ) ( resid 35 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3571
assign ( resid 91 and name HG# ) ( resid 92 and name HN or resid 91 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3590
assign ( resid 5 and name HG ) ( resid 5 and name HN ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  3593
assign ( resid 46 and name HD# ) ( resid 46 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3594
assign ( resid 46 and name HD# ) ( resid 47 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3595
assign ( resid 46 and name HD# ) ( resid 46 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  3596
assign ( resid 90 and name HA ) ( resid 90 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3600
assign ( resid 74 and name HD# ) ( resid 68 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3602
assign ( resid 74 and name HD# ) ( resid 74 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3603
assign ( resid 90 and name HA ) ( resid 91 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  3607
assign ( resid 74 and name HD# ) ( resid 75 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3615
assign ( resid 74 and name HD# ) ( resid 66 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3616
assign ( resid 74 and name HD# ) ( resid 74 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3617
assign ( resid 75 and name HA ) ( resid 76 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3620
assign ( resid 6 and name HA ) ( resid 7 and name HN ) 2.60 0.80 0.80 !FROM 
PEAK NUMBER:  3623
assign ( resid 21 and name HG# ) ( resid 22 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3624
assign ( resid 21 and name HG# ) ( resid 21 and name HA or resid 22 and name 
HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  3626
assign ( resid 38 and name HG# ) ( resid 39 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3636
assign ( resid 63 and name HB1 ) ( resid 63 and name HN or resid 32 and name 
HE2# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  3637
assign ( resid 63 and name HB1 ) ( resid 63 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  3638
assign ( resid 63 and name HB1 ) ( resid 64 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3643
assign ( resid 63 and name HB1 ) ( resid 25 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3644
assign ( resid 38 and name HG# ) ( resid 38 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3648
assign ( resid 38 and name HG# ) ( resid 37 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3649
assign ( resid 80 and name HA ) ( resid 80 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3652
assign ( resid 83 and name HG# ) ( resid 83 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3669
assign ( resid 19 and name HD# ) ( resid 20 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3670
assign ( resid 19 and name HD# ) ( resid 19 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3671
assign ( resid 69 and name HG21 ) ( resid 69 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3692
assign ( resid 39 and name HG# ) ( resid 39 and name HN or resid 48 and name 
HN or resid 49 and name HN ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  3693
assign ( resid 57 and name HG21 ) ( resid 46 and name HN or resid 57 and 
name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3733
assign ( resid 32 and name HA ) ( resid 33 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3738
assign ( resid 57 and name HG21 ) ( resid 58 and name HN or resid 48 and 
name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3739
assign ( resid 57 and name HG21 ) ( resid 47 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3740
assign ( resid 57 and name HG21 ) ( resid 57 and name HA or resid 46 and 
name HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  3741
assign ( resid 7 and name HG21 ) ( resid 7 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3757
assign ( resid 83 and name HG# ) ( resid 84 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3762
assign ( resid 45 and name HG21 ) ( resid 45 and name HA or resid 47 and 
name HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  3763
assign ( resid 45 and name HG21 ) ( resid 46 and name HN or resid 42 and 
name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3764
assign ( resid 45 and name HG21 ) ( resid 60 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3767
assign ( resid 64 and name HG# ) ( resid 64 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3768
assign ( resid 64 and name HG# ) ( resid 25 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3771
assign ( resid 58 and name HG# or resid 27 and name HG# ) ( resid 34 and 
name HN or resid 83 and name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3773
assign ( resid 64 and name HG# ) ( resid 65 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3774
assign ( resid 64 and name HG# ) ( resid 64 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3775
assign ( resid 42 and name HG21 ) ( resid 42 and name HN or resid 46 and 
name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3776
assign ( resid 58 and name HG# ) ( resid 58 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3777
assign ( resid 75 and name HG# ) ( resid 76 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3778
assign ( resid 64 and name HG# ) ( resid 77 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3779
assign ( resid 87 and name HA ) ( resid 87 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3787
assign ( resid 75 and name HG# ) ( resid 75 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3789
assign ( resid 87 and name HA ) ( resid 88 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3794
assign ( resid 64 and name HG# or resid 27 and name HG# ) ( resid 64 and 
name HN or resid 28 and name HN ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  3795
assign ( resid 51 and name HA ) ( resid 51 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3796
assign ( resid 51 and name HA ) ( resid 52 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3797
assign ( resid 54 and name HA ) ( resid 54 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3804
assign ( resid 27 and name HG# ) ( resid 27 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3805
assign ( resid 21 and name HG# ) ( resid 21 and name HA or resid 37 and name 
HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  3806
assign ( resid 54 and name HA ) ( resid 55 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  3807
assign ( resid 88 and name HA ) ( resid 90 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3808
assign ( resid 21 and name HG# ) ( resid 21 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3809
assign ( resid 21 and name HG# ) ( resid 36 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3810
assign ( resid 21 and name HG# ) ( resid 20 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3811
assign ( resid 71 and name HA ) ( resid 71 and name HN or resid 73 and name 
HN ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  3813
assign ( resid 71 and name HA or resid 9 and name HA ) ( resid 71 and name 
HE2# or resid 10 and name HD2# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3815
assign ( resid 9 and name HA or resid 71 and name HA or resid 9 and name HA 
) ( resid 10 and name HN or resid 72 and name HN or resid 68 and name HN ) 
2.60 0.80 0.80 !FROM PEAK NUMBER:  3819
assign ( resid 93 and name HA ) ( resid 94 and name HN or resid 93 and name 
HN or resid 92 and name HN ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  3820
assign ( resid 9 and name HA ) ( resid 9 and name HN ) 2.60 0.80 0.80 !FROM 
PEAK NUMBER:  3827
assign ( resid 73 and name HA ) ( resid 74 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  3835
assign ( resid 84 and name HB1 ) ( resid 84 and name HN or resid 85 and name 
HN ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  3837
assign ( resid 39 and name HG# ) ( resid 39 and name HN or resid 48 and name 
HN or resid 49 and name HN ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  3838
assign ( resid 30 and name HA ) ( resid 30 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3839
assign ( resid 39 and name HG# ) ( resid 40 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3840
assign ( resid 23 and name HG2# ) ( resid 33 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3842
assign ( resid 30 and name HA ) ( resid 31 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3847
assign ( resid 81 and name HB1 ) ( resid 81 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  3851
assign ( resid 23 and name HG2# ) ( resid 25 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3852
assign ( resid 19 and name HA ) ( resid 18 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3853
assign ( resid 5 and name HA ) ( resid 6 and name HN ) 2.30 0.50 0.50 !FROM 
PEAK NUMBER:  3868
assign ( resid 95 and name HA or resid 85 and name HA ) ( resid 95 and name 
HN or resid 85 and name HN ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  3869
assign ( resid 50 and name HE1 ) ( resid 51 and name HN or resid 56 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3882
assign ( resid 50 and name HE1 ) ( resid 53 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3883
assign ( resid 62 and name HG2# ) ( resid 62 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3884
assign ( resid 24 and name HB1 ) ( resid 24 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3885
assign ( resid 24 and name HB1 ) ( resid 25 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3886
assign ( resid 50 and name HE1 ) ( resid 50 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3887
assign ( resid 50 and name HE1 ) ( resid 54 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3888
assign ( resid 82 and name HA ) ( resid 82 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3889
assign ( resid 17 and name HG2# ) ( resid 18 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3890
assign ( resid 90 and name HG2# ) ( resid 90 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3892
assign ( resid 31 and name HG2# ) ( resid 31 and name HN or resid 32 and 
name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3893
assign ( resid 90 and name HG2# ) ( resid 91 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3894
assign ( resid 31 and name HG2# ) ( resid 31 and name HN or resid 32 and 
name HN ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  3895
assign ( resid 96 and name HA ) ( resid 96 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3896
assign ( resid 34 and name HD11 or resid 31 and name HG2# ) ( resid 34 and 
name HN or resid 32 and name HN ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  3897
assign ( resid 34 and name HD11 ) ( resid 35 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3902
assign ( resid 56 and name HG2# ) ( resid 56 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3916
assign ( resid 11 and name HG2# ) ( resid 11 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3917
assign ( resid 81 and name HA ) ( resid 82 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3919
assign ( resid 81 and name HA ) ( resid 81 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3920
assign ( resid 52 and name HA ) ( resid 52 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  3922
assign ( resid 48 and name HG2# ) ( resid 37 and name HN or resid 36 and 
name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3925
assign ( resid 48 and name HG2# ) ( resid 49 and name HN or resid 48 and 
name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3927
assign ( resid 84 and name HA ) ( resid 85 and name HN or resid 84 and name 
HN ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  3939
assign ( resid 23 and name HD11 ) ( resid 23 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3965
assign ( resid 31 and name HD11 ) ( resid 31 and name HN or resid 32 and 
name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3978
assign ( resid 21 and name HG# ) ( resid 65 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4038
assign ( resid 21 and name HG# ) ( resid 67 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4039
assign ( resid 21 and name HG# ) ( resid 65 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4040
assign ( resid 48 and name HG2# ) ( resid 50 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4045
assign ( resid 48 and name HG2# ) ( resid 50 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4046
assign ( resid 48 and name HG2# ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4047
assign ( resid 81 and name HB1 ) ( resid 82 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4048
assign ( resid 46 and name HB# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4049
assign ( resid 46 and name HB# ) ( resid 48 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4050
assign ( resid 40 and name HB# ) ( resid 47 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4051
assign ( resid 40 and name HB# ) ( resid 40 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4052
assign ( resid 40 and name HB# ) ( resid 47 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4053
assign ( resid 40 and name HB# ) ( resid 40 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4054
assign ( resid 40 and name HB# ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4055
assign ( resid 65 and name HB# ) ( resid 23 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4056
assign ( resid 19 and name HB# ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4057
assign ( resid 66 and name HA ) ( resid 22 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4058
assign ( resid 55 and name HA ) ( resid 49 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4059
assign ( resid 55 and name HA ) ( resid 56 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4060
assign ( resid 35 and name HA ) ( resid 23 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4062
assign ( resid 35 and name HA ) ( resid 22 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4065
assign ( resid 68 and name HA ) ( resid 73 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4066
assign ( resid 68 and name HA ) ( resid 68 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4067
assign ( resid 68 and name HA ) ( resid 69 and name HG1 or resid 74 and name 
HG ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4068
assign ( resid 67 and name HA ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4070
assign ( resid 67 and name HA ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4071
assign ( resid 67 and name HA ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4072
assign ( resid 67 and name HA ) ( resid 67 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4074
assign ( resid 76 and name HA ) ( resid 75 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4075
assign ( resid 37 and name HA ) ( resid 37 and name HN or resid 36 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4076
assign ( resid 37 and name HA ) ( resid 21 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4077
assign ( resid 37 and name HA ) ( resid 20 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4078
assign ( resid 37 and name HA ) ( resid 37 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4079
assign ( resid 37 and name HA ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4080
assign ( resid 37 and name HA ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4082
assign ( resid 47 and name HA ) ( resid 47 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4083
assign ( resid 47 and name HA ) ( resid 57 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4084
assign ( resid 47 and name HA ) ( resid 47 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4087
assign ( resid 47 and name HA ) ( resid 47 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4088
assign ( resid 47 and name HA ) ( resid 57 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4089
assign ( resid 47 and name HA ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4090
assign ( resid 21 and name HA ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4093
assign ( resid 22 and name HA ) ( resid 22 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4094
assign ( resid 22 and name HA ) ( resid 23 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4095
assign ( resid 45 and name HA ) ( resid 59 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4104
assign ( resid 45 and name HA ) ( resid 45 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4105
assign ( resid 20 and name HA ) ( resid 21 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  4106
assign ( resid 20 and name HA ) ( resid 37 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  4109
assign ( resid 20 and name HA ) ( resid 20 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  4112
assign ( resid 20 and name HA ) ( resid 20 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  4113
assign ( resid 20 and name HA ) ( resid 21 and name HB or resid 68 and name 
HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4115
assign ( resid 20 and name HA ) ( resid 37 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4117
assign ( resid 63 and name HA ) ( resid 64 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  4120
assign ( resid 63 and name HA ) ( resid 63 and name HN or resid 32 and name 
HE2# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4121
assign ( resid 63 and name HA ) ( resid 26 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  4124
assign ( resid 79 and name HA# ) ( resid 82 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4126
assign ( resid 84 and name HA ) ( resid 85 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4127
assign ( resid 84 and name HA ) ( resid 83 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4128
assign ( resid 80 and name HA ) ( resid 81 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4134
assign ( resid 32 and name HA ) ( resid 32 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4135
assign ( resid 26 and name HB# ) ( resid 63 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4137
assign ( resid 26 and name HB# ) ( resid 26 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  4138
assign ( resid 26 and name HB# ) ( resid 26 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4139
assign ( resid 38 and name HA ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4141
assign ( resid 35 and name HB# ) ( resid 35 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4142
assign ( resid 35 and name HB# ) ( resid 36 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4143
assign ( resid 35 and name HB# ) ( resid 22 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4144
assign ( resid 35 and name HB# ) ( resid 22 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4146
assign ( resid 28 and name HB# ) ( resid 29 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  4151
assign ( resid 64 and name HA ) ( resid 65 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4155
assign ( resid 64 and name HA ) ( resid 79 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4156
assign ( resid 64 and name HA ) ( resid 64 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4157
assign ( resid 34 and name HA ) ( resid 34 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4158
assign ( resid 82 and name HA ) ( resid 83 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4159
assign ( resid 82 and name HA ) ( resid 60 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4161
assign ( resid 82 and name HA ) ( resid 81 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4163
assign ( resid 21 and name HG# ) ( resid 38 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4165
assign ( resid 21 and name HG# ) ( resid 48 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4166
assign ( resid 38 and name HG# ) ( resid 21 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4168
assign ( resid 31 and name HA ) ( resid 26 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4173
assign ( resid 69 and name HA ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4174
assign ( resid 31 and name HA ) ( resid 31 and name HG2# or resid 31 and 
name HD11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4175
assign ( resid 24 and name HA ) ( resid 24 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4176
assign ( resid 53 and name HA# ) ( resid 53 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4179
assign ( resid 72 and name HA# ) ( resid 71 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4180
assign ( resid 81 and name HA ) ( resid 80 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4181
assign ( resid 27 and name HA ) ( resid 26 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4182
assign ( resid 86 and name HA ) ( resid 85 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4183
assign ( resid 87 and name HB# ) ( resid 87 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  4191
assign ( resid 90 and name HB ) ( resid 91 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4193
assign ( resid 34 and name HA ) ( resid 35 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4195
assign ( resid 34 and name HB ) ( resid 34 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4198
assign ( resid 34 and name HB ) ( resid 34 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4199
assign ( resid 34 and name HG11 ) ( resid 34 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4200
assign ( resid 34 and name HG11 ) ( resid 34 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4203
assign ( resid 34 and name HG11 ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4204
assign ( resid 56 and name HB ) ( resid 57 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4206
assign ( resid 25 and name HA ) ( resid 26 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  4208
assign ( resid 25 and name HA ) ( resid 32 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  4209
assign ( resid 25 and name HB# ) ( resid 25 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4210
assign ( resid 25 and name HB# ) ( resid 25 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4211
assign ( resid 25 and name HB# ) ( resid 26 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4212
assign ( resid 56 and name HG2# ) ( resid 48 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4215
assign ( resid 56 and name HG2# ) ( resid 57 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4216
assign ( resid 56 and name HG2# ) ( resid 55 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4217
assign ( resid 46 and name HD# ) ( resid 46 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  4232
assign ( resid 21 and name HG# ) ( resid 46 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  4246
assign ( resid 21 and name HG# ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4252
assign ( resid 21 and name HG# ) ( resid 23 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4254
assign ( resid 21 and name HG# ) ( resid 67 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4258
assign ( resid 21 and name HG# ) ( resid 21 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4262
assign ( resid 66 and name HA ) ( resid 76 and name HA or resid 67 and name 
HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4264
assign ( resid 74 and name HA ) ( resid 68 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  4270
assign ( resid 50 and name HE1 ) ( resid 50 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4272
assign ( resid 50 and name HE1 ) ( resid 37 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4276
assign ( resid 74 and name HD# ) ( resid 75 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4282
assign ( resid 74 and name HD# ) ( resid 66 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4284
assign ( resid 68 and name HA ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4285
assign ( resid 48 and name HG2# ) ( resid 21 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4288
assign ( resid 46 and name HD# ) ( resid 47 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4289
assign ( resid 31 and name HD11 ) ( resid 31 and name HN or resid 32 and 
name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4292
assign ( resid 24 and name HB1 ) ( resid 65 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4293
assign ( resid 36 and name HA# ) ( resid 37 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4294
assign ( resid 21 and name HG# ) ( resid 21 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4295
assign ( resid 36 and name HA# ) ( resid 48 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4296
assign ( resid 18 and name HA# ) ( resid 17 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4297
assign ( resid 6 and name HB ) ( resid 6 and name HA ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  4298
assign ( resid 6 and name HB ) ( resid 6 and name HA or resid 5 and name HA 
) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4299
assign ( resid 6 and name HB ) ( resid 7 and name HA ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  4300
assign ( resid 45 and name HB ) ( resid 59 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4304
assign ( resid 50 and name HG# ) ( resid 56 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4306
assign ( resid 46 and name HD# ) ( resid 60 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4307
assign ( resid 48 and name HG2# ) ( resid 37 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4309
assign ( resid 33 and name HA# ) ( resid 34 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4313
assign ( resid 48 and name HB ) ( resid 48 and name HN or resid 49 and name 
HN or resid 39 and name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4314
assign ( resid 44 and name HB# ) ( resid 45 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4315
assign ( resid 44 and name HB# ) ( resid 44 and name HD2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4316
assign ( resid 44 and name HB# ) ( resid 44 and name HD2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4317
assign ( resid 78 and name HB# ) ( resid 78 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4318
assign ( resid 94 and name HB# or resid 52 and name HB# ) ( resid 94 and 
name HN or resid 53 and name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4321
assign ( resid 94 and name HB# ) ( resid 94 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4322
assign ( resid 30 and name HB# ) ( resid 30 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4323
assign ( resid 23 and name HB ) ( resid 34 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4327
assign ( resid 71 and name HG# ) ( resid 71 and name HE2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4328
assign ( resid 71 and name HG# ) ( resid 71 and name HE2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4329
assign ( resid 23 and name HB ) ( resid 23 and name HN or resid 33 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4330
assign ( resid 32 and name HG# ) ( resid 33 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4332
assign ( resid 75 and name HB ) ( resid 75 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4333
assign ( resid 32 and name HG# ) ( resid 26 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4334
assign ( resid 64 and name HB ) ( resid 25 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4335
assign ( resid 68 and name HB# ) ( resid 68 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4336
assign ( resid 68 and name HB# ) ( resid 68 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4337
assign ( resid 76 and name HB# or resid 68 and name HB# ) ( resid 76 and 
name HA or resid 67 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4338
assign ( resid 68 and name HB# ) ( resid 21 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4340
assign ( resid 83 and name HB or resid 27 and name HB ) ( resid 84 and name 
HN or resid 28 and name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4341
assign ( resid 54 and name HB# ) ( resid 54 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4343
assign ( resid 87 and name HB# ) ( resid 87 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4345
assign ( resid 29 and name HB# ) ( resid 30 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4347
assign ( resid 85 and name HG# ) ( resid 85 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4348
assign ( resid 54 and name HG# ) ( resid 55 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4350
assign ( resid 56 and name HG11 ) ( resid 57 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4351
assign ( resid 23 and name HG11 or resid 37 and name HG# ) ( resid 23 and 
name HN or resid 38 and name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4352
assign ( resid 47 and name HG# ) ( resid 48 and name HN or resid 39 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4353
assign ( resid 80 and name HG# ) ( resid 80 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4356
assign ( resid 25 and name HG# ) ( resid 25 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4357
assign ( resid 20 and name HB# ) ( resid 20 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4360
assign ( resid 20 and name HB# ) ( resid 21 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4361
assign ( resid 93 and name HG# ) ( resid 93 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4364
assign ( resid 82 and name HD# ) ( resid 81 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4365
assign ( resid 77 and name HG2# ) ( resid 77 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4371
assign ( resid 77 and name HG2# ) ( resid 78 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4372
assign ( resid 48 and name HD11 ) ( resid 48 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4373
assign ( resid 46 and name HB# ) ( resid 46 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4374
assign ( resid 40 and name HB# ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4376
assign ( resid 66 and name HA ) ( resid 77 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4377
assign ( resid 66 and name HA ) ( resid 66 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4378
assign ( resid 29 and name HA ) ( resid 31 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4384
assign ( resid 35 and name HB# ) ( resid 36 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4385
assign ( resid 28 and name HB# ) ( resid 28 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4386
assign ( resid 24 and name HA ) ( resid 25 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4387
assign ( resid 31 and name HB ) ( resid 31 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4388
assign ( resid 31 and name HB ) ( resid 31 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4389
assign ( resid 71 and name HG# ) ( resid 71 and name HE2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4394
assign ( resid 75 and name HB ) ( resid 75 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4395
assign ( resid 75 and name HB ) ( resid 67 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4396
assign ( resid 29 and name HB# or resid 80 and name HB# ) ( resid 30 and 
name HA or resid 81 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4398
assign ( resid 96 and name HD# ) ( resid 96 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4399
assign ( resid 21 and name HB ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4400
assign ( resid 27 and name HB ) ( resid 27 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  4401
assign ( resid 65 and name HB# ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4402
assign ( resid 65 and name HB# ) ( resid 67 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4409
assign ( resid 65 and name HB# ) ( resid 65 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4412
assign ( resid 65 and name HB# ) ( resid 22 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4413
assign ( resid 40 and name HB# ) ( resid 41 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4414
assign ( resid 67 and name HB# ) ( resid 67 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4415
assign ( resid 91 and name HE# ) ( resid 91 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4416
assign ( resid 66 and name HB# ) ( resid 22 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4419
assign ( resid 66 and name HB# ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4420
assign ( resid 50 and name HG# ) ( resid 50 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4422
assign ( resid 65 and name HB# ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4427
assign ( resid 65 and name HB# ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4428
assign ( resid 25 and name HG# or resid 85 and name HG# ) ( resid 25 and 
name HD# or resid 85 and name HD# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  4430
assign ( resid 46 and name HD# ) ( resid 40 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4432
assign ( resid 77 and name HB ) ( resid 77 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4442
assign ( resid 19 and name HB# ) ( resid 19 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4443
assign ( resid 37 and name HG# ) ( resid 20 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4444
assign ( resid 48 and name HG11 ) ( resid 48 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4445
assign ( resid 68 and name HG# ) ( resid 68 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  4446
assign ( resid 34 and name HB ) ( resid 34 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4448
assign ( resid 38 and name HB ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4450
assign ( resid 59 and name HB# ) ( resid 59 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4451
assign ( resid 56 and name HG12 ) ( resid 56 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4454
assign ( resid 77 and name HB ) ( resid 75 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4456
assign ( resid 77 and name HB ) ( resid 82 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4457
assign ( resid 74 and name HB# ) ( resid 74 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4458
assign ( resid 74 and name HB# ) ( resid 74 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  4459
assign ( resid 41 and name HB# ) ( resid 38 and name HG# or resid 46 and 
name HD# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  4461

noechd033103sss

assign ( resid 36 and name HA# ) ( resid 50 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  29
assign ( resid 36 and name HA# ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  32
assign ( resid 36 and name HA# ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  34
assign ( resid 46 and name HB# ) ( resid 23 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  38
assign ( resid 46 and name HB# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  39
assign ( resid 46 and name HB# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  40
assign ( resid 36 and name HA# ) ( resid 50 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  44
assign ( resid 61 and name HA# ) ( resid 80 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  53
assign ( resid 61 and name HA# ) ( resid 80 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  62
assign ( resid 72 and name HA# ) ( resid 68 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  77
assign ( resid 72 and name HA# ) ( resid 68 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  83
assign ( resid 40 and name HB# ) ( resid 40 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  116
assign ( resid 40 and name HB# ) ( resid 47 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  121
assign ( resid 40 and name HB# ) ( resid 47 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  125
assign ( resid 65 and name HB# ) ( resid 65 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  128
assign ( resid 65 and name HB# ) ( resid 65 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  129
assign ( resid 54 and name HD# ) ( resid 54 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  136
assign ( resid 80 and name HD# ) ( resid 80 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  152
assign ( resid 25 and name HD# ) ( resid 25 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  154
assign ( resid 80 and name HD# or resid 43 and name HD# ) ( resid 78 and 
name HB# or resid 44 and name HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  157
assign ( resid 80 and name HD# ) ( resid 81 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  158
assign ( resid 80 and name HD# ) ( resid 80 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  159
assign ( resid 22 and name HD# ) ( resid 35 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  160
assign ( resid 47 and name HD# ) ( resid 39 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  164
assign ( resid 85 and name HD# or resid 54 and name HD# ) ( resid 84 and 
name HA or resid 54 and name HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  165
assign ( resid 47 and name HD# or resid 37 and name HD# ) ( resid 47 and 
name HA or resid 37 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  169
assign ( resid 47 and name HD# or resid 80 and name HD# ) ( resid 57 and 
name HB or resid 80 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  170
assign ( resid 37 and name HD# ) ( resid 20 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  171
assign ( resid 25 and name HD# ) ( resid 64 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  173
assign ( resid 85 and name HD# ) ( resid 87 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  174
assign ( resid 47 and name HD# ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  175
assign ( resid 74 and name HB# ) ( resid 74 and name HG ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  179
assign ( resid 74 and name HB# ) ( resid 74 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  180
assign ( resid 74 and name HB# ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  182
assign ( resid 74 and name HB# ) ( resid 74 and name HG ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  185
assign ( resid 74 and name HB# ) ( resid 74 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  186
assign ( resid 43 and name HD# ) ( resid 43 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  193
assign ( resid 22 and name HD# ) ( resid 22 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  197
assign ( resid 37 and name HD# ) ( resid 18 and name HA# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  199
assign ( resid 37 and name HD# ) ( resid 20 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  204
assign ( resid 37 and name HD# or resid 25 and name HD# ) ( resid 37 and 
name HG# or resid 25 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  205
assign ( resid 68 and name HD# ) ( resid 72 and name HA# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  206
assign ( resid 68 and name HD# ) ( resid 72 and name HA# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  208
assign ( resid 68 and name HD# or resid 25 and name HD# ) ( resid 68 and 
name HB# or resid 25 and name HB# or resid 64 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  213
assign ( resid 68 and name HD# ) ( resid 68 and name HG# or resid 74 and 
name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  214
assign ( resid 68 and name HD# ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  217
assign ( resid 82 and name HB# ) ( resid 60 and name HE# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  224
assign ( resid 74 and name HB# ) ( resid 68 and name HD# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  225
assign ( resid 74 and name HB# ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  226
assign ( resid 29 and name HD# or resid 22 and name HD# ) ( resid 29 and 
name HA or resid 35 and name HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  228
assign ( resid 68 and name HD# ) ( resid 68 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  229
assign ( resid 68 and name HD# ) ( resid 74 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  230
assign ( resid 82 and name HB# ) ( resid 82 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  233
assign ( resid 77 and name HB ) ( resid 77 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  241
assign ( resid 77 and name HB ) ( resid 77 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  242
assign ( resid 77 and name HB ) ( resid 77 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  244
assign ( resid 56 and name HB ) ( resid 56 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  246
assign ( resid 48 and name HB ) ( resid 48 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  247
assign ( resid 5 and name HB# ) ( resid 5 and name HA ) 2.60 0.80 0.80 !FROM 
PEAK NUMBER:  248
assign ( resid 5 and name HB# or resid 48 and name HB ) ( resid 5 and name 
HG or resid 56 and name HG2# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  250
assign ( resid 77 and name HB ) ( resid 77 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  254
assign ( resid 56 and name HB ) ( resid 56 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  255
assign ( resid 56 and name HB ) ( resid 56 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  256
assign ( resid 56 and name HB ) ( resid 56 and name HD11 or resid 56 and 
name HG2# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  257
assign ( resid 48 and name HB ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  258
assign ( resid 48 and name HB ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  259
assign ( resid 93 and name HE# or resid 91 and name HE# ) ( resid 93 and 
name HG# or resid 91 and name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  270
assign ( resid 78 and name HB# ) ( resid 64 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  283
assign ( resid 78 and name HB# or resid 93 and name HE# ) ( resid 64 and 
name HA or resid 93 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  286
assign ( resid 91 and name HE# ) ( resid 90 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  293
assign ( resid 91 and name HE# ) ( resid 91 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  300
assign ( resid 19 and name HB# ) ( resid 19 and name HG ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  303
assign ( resid 60 and name HE# ) ( resid 60 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  311
assign ( resid 78 and name HB# ) ( resid 78 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  313
assign ( resid 44 and name HB# ) ( resid 44 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  315
assign ( resid 91 and name HE# ) ( resid 90 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  316
assign ( resid 78 and name HB# ) ( resid 78 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  317
assign ( resid 19 and name HB# ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  322
assign ( resid 19 and name HB# ) ( resid 70 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  325
assign ( resid 52 and name HB# ) ( resid 52 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  348
assign ( resid 51 and name HB# ) ( resid 51 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  356
assign ( resid 94 and name HB# or resid 52 and name HB# ) ( resid 94 and 
name HA or resid 52 and name HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  359
assign ( resid 51 and name HB# ) ( resid 51 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  361
assign ( resid 94 and name HB# ) ( resid 94 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  367
assign ( resid 94 and name HB# ) ( resid 94 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  369
assign ( resid 94 and name HB# ) ( resid 94 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  371
assign ( resid 62 and name HB ) ( resid 62 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  373
assign ( resid 62 and name HB ) ( resid 62 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  375
assign ( resid 30 and name HB# ) ( resid 28 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  377
assign ( resid 62 and name HB ) ( resid 62 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  378
assign ( resid 10 and name HB# ) ( resid 10 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  382
assign ( resid 30 and name HB# ) ( resid 28 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  384
assign ( resid 10 and name HB# ) ( resid 10 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  389
assign ( resid 11 and name HB ) ( resid 11 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  396
assign ( resid 31 and name HB ) ( resid 31 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  402
assign ( resid 11 and name HB ) ( resid 11 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  403
assign ( resid 6 and name HB ) ( resid 6 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  406
assign ( resid 6 and name HB ) ( resid 6 and name HG2# or resid 6 and name 
HD11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  407
assign ( resid 90 and name HB ) ( resid 90 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  413
assign ( resid 31 and name HB ) ( resid 31 and name HD11 or resid 31 and 
name HG2# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  416
assign ( resid 34 and name HB ) ( resid 58 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  418
assign ( resid 34 and name HB ) ( resid 34 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  419
assign ( resid 90 and name HB ) ( resid 88 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  420
assign ( resid 90 and name HB ) ( resid 90 and name HG2# or resid 90 and 
name HD11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  421
assign ( resid 90 and name HB ) ( resid 90 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  422
assign ( resid 34 and name HB ) ( resid 34 and name HD11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  427
assign ( resid 90 and name HB ) ( resid 90 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  430
assign ( resid 34 and name HB ) ( resid 34 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  435
assign ( resid 17 and name HB ) ( resid 17 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  452
assign ( resid 55 and name HG# ) ( resid 55 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  453
assign ( resid 55 and name HG# ) ( resid 55 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  461
assign ( resid 49 and name HG# ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  462
assign ( resid 49 and name HG# ) ( resid 49 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  471
assign ( resid 87 and name HG# or resid 55 and name HG# ) ( resid 87 and 
name HB# or resid 55 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  474
assign ( resid 49 and name HG# ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  475
assign ( resid 45 and name HB ) ( resid 57 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  479
assign ( resid 87 and name HG# ) ( resid 87 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  482
assign ( resid 87 and name HG# or resid 88 and name HG# ) ( resid 87 and 
name HB# or resid 88 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  483
assign ( resid 88 and name HG# ) ( resid 88 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  485
assign ( resid 45 and name HB ) ( resid 45 and name HG21 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  489
assign ( resid 45 and name HB ) ( resid 45 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  490
assign ( resid 73 and name HG# ) ( resid 71 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  491
assign ( resid 73 and name HG# ) ( resid 73 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  492
assign ( resid 73 and name HG# ) ( resid 73 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  494
assign ( resid 73 and name HG# ) ( resid 69 and name HG1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  495
assign ( resid 73 and name HG# ) ( resid 71 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  500
assign ( resid 21 and name HB ) ( resid 21 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  506
assign ( resid 21 and name HB ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  508
assign ( resid 21 and name HB ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  509
assign ( resid 71 and name HG# ) ( resid 70 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  519
assign ( resid 23 and name HB ) ( resid 23 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  520
assign ( resid 71 and name HG# ) ( resid 71 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  524
assign ( resid 23 and name HB ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  526
assign ( resid 32 and name HG# ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  528
assign ( resid 71 and name HG# ) ( resid 71 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  533
assign ( resid 71 and name HG# ) ( resid 71 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  536
assign ( resid 71 and name HG# ) ( resid 71 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  537
assign ( resid 23 and name HB ) ( resid 32 and name HB# or resid 58 and name 
HB ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  540
assign ( resid 23 and name HB ) ( resid 23 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  541
assign ( resid 32 and name HG# ) ( resid 25 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  542
assign ( resid 32 and name HG# ) ( resid 32 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  543
assign ( resid 32 and name HG# ) ( resid 25 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  545
assign ( resid 32 and name HG# ) ( resid 23 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  546
assign ( resid 58 and name HB ) ( resid 58 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  547
assign ( resid 75 and name HB ) ( resid 75 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  549
assign ( resid 75 and name HB ) ( resid 75 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  550
assign ( resid 22 and name HB# ) ( resid 22 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  562
assign ( resid 22 and name HB# ) ( resid 22 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  571
assign ( resid 22 and name HB# ) ( resid 22 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  572
assign ( resid 22 and name HB# ) ( resid 22 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  577
assign ( resid 25 and name HB# ) ( resid 25 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  579
assign ( resid 25 and name HB# ) ( resid 64 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  580
assign ( resid 25 and name HB# ) ( resid 25 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  581
assign ( resid 25 and name HB# ) ( resid 25 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  586
assign ( resid 42 and name HB ) ( resid 42 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  589
assign ( resid 42 and name HB ) ( resid 42 and name HG21 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  591
assign ( resid 37 and name HB# or resid 25 and name HB# ) ( resid 37 and 
name HD# or resid 25 and name HD# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  593
assign ( resid 39 and name HB ) ( resid 39 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  596
assign ( resid 37 and name HB# ) ( resid 37 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  597
assign ( resid 39 and name HB ) ( resid 39 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  602
assign ( resid 39 and name HB ) ( resid 39 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  604
assign ( resid 37 and name HB# ) ( resid 37 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  605
assign ( resid 93 and name HB# or resid 47 and name HB# ) ( resid 93 and 
name HG# or resid 47 and name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  621
assign ( resid 64 and name HB ) ( resid 64 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  622
assign ( resid 64 and name HB ) ( resid 64 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  623
assign ( resid 55 and name HB# ) ( resid 55 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  630
assign ( resid 41 and name HB# or resid 91 and name HB# ) ( resid 41 and 
name HA or resid 91 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  634
assign ( resid 91 and name HB# ) ( resid 91 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  635
assign ( resid 41 and name HB# or resid 91 and name HB# ) ( resid 41 and 
name HA or resid 91 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  637
assign ( resid 91 and name HB# ) ( resid 91 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  638
assign ( resid 55 and name HB# ) ( resid 55 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  639
assign ( resid 55 and name HB# ) ( resid 55 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  640
assign ( resid 47 and name HB# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  641
assign ( resid 93 and name HB# or resid 91 and name HB# ) ( resid 93 and 
name HE# or resid 91 and name HE# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  642
assign ( resid 7 and name HB ) ( resid 7 and name HA ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  645
assign ( resid 41 and name HB# ) ( resid 42 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  653
assign ( resid 41 and name HB# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  654
assign ( resid 55 and name HB# ) ( resid 55 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  655
assign ( resid 7 and name HB ) ( resid 7 and name HG21 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  658
assign ( resid 50 and name HG# ) ( resid 50 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  659
assign ( resid 47 and name HB# ) ( resid 40 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  662
assign ( resid 96 and name HB# or resid 68 and name HB# ) ( resid 96 and 
name HG# or resid 68 and name HG# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  674
assign ( resid 41 and name HB# ) ( resid 41 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  676
assign ( resid 57 and name HB ) ( resid 57 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  686
assign ( resid 57 and name HB ) ( resid 57 and name HG21 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  688
assign ( resid 4 and name HG# ) ( resid 4 and name HA ) 2.60 0.80 0.80 !FROM 
PEAK NUMBER:  691
assign ( resid 4 and name HG# ) ( resid 4 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  693
assign ( resid 83 and name HB ) ( resid 83 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  697
assign ( resid 76 and name HB# ) ( resid 76 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  698
assign ( resid 27 and name HB ) ( resid 62 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  705
assign ( resid 59 and name HB# ) ( resid 59 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  706
assign ( resid 68 and name HB# ) ( resid 68 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  707
assign ( resid 86 and name HB# ) ( resid 86 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  714
assign ( resid 83 and name HB ) ( resid 83 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  716
assign ( resid 49 and name HB# ) ( resid 49 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  719
assign ( resid 86 and name HB# ) ( resid 86 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  721
assign ( resid 86 and name HB# ) ( resid 86 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  722
assign ( resid 68 and name HB# ) ( resid 68 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  726
assign ( resid 68 and name HB# ) ( resid 68 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  728
assign ( resid 68 and name HB# ) ( resid 68 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  729
assign ( resid 59 and name HB# ) ( resid 27 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  731
assign ( resid 86 and name HB# ) ( resid 86 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  732
assign ( resid 86 and name HB# ) ( resid 86 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  733
assign ( resid 27 and name HB ) ( resid 27 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  734
assign ( resid 27 and name HB ) ( resid 27 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  736
assign ( resid 49 and name HB# ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  737
assign ( resid 38 and name HB ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  745
assign ( resid 59 and name HB# ) ( resid 59 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  747
assign ( resid 76 and name HB# ) ( resid 75 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  749
assign ( resid 38 and name HB ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  754
assign ( resid 59 and name HB# ) ( resid 59 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  755
assign ( resid 54 and name HB# ) ( resid 54 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  756
assign ( resid 54 and name HB# ) ( resid 54 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  758
assign ( resid 59 and name HB# ) ( resid 59 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  759
assign ( resid 69 and name HB ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  764
assign ( resid 38 and name HB ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  767
assign ( resid 54 and name HB# or resid 9 and name HB# ) ( resid 54 and name 
HA or resid 9 and name HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  772
assign ( resid 9 and name HB# ) ( resid 9 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  774
assign ( resid 69 and name HB ) ( resid 70 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  776
assign ( resid 9 and name HB# ) ( resid 9 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  779
assign ( resid 54 and name HB# ) ( resid 54 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  783
assign ( resid 54 and name HB# or resid 9 and name HB# ) ( resid 54 and name 
HD# or resid 9 and name HD# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  784
assign ( resid 69 and name HB ) ( resid 69 and name HG1 or resid 69 and name 
HG21 ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  789
assign ( resid 69 and name HB ) ( resid 69 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  790
assign ( resid 73 and name HB# ) ( resid 73 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  804
assign ( resid 88 and name HB# ) ( resid 88 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  814
assign ( resid 43 and name HB# ) ( resid 43 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  815
assign ( resid 87 and name HB# or resid 88 and name HB# ) ( resid 87 and 
name HG# or resid 88 and name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  822
assign ( resid 87 and name HB# ) ( resid 85 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  824
assign ( resid 43 and name HB# ) ( resid 43 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  825
assign ( resid 43 and name HB# ) ( resid 43 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  826
assign ( resid 29 and name HB# or resid 43 and name HB# or resid 80 and name 
HB# ) ( resid 29 and name HD# or resid 43 and name HD# or resid 80 and name 
HD# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  827
assign ( resid 29 and name HB# ) ( resid 29 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  830
assign ( resid 80 and name HB# or resid 29 and name HB# ) ( resid 80 and 
name HD# or resid 29 and name HD# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  836
assign ( resid 29 and name HB# or resid 80 and name HB# ) ( resid 29 and 
name HG# or resid 80 and name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  838
assign ( resid 29 and name HG# or resid 96 and name HD# ) ( resid 29 and 
name HB# or resid 96 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  840
assign ( resid 35 and name HB# ) ( resid 35 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  852
assign ( resid 35 and name HB# ) ( resid 22 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  853
assign ( resid 35 and name HB# ) ( resid 35 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  856
assign ( resid 35 and name HB# ) ( resid 34 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  857
assign ( resid 87 and name HB# ) ( resid 87 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  861
assign ( resid 87 and name HB# ) ( resid 87 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  862
assign ( resid 35 and name HB# ) ( resid 22 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  863
assign ( resid 87 and name HB# ) ( resid 87 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  865
assign ( resid 96 and name HD# ) ( resid 96 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  870
assign ( resid 17 and name HG11 ) ( resid 16 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  874
assign ( resid 93 and name HD# ) ( resid 93 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  883
assign ( resid 93 and name HD# ) ( resid 93 and name HE# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  884
assign ( resid 32 and name HB# ) ( resid 32 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  894
assign ( resid 17 and name HG11 ) ( resid 17 and name HD11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  895
assign ( resid 17 and name HG11 ) ( resid 17 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  903
assign ( resid 34 and name HG11 ) ( resid 34 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  904
assign ( resid 34 and name HG12 ) ( resid 34 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  905
assign ( resid 71 and name HB# ) ( resid 71 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  908
assign ( resid 71 and name HB# ) ( resid 71 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  909
assign ( resid 32 and name HB# ) ( resid 32 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  911
assign ( resid 34 and name HG11 ) ( resid 34 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  912
assign ( resid 34 and name HG11 ) ( resid 34 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  913
assign ( resid 34 and name HG12 ) ( resid 34 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  914
assign ( resid 34 and name HG12 ) ( resid 58 and name HG# or resid 23 and 
name HG12 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  915
assign ( resid 34 and name HG12 ) ( resid 34 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  916
assign ( resid 23 and name HG12 ) ( resid 23 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  917
assign ( resid 71 and name HB# ) ( resid 71 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  931
assign ( resid 71 and name HB# ) ( resid 71 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  937
assign ( resid 71 and name HB# ) ( resid 71 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  938
assign ( resid 34 and name HG12 ) ( resid 34 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  939
assign ( resid 71 and name HB# ) ( resid 71 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  942
assign ( resid 59 and name HG# ) ( resid 59 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  950
assign ( resid 23 and name HG11 or resid 48 and name HG11 ) ( resid 23 and 
name HG2# or resid 48 and name HG2# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  957
assign ( resid 70 and name HA ) ( resid 70 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  966
assign ( resid 26 and name HB# ) ( resid 26 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  969
assign ( resid 26 and name HB# ) ( resid 27 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  970
assign ( resid 26 and name HB# ) ( resid 26 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  973
assign ( resid 59 and name HG# ) ( resid 59 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  977
assign ( resid 59 and name HG# ) ( resid 59 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  978
assign ( resid 86 and name HG# ) ( resid 86 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  979
assign ( resid 70 and name HG# ) ( resid 69 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  983
assign ( resid 77 and name HG11 ) ( resid 77 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  986
assign ( resid 77 and name HG11 ) ( resid 77 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  987
assign ( resid 23 and name HG11 ) ( resid 23 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  988
assign ( resid 56 and name HG11 or resid 48 and name HG11 ) ( resid 56 and 
name HA or resid 48 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  989
assign ( resid 48 and name HG11 or resid 23 and name HG11 ) ( resid 58 and 
name HB ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  990
assign ( resid 23 and name HG11 ) ( resid 23 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  991
assign ( resid 77 and name HG12 ) ( resid 77 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  993
assign ( resid 77 and name HG12 ) ( resid 77 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  994
assign ( resid 22 and name HG# ) ( resid 22 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  995
assign ( resid 22 and name HG# ) ( resid 22 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  996
assign ( resid 86 and name HG# ) ( resid 86 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1003
assign ( resid 54 and name HG# ) ( resid 54 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1008
assign ( resid 54 and name HG# ) ( resid 54 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1009
assign ( resid 77 and name HG11 ) ( resid 77 and name HD11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1010
assign ( resid 56 and name HG11 or resid 77 and name HG11 ) ( resid 56 and 
name HA or resid 77 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1011
assign ( resid 56 and name HG11 or resid 77 and name HG11 ) ( resid 56 and 
name HG12 or resid 77 and name HG2# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  
1012
assign ( resid 23 and name HG11 or resid 56 and name HG11 ) ( resid 23 and 
name HD11 or resid 56 and name HD11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  
1013
assign ( resid 48 and name HG11 ) ( resid 38 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1015
assign ( resid 90 and name HG11 ) ( resid 90 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1016
assign ( resid 47 and name HG# ) ( resid 47 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1017
assign ( resid 22 and name HG# ) ( resid 35 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1019
assign ( resid 74 and name HG or resid 47 and name HG# ) ( resid 74 and name 
HB# or resid 47 and name HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1022
assign ( resid 11 and name HG11 ) ( resid 11 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1023
assign ( resid 77 and name HG12 or resid 74 and name HG or resid 11 and name 
HG11 ) ( resid 77 and name HD11 or resid 74 and name HD# or resid 11 and 
name HG2# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1024
assign ( resid 11 and name HG11 or resid 77 and name HG12 ) ( resid 11 and 
name HD11 or resid 75 and name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1025
assign ( resid 77 and name HG12 ) ( resid 77 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1028
assign ( resid 22 and name HG# ) ( resid 22 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1030
assign ( resid 56 and name HG12 or resid 90 and name HG12 ) ( resid 56 and 
name HB or resid 90 and name HB ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1032
assign ( resid 56 and name HG12 ) ( resid 56 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1033
assign ( resid 56 and name HG12 or resid 90 and name HG12 ) ( resid 56 and 
name HD11 or resid 90 and name HD11 or resid 90 and name HG2# ) 2.30 0.50 
0.50 !FROM PEAK NUMBER:  1035
assign ( resid 90 and name HG12 ) ( resid 90 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1036
assign ( resid 90 and name HG12 ) ( resid 90 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1037
assign ( resid 86 and name HG# ) ( resid 86 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1050
assign ( resid 70 and name HG# ) ( resid 70 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1051
assign ( resid 70 and name HG# ) ( resid 70 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1052
assign ( resid 70 and name HG# ) ( resid 70 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1053
assign ( resid 70 and name HG# ) ( resid 70 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1054
assign ( resid 19 and name HG ) ( resid 19 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1057
assign ( resid 54 and name HG# or resid 43 and name HG# ) ( resid 54 and 
name HD# or resid 43 and name HD# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1058
assign ( resid 48 and name HG11 ) ( resid 47 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1059
assign ( resid 86 and name HA ) ( resid 87 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1064
assign ( resid 86 and name HA ) ( resid 85 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1065
assign ( resid 86 and name HA ) ( resid 86 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1067
assign ( resid 86 and name HA ) ( resid 86 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1068
assign ( resid 19 and name HG ) ( resid 17 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1077
assign ( resid 80 and name HG# ) ( resid 81 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1078
assign ( resid 80 and name HG# or resid 9 and name HG# ) ( resid 80 and name 
HD# or resid 9 and name HD# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1079
assign ( resid 80 and name HG# ) ( resid 62 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1080
assign ( resid 54 and name HG# ) ( resid 56 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1081
assign ( resid 37 and name HG# or resid 56 and name HG11 ) ( resid 37 and 
name HB# or resid 56 and name HB ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1082
assign ( resid 37 and name HG# ) ( resid 37 and name HD# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1083
assign ( resid 37 and name HG# ) ( resid 37 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1084
assign ( resid 25 and name HG# ) ( resid 25 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1086
assign ( resid 6 and name HG11 ) ( resid 4 and name HE1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1087
assign ( resid 6 and name HG11 or resid 46 and name HG ) ( resid 6 and name 
HG12 or resid 46 and name HD# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1088
assign ( resid 6 and name HG12 ) ( resid 6 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1090
assign ( resid 38 and name HA ) ( resid 48 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1096
assign ( resid 38 and name HA ) ( resid 38 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1097
assign ( resid 38 and name HA ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1098
assign ( resid 19 and name HG ) ( resid 16 and name HG ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1105
assign ( resid 80 and name HG# or resid 9 and name HG# ) ( resid 80 and name 
HB# or resid 9 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1107
assign ( resid 68 and name HG# ) ( resid 70 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1111
assign ( resid 68 and name HG# ) ( resid 72 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1112
assign ( resid 82 and name HG ) ( resid 82 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1113
assign ( resid 25 and name HG# or resid 85 and name HG# ) ( resid 25 and 
name HD# or resid 85 and name HD# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1114
assign ( resid 6 and name HG11 ) ( resid 6 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1115
assign ( resid 25 and name HG# ) ( resid 25 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1127
assign ( resid 83 and name HA ) ( resid 82 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1135
assign ( resid 83 and name HA ) ( resid 83 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1136
assign ( resid 83 and name HA ) ( resid 83 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1137
assign ( resid 27 and name HA ) ( resid 27 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1146
assign ( resid 27 and name HA ) ( resid 27 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1157
assign ( resid 20 and name HB# ) ( resid 20 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1158
assign ( resid 20 and name HB# ) ( resid 68 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1159
assign ( resid 20 and name HB# ) ( resid 20 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1160
assign ( resid 20 and name HB# ) ( resid 68 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1162
assign ( resid 20 and name HB# ) ( resid 68 and name HB# or resid 37 and 
name HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1163
assign ( resid 16 and name HD# ) ( resid 16 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1178
assign ( resid 16 and name HD# ) ( resid 38 and name HG# or resid 46 and 
name HD# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1179
assign ( resid 17 and name HA ) ( resid 17 and name HB or resid 17 and name 
HG11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1183
assign ( resid 17 and name HA ) ( resid 17 and name HD11 or resid 17 and 
name HG2# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1184
assign ( resid 62 and name HG11 ) ( resid 62 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1187
assign ( resid 31 and name HG11 or resid 62 and name HG11 or resid 31 and 
name HG11 ) ( resid 31 and name HD11 or resid 62 and name HG2# or resid 31 
and name HG2# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1188
assign ( resid 62 and name HG11 ) ( resid 62 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1190
assign ( resid 62 and name HG11 ) ( resid 62 and name HD11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1191
assign ( resid 31 and name HG12 ) ( resid 31 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1193
assign ( resid 31 and name HG12 ) ( resid 31 and name HD11 or resid 31 and 
name HG2# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1194
assign ( resid 31 and name HG12 ) ( resid 31 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1195
assign ( resid 62 and name HG12 ) ( resid 62 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1196
assign ( resid 62 and name HG12 ) ( resid 83 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1197
assign ( resid 62 and name HG12 ) ( resid 62 and name HD11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1198
assign ( resid 62 and name HG12 ) ( resid 62 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1199
assign ( resid 62 and name HG11 ) ( resid 59 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1213
assign ( resid 62 and name HG12 ) ( resid 62 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1214
assign ( resid 16 and name HD# ) ( resid 16 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1224
assign ( resid 46 and name HD# ) ( resid 46 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1235
assign ( resid 34 and name HA ) ( resid 34 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1239
assign ( resid 34 and name HA ) ( resid 34 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1240
assign ( resid 34 and name HA ) ( resid 34 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1241
assign ( resid 46 and name HD# ) ( resid 65 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1243
assign ( resid 46 and name HD# ) ( resid 38 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1245
assign ( resid 46 and name HD# ) ( resid 21 and name HG# or resid 48 and 
name HD11 ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1247
assign ( resid 46 and name HD# ) ( resid 16 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1248
assign ( resid 46 and name HD# ) ( resid 65 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1251
assign ( resid 57 and name HA ) ( resid 57 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1252
assign ( resid 64 and name HA ) ( resid 64 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1253
assign ( resid 64 and name HA ) ( resid 78 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1254
assign ( resid 64 and name HA ) ( resid 64 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1255
assign ( resid 34 and name HA ) ( resid 34 and name HD11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1257
assign ( resid 46 and name HD# ) ( resid 46 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1261
assign ( resid 57 and name HA ) ( resid 57 and name HG21 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1262
assign ( resid 57 and name HA ) ( resid 47 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1263
assign ( resid 46 and name HD# ) ( resid 46 and name HG ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1271
assign ( resid 59 and name HA ) ( resid 59 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1272
assign ( resid 11 and name HA ) ( resid 11 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1275
assign ( resid 11 and name HA ) ( resid 11 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1276
assign ( resid 5 and name HG ) ( resid 5 and name HB# ) 2.60 0.80 0.80 !FROM 
PEAK NUMBER:  1277
assign ( resid 59 and name HA ) ( resid 45 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1279
assign ( resid 59 and name HA ) ( resid 59 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1280
assign ( resid 59 and name HA ) ( resid 59 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1281
assign ( resid 59 and name HA ) ( resid 59 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1287
assign ( resid 91 and name HG# ) ( resid 91 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1297
assign ( resid 91 and name HG# ) ( resid 91 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1298
assign ( resid 91 and name HG# ) ( resid 91 and name HD# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1299
assign ( resid 93 and name HG# ) ( resid 93 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1300
assign ( resid 46 and name HD# or resid 82 and name HD# ) ( resid 60 and 
name HE# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1301
assign ( resid 96 and name HG# ) ( resid 96 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1310
assign ( resid 91 and name HG# ) ( resid 91 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1311
assign ( resid 91 and name HG# or resid 93 and name HG# ) ( resid 91 and 
name HA or resid 93 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1312
assign ( resid 93 and name HG# or resid 91 and name HG# ) ( resid 93 and 
name HE# or resid 91 and name HE# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1313
assign ( resid 93 and name HG# ) ( resid 93 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1315
assign ( resid 82 and name HD# ) ( resid 77 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1317
assign ( resid 46 and name HD# ) ( resid 48 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1319
assign ( resid 46 and name HD# ) ( resid 46 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1322
assign ( resid 46 and name HD# or resid 82 and name HD# ) ( resid 60 and 
name HE# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1323
assign ( resid 46 and name HD# or resid 82 and name HD# ) ( resid 60 and 
name HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1324
assign ( resid 46 and name HD# ) ( resid 41 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1325
assign ( resid 46 and name HD# ) ( resid 41 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1326
assign ( resid 46 and name HD# or resid 82 and name HD# ) ( resid 46 and 
name HG or resid 82 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1327
assign ( resid 46 and name HD# or resid 82 and name HD# ) ( resid 38 and 
name HG# or resid 60 and name HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1329
assign ( resid 46 and name HD# ) ( resid 21 and name HG# or resid 16 and 
name HD# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1332
assign ( resid 96 and name HG# ) ( resid 96 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1354
assign ( resid 82 and name HD# ) ( resid 82 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1357
assign ( resid 46 and name HD# ) ( resid 21 and name HG# or resid 16 and 
name HD# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1358
assign ( resid 46 and name HD# ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1359
assign ( resid 74 and name HD# ) ( resid 68 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1360
assign ( resid 74 and name HD# ) ( resid 74 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1361
assign ( resid 74 and name HD# ) ( resid 66 and name HB# or resid 68 and 
name HD# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1362
assign ( resid 74 and name HD# ) ( resid 68 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1363
assign ( resid 74 and name HD# ) ( resid 74 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1364
assign ( resid 74 and name HD# ) ( resid 74 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1365
assign ( resid 74 and name HD# ) ( resid 74 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1366
assign ( resid 39 and name HA ) ( resid 39 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1375
assign ( resid 39 and name HA ) ( resid 39 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1376
assign ( resid 82 and name HD# ) ( resid 82 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1382
assign ( resid 74 and name HD# ) ( resid 74 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1386
assign ( resid 74 and name HD# ) ( resid 66 and name HB# or resid 68 and 
name HD# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1387
assign ( resid 74 and name HD# ) ( resid 66 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1388
assign ( resid 74 and name HD# ) ( resid 68 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1389
assign ( resid 74 and name HD# ) ( resid 68 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1390
assign ( resid 74 and name HD# ) ( resid 74 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1391
assign ( resid 74 and name HD# ) ( resid 74 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1392
assign ( resid 74 and name HD# ) ( resid 74 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1393
assign ( resid 74 and name HD# ) ( resid 66 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1399
assign ( resid 74 and name HD# ) ( resid 68 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1400
assign ( resid 45 and name HA ) ( resid 59 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1406
assign ( resid 45 and name HA ) ( resid 45 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1407
assign ( resid 45 and name HA ) ( resid 42 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1408
assign ( resid 45 and name HA ) ( resid 45 and name HG21 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1409
assign ( resid 75 and name HA ) ( resid 75 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1410
assign ( resid 82 and name HD# ) ( resid 82 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1412
assign ( resid 31 and name HA ) ( resid 26 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1421
assign ( resid 75 and name HA ) ( resid 75 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1423
assign ( resid 6 and name HA ) ( resid 6 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1425
assign ( resid 6 and name HA ) ( resid 6 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1427
assign ( resid 82 and name HD# ) ( resid 82 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1430
assign ( resid 82 and name HD# ) ( resid 82 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1432
assign ( resid 21 and name HG# ) ( resid 21 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1439
assign ( resid 21 and name HG# ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1440
assign ( resid 21 and name HG# ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1441
assign ( resid 21 and name HG# ) ( resid 65 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1443
assign ( resid 21 and name HG# ) ( resid 65 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1444
assign ( resid 21 and name HG# ) ( resid 65 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1445
assign ( resid 69 and name HA ) ( resid 70 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1451
assign ( resid 6 and name HA ) ( resid 6 and name HB ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  1453
assign ( resid 6 and name HA ) ( resid 6 and name HG2# or resid 6 and name 
HD11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1454
assign ( resid 21 and name HG# ) ( resid 21 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1461
assign ( resid 21 and name HG# ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1462
assign ( resid 69 and name HA ) ( resid 70 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1463
assign ( resid 69 and name HA or resid 31 and name HA ) ( resid 70 and name 
HD# or resid 26 and name HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1464
assign ( resid 69 and name HA or resid 31 and name HA ) ( resid 69 and name 
HG21 or resid 69 and name HG1 or resid 31 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1465
assign ( resid 69 and name HA ) ( resid 19 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1468
assign ( resid 69 and name HA ) ( resid 68 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1469
assign ( resid 43 and name HA ) ( resid 43 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1472
assign ( resid 43 and name HA ) ( resid 43 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1473
assign ( resid 43 and name HA ) ( resid 43 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1475
assign ( resid 69 and name HA ) ( resid 69 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1477
assign ( resid 38 and name HG# ) ( resid 39 and name HA or resid 48 and name 
HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1481
assign ( resid 38 and name HG# ) ( resid 17 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1482
assign ( resid 38 and name HG# ) ( resid 38 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1483
assign ( resid 38 and name HG# ) ( resid 41 and name HG# or resid 47 and 
name HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1484
assign ( resid 38 and name HG# ) ( resid 41 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1485
assign ( resid 38 and name HG# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1487
assign ( resid 38 and name HG# ) ( resid 21 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1488
assign ( resid 38 and name HG# ) ( resid 38 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1496
assign ( resid 63 and name HB1 ) ( resid 65 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1500
assign ( resid 63 and name HB1 ) ( resid 63 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1501
assign ( resid 63 and name HB1 ) ( resid 65 and name HA or resid 26 and name 
HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1502
assign ( resid 63 and name HB1 ) ( resid 23 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1503
assign ( resid 63 and name HB1 ) ( resid 26 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1504
assign ( resid 63 and name HB1 ) ( resid 26 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1505
assign ( resid 63 and name HB1 ) ( resid 32 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1506
assign ( resid 63 and name HB1 ) ( resid 46 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1507
assign ( resid 63 and name HB1 ) ( resid 23 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1508
assign ( resid 63 and name HB1 ) ( resid 23 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1510
assign ( resid 48 and name HA ) ( resid 38 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1528
assign ( resid 38 and name HG# ) ( resid 38 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1543
assign ( resid 38 and name HG# ) ( resid 38 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1544
assign ( resid 38 and name HG# ) ( resid 19 and name HG or resid 21 and name 
HB ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1545
assign ( resid 38 and name HG# ) ( resid 21 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1548
assign ( resid 38 and name HG# ) ( resid 46 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1549
assign ( resid 38 and name HG# ) ( resid 67 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1550
assign ( resid 42 and name HA ) ( resid 42 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1554
assign ( resid 48 and name HA ) ( resid 38 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1557
assign ( resid 48 and name HA ) ( resid 37 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1561
assign ( resid 48 and name HA ) ( resid 38 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1562
assign ( resid 38 and name HG# ) ( resid 37 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1571
assign ( resid 38 and name HG# ) ( resid 37 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1572
assign ( resid 38 and name HG# ) ( resid 41 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1574
assign ( resid 48 and name HA ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1577
assign ( resid 48 and name HA ) ( resid 48 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1581
assign ( resid 48 and name HA ) ( resid 39 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1583
assign ( resid 48 and name HA ) ( resid 48 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1584
assign ( resid 19 and name HD# ) ( resid 19 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1588
assign ( resid 19 and name HD# ) ( resid 16 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1589
assign ( resid 7 and name HA ) ( resid 7 and name HB ) 2.30 0.50 0.50 !FROM 
PEAK NUMBER:  1606
assign ( resid 7 and name HA ) ( resid 6 and name HA ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  1607
assign ( resid 48 and name HA ) ( resid 48 and name HD11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1616
assign ( resid 56 and name HA ) ( resid 56 and name HD11 or resid 56 and 
name HG2# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1619
assign ( resid 80 and name HA ) ( resid 61 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1626
assign ( resid 80 and name HA ) ( resid 80 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1627
assign ( resid 80 and name HA ) ( resid 79 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1628
assign ( resid 19 and name HD# ) ( resid 16 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1633
assign ( resid 19 and name HD# ) ( resid 19 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1636
assign ( resid 19 and name HD# ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1637
assign ( resid 56 and name HA ) ( resid 56 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1662
assign ( resid 56 and name HA or resid 77 and name HA ) ( resid 56 and name 
HG11 or resid 77 and name HG11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1663
assign ( resid 77 and name HA or resid 56 and name HA ) ( resid 77 and name 
HG2# or resid 56 and name HG12 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1664
assign ( resid 56 and name HA or resid 62 and name HA or resid 56 and name 
HA ) ( resid 56 and name HD11 or resid 62 and name HG2# or resid 56 and name 
HG2# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1666
assign ( resid 62 and name HA ) ( resid 62 and name HD11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1667
assign ( resid 62 and name HA ) ( resid 62 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1668
assign ( resid 80 and name HA ) ( resid 83 and name HG# or resid 62 and name 
HG12 ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1669
assign ( resid 83 and name HG# ) ( resid 61 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1670
assign ( resid 83 and name HG# ) ( resid 44 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1671
assign ( resid 83 and name HG# ) ( resid 62 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1672
assign ( resid 77 and name HA ) ( resid 77 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1674
assign ( resid 77 and name HA ) ( resid 77 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1675
assign ( resid 83 and name HG# ) ( resid 85 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1680
assign ( resid 83 and name HG# ) ( resid 83 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1681
assign ( resid 83 and name HG# ) ( resid 83 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1682
assign ( resid 83 and name HG# ) ( resid 80 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1683
assign ( resid 83 and name HG# ) ( resid 62 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1684
assign ( resid 39 and name HG# ) ( resid 47 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1688
assign ( resid 7 and name HA ) ( resid 7 and name HG21 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1689
assign ( resid 39 and name HG# ) ( resid 49 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1697
assign ( resid 39 and name HG# ) ( resid 39 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1698
assign ( resid 39 and name HG# ) ( resid 47 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1699
assign ( resid 39 and name HG# ) ( resid 39 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1700
assign ( resid 39 and name HG# ) ( resid 49 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1701
assign ( resid 39 and name HG# ) ( resid 47 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1702
assign ( resid 19 and name HD# ) ( resid 19 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1707
assign ( resid 19 and name HD# ) ( resid 67 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1709
assign ( resid 19 and name HD# ) ( resid 19 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1710
assign ( resid 19 and name HD# ) ( resid 19 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1711
assign ( resid 19 and name HD# ) ( resid 16 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1712
assign ( resid 19 and name HD# ) ( resid 38 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1713
assign ( resid 19 and name HD# ) ( resid 16 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1716
assign ( resid 20 and name HA ) ( resid 37 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1717
assign ( resid 20 and name HA ) ( resid 20 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1719
assign ( resid 69 and name HG21 ) ( resid 69 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1722
assign ( resid 69 and name HG21 ) ( resid 69 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1723
assign ( resid 69 and name HG21 ) ( resid 70 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1724
assign ( resid 69 and name HG21 ) ( resid 70 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1725
assign ( resid 69 and name HG21 ) ( resid 70 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1733
assign ( resid 39 and name HG# ) ( resid 48 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1735
assign ( resid 19 and name HD# ) ( resid 18 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1736
assign ( resid 19 and name HD# ) ( resid 67 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1737
assign ( resid 19 and name HD# ) ( resid 16 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1739
assign ( resid 16 and name HD# ) ( resid 41 and name HG# or resid 19 and 
name HG ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1741
assign ( resid 20 and name HA ) ( resid 20 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1743
assign ( resid 20 and name HA ) ( resid 37 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1744
assign ( resid 20 and name HA ) ( resid 37 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1745
assign ( resid 29 and name HA ) ( resid 29 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1747
assign ( resid 29 and name HA ) ( resid 29 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1749
assign ( resid 16 and name HD# ) ( resid 67 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1752
assign ( resid 16 and name HD# ) ( resid 67 and name HZ ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1753
assign ( resid 16 and name HD# ) ( resid 16 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1754
assign ( resid 16 and name HD# ) ( resid 16 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1755
assign ( resid 16 and name HD# ) ( resid 16 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1756
assign ( resid 16 and name HD# ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1757
assign ( resid 16 and name HD# ) ( resid 19 and name HD# or resid 46 and 
name HD# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1758
assign ( resid 29 and name HA ) ( resid 29 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1767
assign ( resid 57 and name HG21 ) ( resid 47 and name HG# or resid 48 and 
name HG11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1769
assign ( resid 57 and name HG21 ) ( resid 47 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1773
assign ( resid 57 and name HG21 ) ( resid 47 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1774
assign ( resid 57 and name HG21 ) ( resid 57 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1776
assign ( resid 32 and name HA ) ( resid 32 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1783
assign ( resid 32 and name HA ) ( resid 32 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1784
assign ( resid 32 and name HA ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1785
assign ( resid 57 and name HG21 ) ( resid 57 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1788
assign ( resid 7 and name HG21 ) ( resid 7 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1802
assign ( resid 7 and name HG21 ) ( resid 7 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1803
assign ( resid 7 and name HG21 ) ( resid 5 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1809
assign ( resid 58 and name HG# ) ( resid 34 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1812
assign ( resid 75 and name HG# ) ( resid 65 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1814
assign ( resid 75 and name HG# ) ( resid 75 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1815
assign ( resid 75 and name HG# ) ( resid 75 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1816
assign ( resid 64 and name HG# ) ( resid 64 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1817
assign ( resid 75 and name HG# ) ( resid 77 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1818
assign ( resid 75 and name HG# ) ( resid 77 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1819
assign ( resid 27 and name HG# ) ( resid 62 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1821
assign ( resid 75 and name HG# ) ( resid 77 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1822
assign ( resid 21 and name HA ) ( resid 21 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1824
assign ( resid 21 and name HA ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1825
assign ( resid 83 and name HG# ) ( resid 83 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1842
assign ( resid 45 and name HG21 or resid 83 and name HG# ) ( resid 47 and 
name HB# or resid 43 and name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1843
assign ( resid 45 and name HG21 ) ( resid 46 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1844
assign ( resid 45 and name HG21 ) ( resid 47 and name HG# or resid 46 and 
name HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1845
assign ( resid 83 and name HG# ) ( resid 83 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1847
assign ( resid 83 and name HG# or resid 45 and name HG21 ) ( resid 62 and 
name HG11 or resid 47 and name HG# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1848
assign ( resid 83 and name HG# ) ( resid 84 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1852
assign ( resid 45 and name HG21 ) ( resid 45 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1853
assign ( resid 45 and name HG21 or resid 83 and name HG# ) ( resid 59 and 
name HA or resid 62 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1854
assign ( resid 45 and name HG21 ) ( resid 45 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1855
assign ( resid 58 and name HG# ) ( resid 32 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1860
assign ( resid 21 and name HA ) ( resid 21 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1864
assign ( resid 58 and name HA ) ( resid 59 and name HD# or resid 57 and name 
HB ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1867
assign ( resid 42 and name HG21 ) ( resid 47 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1875
assign ( resid 42 and name HG21 ) ( resid 45 and name HG21 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1876
assign ( resid 58 and name HG# ) ( resid 58 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1877
assign ( resid 58 and name HG# ) ( resid 23 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1883
assign ( resid 58 and name HG# or resid 27 and name HG# ) ( resid 58 and 
name HB or resid 27 and name HB ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1884
assign ( resid 58 and name HG# ) ( resid 34 and name HG11 or resid 23 and 
name HG11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1885
assign ( resid 58 and name HG# or resid 27 and name HG# ) ( resid 34 and 
name HG12 or resid 62 and name HG11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  
1886
assign ( resid 58 and name HG# ) ( resid 63 and name HB1 or resid 48 and 
name HD11 ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1890
assign ( resid 27 and name HG# ) ( resid 27 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1893
assign ( resid 75 and name HG# ) ( resid 67 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1896
assign ( resid 75 and name HG# ) ( resid 65 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1897
assign ( resid 75 and name HG# ) ( resid 76 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1898
assign ( resid 64 and name HG# ) ( resid 78 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1899
assign ( resid 64 and name HG# ) ( resid 64 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1900
assign ( resid 75 and name HG# or resid 64 and name HG# ) ( resid 67 and 
name HB# or resid 78 and name HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1901
assign ( resid 75 and name HG# or resid 64 and name HG# ) ( resid 67 and 
name HB# or resid 78 and name HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1902
assign ( resid 64 and name HG# ) ( resid 64 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1903
assign ( resid 64 and name HG# ) ( resid 25 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1904
assign ( resid 64 and name HG# ) ( resid 24 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1906
assign ( resid 58 and name HA ) ( resid 58 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1908
assign ( resid 65 and name HA ) ( resid 24 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1909
assign ( resid 58 and name HA ) ( resid 58 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1913
assign ( resid 58 and name HA or resid 65 and name HA ) ( resid 57 and name 
HG21 or resid 22 and name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1915
assign ( resid 87 and name HA ) ( resid 86 and name HA or resid 88 and name 
HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1916
assign ( resid 87 and name HA ) ( resid 87 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1918
assign ( resid 87 and name HA ) ( resid 87 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1919
assign ( resid 42 and name HG21 ) ( resid 42 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1925
assign ( resid 42 and name HG21 ) ( resid 42 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1926
assign ( resid 42 and name HG21 ) ( resid 40 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1927
assign ( resid 42 and name HG21 ) ( resid 47 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1928
assign ( resid 42 and name HG21 ) ( resid 47 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1929
assign ( resid 58 and name HG# ) ( resid 65 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1932
assign ( resid 64 and name HG# or resid 58 and name HG# ) ( resid 23 and 
name HG2# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1934
assign ( resid 64 and name HG# ) ( resid 63 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1935
assign ( resid 27 and name HG# ) ( resid 62 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1936
assign ( resid 64 and name HG# ) ( resid 64 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1937
assign ( resid 64 and name HG# ) ( resid 25 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1938
assign ( resid 64 and name HG# ) ( resid 64 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1939
assign ( resid 58 and name HG# or resid 64 and name HG# ) ( resid 46 and 
name HG or resid 25 and name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1940
assign ( resid 27 and name HG# ) ( resid 62 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1941
assign ( resid 64 and name HG# ) ( resid 24 and name HB1 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1942
assign ( resid 75 and name HG# ) ( resid 67 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1943
assign ( resid 75 and name HG# ) ( resid 75 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1944
assign ( resid 75 and name HG# ) ( resid 75 and name HB or resid 77 and name 
HB ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1945
assign ( resid 75 and name HG# ) ( resid 77 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1946
assign ( resid 65 and name HA ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1953
assign ( resid 26 and name HA ) ( resid 26 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1954
assign ( resid 64 and name HG# ) ( resid 25 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1956
assign ( resid 26 and name HA or resid 65 and name HA ) ( resid 63 and name 
HB1 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1959
assign ( resid 58 and name HA ) ( resid 58 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1960
assign ( resid 65 and name HA ) ( resid 65 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1961
assign ( resid 65 and name HA ) ( resid 65 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1962
assign ( resid 65 and name HA ) ( resid 23 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1963
assign ( resid 65 and name HA ) ( resid 65 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1964
assign ( resid 65 and name HA ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1965
assign ( resid 65 and name HA ) ( resid 65 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1966
assign ( resid 94 and name HA ) ( resid 96 and name HE# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1970
assign ( resid 94 and name HA ) ( resid 94 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1971
assign ( resid 26 and name HA ) ( resid 26 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1978
assign ( resid 26 and name HA ) ( resid 63 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1980
assign ( resid 87 and name HA ) ( resid 87 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1984
assign ( resid 51 and name HA ) ( resid 51 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1986
assign ( resid 51 and name HA ) ( resid 52 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1987
assign ( resid 87 and name HA ) ( resid 90 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1991
assign ( resid 67 and name HA ) ( resid 67 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1995
assign ( resid 67 and name HA ) ( resid 67 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1996
assign ( resid 88 and name HA ) ( resid 88 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1998
assign ( resid 88 and name HA ) ( resid 88 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1999
assign ( resid 88 and name HA ) ( resid 85 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2001
assign ( resid 27 and name HG# ) ( resid 27 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2007
assign ( resid 27 and name HG# ) ( resid 62 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2008
assign ( resid 27 and name HG# ) ( resid 62 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2009
assign ( resid 27 and name HG# ) ( resid 27 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2014
assign ( resid 54 and name HA or resid 91 and name HA ) ( resid 54 and name 
HG# or resid 91 and name HD# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2017
assign ( resid 27 and name HG# ) ( resid 62 and name HD11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2021
assign ( resid 21 and name HG# ) ( resid 21 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2024
assign ( resid 21 and name HG# ) ( resid 20 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2025
assign ( resid 21 and name HG# ) ( resid 38 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2026
assign ( resid 21 and name HG# ) ( resid 21 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2027
assign ( resid 21 and name HG# ) ( resid 23 and name HG11 or resid 48 and 
name HG11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2028
assign ( resid 21 and name HG# ) ( resid 38 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2029
assign ( resid 21 and name HG# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2030
assign ( resid 21 and name HG# ) ( resid 48 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2032
assign ( resid 71 and name HA ) ( resid 71 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2038
assign ( resid 71 and name HA ) ( resid 71 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2039
assign ( resid 71 and name HA ) ( resid 71 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2040
assign ( resid 50 and name HA ) ( resid 36 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2049
assign ( resid 50 and name HA ) ( resid 36 and name HA# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2054
assign ( resid 50 and name HA ) ( resid 50 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2055
assign ( resid 50 and name HA ) ( resid 50 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2056
assign ( resid 93 and name HA or resid 92 and name HA ) ( resid 93 and name 
HB# or resid 92 and name HB# or resid 91 and name HB# ) 2.30 0.50 0.50 !FROM 
PEAK NUMBER:  2064
assign ( resid 93 and name HA ) ( resid 93 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2065
assign ( resid 9 and name HA ) ( resid 9 and name HB# ) 2.30 0.50 0.50 !FROM 
PEAK NUMBER:  2074
assign ( resid 9 and name HA ) ( resid 9 and name HB# or resid 9 and name 
HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2075
assign ( resid 9 and name HA ) ( resid 9 and name HD# ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  2076
assign ( resid 91 and name HA or resid 92 and name HA or resid 93 and name 
HA ) ( resid 91 and name HB# or resid 92 and name HB# or resid 93 and name 
HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2079
assign ( resid 84 and name HB1 ) ( resid 84 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2083
assign ( resid 84 and name HB1 ) ( resid 85 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2084
assign ( resid 84 and name HB1 ) ( resid 83 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2092
assign ( resid 84 and name HB1 ) ( resid 83 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2093
assign ( resid 35 and name HA ) ( resid 22 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2095
assign ( resid 35 and name HA ) ( resid 22 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2097
assign ( resid 35 and name HA ) ( resid 35 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2098
assign ( resid 35 and name HA ) ( resid 35 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2099
assign ( resid 41 and name HA ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2105
assign ( resid 91 and name HA ) ( resid 91 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2106
assign ( resid 39 and name HG# ) ( resid 39 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2115
assign ( resid 39 and name HG# ) ( resid 47 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2116
assign ( resid 39 and name HG# ) ( resid 40 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2117
assign ( resid 39 and name HG# ) ( resid 39 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2118
assign ( resid 39 and name HG# ) ( resid 49 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2119
assign ( resid 39 and name HG# ) ( resid 47 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2120
assign ( resid 39 and name HG# ) ( resid 47 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2121
assign ( resid 39 and name HG# ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2126
assign ( resid 30 and name HA ) ( resid 30 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2133
assign ( resid 30 and name HA ) ( resid 30 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2134
assign ( resid 95 and name HA ) ( resid 94 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2135
assign ( resid 41 and name HA or resid 95 and name HA or resid 73 and name 
HA ) ( resid 41 and name HG# or resid 95 and name HG# or resid 73 and name 
HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2136
assign ( resid 73 and name HA or resid 95 and name HA ) ( resid 73 and name 
HB# or resid 95 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2137
assign ( resid 39 and name HG# ) ( resid 47 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2144
assign ( resid 23 and name HG2# ) ( resid 26 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2145
assign ( resid 95 and name HA ) ( resid 94 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2151
assign ( resid 95 and name HA ) ( resid 94 and name HA or resid 96 and name 
HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2152
assign ( resid 23 and name HG2# ) ( resid 34 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2156
assign ( resid 23 and name HG2# ) ( resid 65 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2157
assign ( resid 23 and name HG2# ) ( resid 23 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2158
assign ( resid 23 and name HG2# ) ( resid 33 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2160
assign ( resid 23 and name HG2# ) ( resid 23 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2161
assign ( resid 23 and name HG2# ) ( resid 32 and name HB# or resid 58 and 
name HB ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2162
assign ( resid 23 and name HG2# ) ( resid 23 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2163
assign ( resid 23 and name HG2# ) ( resid 23 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2165
assign ( resid 23 and name HG2# ) ( resid 23 and name HD11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2166
assign ( resid 23 and name HG2# ) ( resid 63 and name HB1 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2167
assign ( resid 41 and name HA ) ( resid 47 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2174
assign ( resid 41 and name HA ) ( resid 41 and name HB# or resid 46 and name 
HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2175
assign ( resid 81 and name HB1 ) ( resid 81 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2178
assign ( resid 81 and name HB1 ) ( resid 77 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2184
assign ( resid 81 and name HB1 ) ( resid 82 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2185
assign ( resid 81 and name HB1 ) ( resid 78 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2187
assign ( resid 4 and name HA ) ( resid 4 and name HB# ) 2.60 0.80 0.80 !FROM 
PEAK NUMBER:  2197
assign ( resid 47 and name HA ) ( resid 47 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2199
assign ( resid 47 and name HA ) ( resid 57 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2201
assign ( resid 47 and name HA ) ( resid 57 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2202
assign ( resid 47 and name HA ) ( resid 47 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2203
assign ( resid 49 and name HA ) ( resid 49 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2204
assign ( resid 47 and name HA ) ( resid 47 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2207
assign ( resid 49 and name HA ) ( resid 49 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2209
assign ( resid 25 and name HA or resid 19 and name HA ) ( resid 26 and name 
HA or resid 69 and name HB ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2211
assign ( resid 19 and name HA ) ( resid 19 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2213
assign ( resid 19 and name HA ) ( resid 19 and name HG ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2214
assign ( resid 19 and name HA ) ( resid 19 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2215
assign ( resid 19 and name HA ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2216
assign ( resid 5 and name HA or resid 85 and name HA ) ( resid 5 and name 
HB# or resid 85 and name HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2220
assign ( resid 5 and name HA ) ( resid 5 and name HG ) 2.30 0.50 0.50 !FROM 
PEAK NUMBER:  2221
assign ( resid 16 and name HA ) ( resid 16 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2222
assign ( resid 16 and name HA ) ( resid 19 and name HG ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2224
assign ( resid 16 and name HA ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2225
assign ( resid 62 and name HG2# ) ( resid 62 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2228
assign ( resid 76 and name HA ) ( resid 66 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2229
assign ( resid 49 and name HA ) ( resid 55 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2231
assign ( resid 78 and name HA ) ( resid 78 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2234
assign ( resid 78 and name HA ) ( resid 64 and name HB or resid 81 and name 
HB1 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2235
assign ( resid 78 and name HA ) ( resid 64 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2236
assign ( resid 85 and name HA ) ( resid 86 and name HD# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2237
assign ( resid 16 and name HA ) ( resid 21 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2239
assign ( resid 16 and name HA ) ( resid 16 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2240
assign ( resid 16 and name HA ) ( resid 16 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2241
assign ( resid 16 and name HA ) ( resid 16 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2242
assign ( resid 62 and name HG2# ) ( resid 62 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2245
assign ( resid 76 and name HA ) ( resid 65 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2246
assign ( resid 76 and name HA ) ( resid 76 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2247
assign ( resid 76 and name HA ) ( resid 76 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2248
assign ( resid 50 and name HE1 ) ( resid 50 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2254
assign ( resid 50 and name HE1 ) ( resid 50 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2259
assign ( resid 50 and name HE1 ) ( resid 56 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2264
assign ( resid 17 and name HG2# ) ( resid 18 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2269
assign ( resid 62 and name HG2# ) ( resid 62 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2270
assign ( resid 6 and name HG2# ) ( resid 6 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2272
assign ( resid 6 and name HG2# ) ( resid 4 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2273
assign ( resid 24 and name HB1 ) ( resid 24 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2277
assign ( resid 24 and name HB1 ) ( resid 25 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2278
assign ( resid 24 and name HB1 ) ( resid 64 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2279
assign ( resid 24 and name HB1 ) ( resid 25 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2280
assign ( resid 24 and name HB1 ) ( resid 64 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2281
assign ( resid 55 and name HA ) ( resid 49 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2285
assign ( resid 55 and name HA ) ( resid 55 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2286
assign ( resid 55 and name HA ) ( resid 55 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2287
assign ( resid 25 and name HA ) ( resid 32 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2290
assign ( resid 25 and name HA ) ( resid 25 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2291
assign ( resid 25 and name HA ) ( resid 25 and name HB# or resid 25 and name 
HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2292
assign ( resid 50 and name HE1 ) ( resid 55 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2296
assign ( resid 50 and name HE1 ) ( resid 53 and name HA# or resid 36 and 
name HA# or resid 54 and name HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2297
assign ( resid 50 and name HE1 ) ( resid 53 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2298
assign ( resid 50 and name HE1 ) ( resid 54 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2299
assign ( resid 50 and name HE1 ) ( resid 50 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2302
assign ( resid 50 and name HE1 ) ( resid 48 and name HB or resid 54 and name 
HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2304
assign ( resid 50 and name HE1 ) ( resid 56 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2308
assign ( resid 50 and name HE1 ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2309
assign ( resid 17 and name HG2# ) ( resid 17 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2316
assign ( resid 17 and name HG2# ) ( resid 17 and name HB or resid 17 and 
name HG11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2317
assign ( resid 34 and name HD11 ) ( resid 23 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2319
assign ( resid 34 and name HD11 or resid 62 and name HG2# or resid 31 and 
name HG2# ) ( resid 34 and name HG12 or resid 62 and name HG11 or resid 31 
and name HG11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2320
assign ( resid 31 and name HG2# ) ( resid 31 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2321
assign ( resid 62 and name HG2# ) ( resid 62 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2322
assign ( resid 34 and name HD11 ) ( resid 34 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2324
assign ( resid 62 and name HG2# ) ( resid 80 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2326
assign ( resid 90 and name HG2# ) ( resid 90 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2327
assign ( resid 90 and name HG2# ) ( resid 91 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2328
assign ( resid 6 and name HG2# ) ( resid 6 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2329
assign ( resid 6 and name HG2# ) ( resid 6 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2332
assign ( resid 6 and name HG2# ) ( resid 6 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2334
assign ( resid 55 and name HA ) ( resid 55 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2340
assign ( resid 28 and name HA ) ( resid 29 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2343
assign ( resid 28 and name HA ) ( resid 28 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2344
assign ( resid 34 and name HD11 ) ( resid 34 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2350
assign ( resid 34 and name HD11 ) ( resid 23 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2351
assign ( resid 34 and name HD11 ) ( resid 33 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2352
assign ( resid 31 and name HG2# ) ( resid 31 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2354
assign ( resid 34 and name HD11 or resid 62 and name HG2# or resid 31 and 
name HG2# ) ( resid 34 and name HG12 or resid 62 and name HG11 or resid 31 
and name HG11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2355
assign ( resid 62 and name HG2# ) ( resid 83 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2356
assign ( resid 74 and name HA ) ( resid 68 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2358
assign ( resid 74 and name HA ) ( resid 74 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2360
assign ( resid 74 and name HA ) ( resid 74 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2361
assign ( resid 96 and name HA ) ( resid 96 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2367
assign ( resid 77 and name HG2# ) ( resid 65 and name HE# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2372
assign ( resid 77 and name HG2# ) ( resid 77 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2374
assign ( resid 77 and name HG2# ) ( resid 77 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2375
assign ( resid 77 and name HG2# ) ( resid 77 and name HD11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2376
assign ( resid 77 and name HG2# ) ( resid 77 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2378
assign ( resid 77 and name HG2# ) ( resid 78 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2379
assign ( resid 77 and name HG2# ) ( resid 77 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2380
assign ( resid 77 and name HG2# ) ( resid 82 and name HD# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2382
assign ( resid 34 and name HD11 or resid 90 and name HG2# ) ( resid 34 and 
name HA or resid 90 and name HA ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2383
assign ( resid 74 and name HA ) ( resid 74 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2384
assign ( resid 46 and name HA ) ( resid 46 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2386
assign ( resid 46 and name HA ) ( resid 46 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2387
assign ( resid 46 and name HA ) ( resid 46 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2388
assign ( resid 96 and name HA ) ( resid 96 and name HB# or resid 96 and name 
HG# or resid 96 and name HD# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2391
assign ( resid 81 and name HA ) ( resid 80 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2392
assign ( resid 24 and name HA ) ( resid 24 and name HB1 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2394
assign ( resid 37 and name HA ) ( resid 37 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2397
assign ( resid 40 and name HA ) ( resid 40 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2398
assign ( resid 82 and name HA ) ( resid 82 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2399
assign ( resid 82 and name HA ) ( resid 82 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2400
assign ( resid 81 and name HA ) ( resid 80 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2401
assign ( resid 4 and name HE1 ) ( resid 5 and name HA ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  2407
assign ( resid 4 and name HE1 ) ( resid 4 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2417
assign ( resid 4 and name HE1 ) ( resid 4 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2421
assign ( resid 4 and name HE1 ) ( resid 5 and name HG ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  2429
assign ( resid 4 and name HE1 ) ( resid 6 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2430
assign ( resid 4 and name HE1 ) ( resid 6 and name HD11 or resid 6 and name 
HG2# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2431
assign ( resid 56 and name HG2# ) ( resid 50 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2434
assign ( resid 37 and name HA ) ( resid 20 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2438
assign ( resid 37 and name HA ) ( resid 37 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2439
assign ( resid 37 and name HA ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2440
assign ( resid 22 and name HA ) ( resid 35 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2442
assign ( resid 22 and name HA ) ( resid 35 and name HB# or resid 23 and name 
HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2443
assign ( resid 22 and name HA ) ( resid 35 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2444
assign ( resid 22 and name HA ) ( resid 22 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2445
assign ( resid 44 and name HA ) ( resid 62 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2447
assign ( resid 40 and name HA ) ( resid 40 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2449
assign ( resid 40 and name HA ) ( resid 47 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2450
assign ( resid 40 and name HA ) ( resid 17 and name HD11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2451
assign ( resid 96 and name HA ) ( resid 95 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2452
assign ( resid 56 and name HG2# ) ( resid 56 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2456
assign ( resid 56 and name HG2# ) ( resid 56 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2457
assign ( resid 56 and name HG2# ) ( resid 34 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2458
assign ( resid 11 and name HG2# ) ( resid 11 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2461
assign ( resid 11 and name HG2# ) ( resid 11 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2462
assign ( resid 11 and name HG2# ) ( resid 11 and name HD11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2463
assign ( resid 68 and name HA ) ( resid 68 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2468
assign ( resid 56 and name HG2# ) ( resid 56 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2472
assign ( resid 56 and name HG2# ) ( resid 50 and name HE1 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2474
assign ( resid 56 and name HG2# ) ( resid 56 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2475
assign ( resid 56 and name HG2# ) ( resid 48 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2480
assign ( resid 68 and name HA ) ( resid 74 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2483
assign ( resid 68 and name HA ) ( resid 68 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2484
assign ( resid 68 and name HA ) ( resid 68 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2485
assign ( resid 68 and name HA ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2486
assign ( resid 44 and name HA ) ( resid 44 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2489
assign ( resid 44 and name HA ) ( resid 83 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2490
assign ( resid 44 and name HA ) ( resid 83 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2491
assign ( resid 81 and name HA ) ( resid 81 and name HB1 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2495
assign ( resid 66 and name HA ) ( resid 76 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2499
assign ( resid 66 and name HA ) ( resid 66 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2500
assign ( resid 66 and name HA ) ( resid 65 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2501
assign ( resid 52 and name HA ) ( resid 51 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2503
assign ( resid 52 and name HA ) ( resid 52 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2504
assign ( resid 52 and name HA ) ( resid 52 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2505
assign ( resid 66 and name HA ) ( resid 65 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2508
assign ( resid 66 and name HA ) ( resid 66 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2509
assign ( resid 10 and name HA ) ( resid 10 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2511
assign ( resid 48 and name HG2# ) ( resid 48 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2517
assign ( resid 48 and name HG2# ) ( resid 36 and name HA# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2518
assign ( resid 48 and name HG2# ) ( resid 46 and name HD# or resid 56 and 
name HG2# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2519
assign ( resid 48 and name HG2# ) ( resid 48 and name HD11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2520
assign ( resid 48 and name HG2# ) ( resid 46 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2522
assign ( resid 10 and name HA ) ( resid 10 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2524
assign ( resid 48 and name HG2# ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2526
assign ( resid 48 and name HG2# ) ( resid 38 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2527
assign ( resid 48 and name HG2# ) ( resid 50 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2528
assign ( resid 48 and name HG2# ) ( resid 48 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2529
assign ( resid 84 and name HA ) ( resid 83 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2540
assign ( resid 84 and name HA ) ( resid 85 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2543
assign ( resid 84 and name HA ) ( resid 84 and name HB1 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2544
assign ( resid 62 and name HD11 ) ( resid 62 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2555
assign ( resid 62 and name HD11 ) ( resid 62 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2559
assign ( resid 62 and name HD11 ) ( resid 62 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2560
assign ( resid 62 and name HD11 ) ( resid 62 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2561
assign ( resid 62 and name HD11 ) ( resid 26 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2568
assign ( resid 62 and name HD11 ) ( resid 59 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2570
assign ( resid 62 and name HD11 ) ( resid 62 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2572
assign ( resid 59 and name HD# ) ( resid 59 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2578
assign ( resid 59 and name HD# ) ( resid 58 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2580
assign ( resid 59 and name HD# ) ( resid 58 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2588
assign ( resid 59 and name HD# ) ( resid 59 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2589
assign ( resid 48 and name HD11 ) ( resid 34 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2594
assign ( resid 48 and name HD11 ) ( resid 48 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2595
assign ( resid 48 and name HD11 ) ( resid 58 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2596
assign ( resid 48 and name HD11 ) ( resid 46 and name HD# or resid 56 and 
name HG2# or resid 23 and name HD11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  
2598
assign ( resid 59 and name HD# ) ( resid 59 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2603
assign ( resid 59 and name HD# ) ( resid 59 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2604
assign ( resid 59 and name HD# ) ( resid 58 and name HA or resid 26 and name 
HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2606
assign ( resid 59 and name HD# ) ( resid 59 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2609
assign ( resid 48 and name HD11 ) ( resid 38 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2612
assign ( resid 48 and name HD11 ) ( resid 46 and name HD# or resid 21 and 
name HG# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2614
assign ( resid 48 and name HD11 ) ( resid 48 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2615
assign ( resid 48 and name HD11 ) ( resid 34 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2616
assign ( resid 48 and name HD11 ) ( resid 48 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2618
assign ( resid 59 and name HD# ) ( resid 59 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2620
assign ( resid 70 and name HD# ) ( resid 69 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2621
assign ( resid 23 and name HD11 ) ( resid 65 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2632
assign ( resid 56 and name HD11 ) ( resid 56 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2633
assign ( resid 56 and name HD11 or resid 11 and name HD11 ) ( resid 56 and 
name HB or resid 11 and name HB ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2634
assign ( resid 70 and name HD# ) ( resid 69 and name HG1 or resid 69 and 
name HG21 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2638
assign ( resid 31 and name HD11 ) ( resid 31 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2654
assign ( resid 11 and name HD11 or resid 31 and name HD11 ) ( resid 11 and 
name HG11 or resid 31 and name HG12 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  
2655
assign ( resid 56 and name HD11 ) ( resid 56 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2656
assign ( resid 31 and name HD11 ) ( resid 32 and name HA or resid 33 and 
name HA# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2658
assign ( resid 31 and name HD11 ) ( resid 31 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2659
assign ( resid 23 and name HD11 ) ( resid 63 and name HB1 or resid 48 and 
name HD11 ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2661
assign ( resid 90 and name HD11 or resid 11 and name HD11 ) ( resid 90 and 
name HA or resid 11 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2662
assign ( resid 23 and name HD11 ) ( resid 34 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2663
assign ( resid 23 and name HD11 or resid 56 and name HD11 ) ( resid 23 and 
name HG11 or resid 56 and name HG11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  
2664
assign ( resid 63 and name HA ) ( resid 26 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2668
assign ( resid 63 and name HA ) ( resid 63 and name HB1 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2670
assign ( resid 11 and name HD11 ) ( resid 11 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2673
assign ( resid 23 and name HD11 ) ( resid 23 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2675
assign ( resid 23 and name HD11 ) ( resid 23 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2676
assign ( resid 23 and name HD11 ) ( resid 23 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2677
assign ( resid 77 and name HD11 ) ( resid 77 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2679
assign ( resid 70 and name HD# ) ( resid 69 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2682
assign ( resid 70 and name HD# or resid 86 and name HD# ) ( resid 70 and 
name HG# or resid 86 and name HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2685
assign ( resid 70 and name HD# ) ( resid 69 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2686
assign ( resid 77 and name HD11 ) ( resid 65 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2695
assign ( resid 77 and name HD11 ) ( resid 67 and name HZ ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2696
assign ( resid 77 and name HD11 ) ( resid 77 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2697
assign ( resid 77 and name HD11 ) ( resid 76 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2698
assign ( resid 77 and name HD11 ) ( resid 77 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2699
assign ( resid 77 and name HD11 ) ( resid 77 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2700
assign ( resid 77 and name HD11 ) ( resid 77 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2703
assign ( resid 77 and name HD11 ) ( resid 75 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2705
assign ( resid 86 and name HD# ) ( resid 86 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2711
assign ( resid 86 and name HD# ) ( resid 86 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2712
assign ( resid 86 and name HD# ) ( resid 80 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2713
assign ( resid 86 and name HD# ) ( resid 86 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2714
assign ( resid 70 and name HD# ) ( resid 19 and name HG ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2715
assign ( resid 90 and name HD11 ) ( resid 90 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2719
assign ( resid 90 and name HD11 or resid 23 and name HD11 ) ( resid 90 and 
name HG11 or resid 23 and name HG11 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  
2720
assign ( resid 77 and name HD11 ) ( resid 75 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2722
assign ( resid 90 and name HD11 ) ( resid 90 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2726
assign ( resid 90 and name HD11 ) ( resid 90 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2731
assign ( resid 6 and name HD11 ) ( resid 6 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2733
assign ( resid 6 and name HD11 or resid 90 and name HD11 ) ( resid 6 and 
name HG12 or resid 90 and name HG2# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  
2744
assign ( resid 6 and name HD11 ) ( resid 6 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2746
assign ( resid 6 and name HD11 ) ( resid 6 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2747
assign ( resid 17 and name HD11 ) ( resid 17 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  2751
assign ( resid 17 and name HD11 ) ( resid 40 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  2752
assign ( resid 17 and name HD11 ) ( resid 17 and name HG11 or resid 17 and 
name HB ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  2755
assign ( resid 17 and name HD11 ) ( resid 16 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2756
assign ( resid 17 and name HD11 ) ( resid 16 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2757
assign ( resid 79 and name HA# ) ( resid 82 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2796
assign ( resid 46 and name HB# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2809
assign ( resid 46 and name HB# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2810
assign ( resid 46 and name HB# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2811
assign ( resid 46 and name HB# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2812
assign ( resid 36 and name HA# ) ( resid 50 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2813
assign ( resid 36 and name HA# ) ( resid 50 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2814
assign ( resid 18 and name HA# ) ( resid 37 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2815
assign ( resid 40 and name HB# ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2816
assign ( resid 40 and name HB# ) ( resid 40 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2817
assign ( resid 40 and name HB# ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2818
assign ( resid 40 and name HB# ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2819
assign ( resid 65 and name HB# ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2821
assign ( resid 65 and name HB# ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2822
assign ( resid 65 and name HB# ) ( resid 65 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2823
assign ( resid 33 and name HA# ) ( resid 32 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2826
assign ( resid 47 and name HD# ) ( resid 57 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2831
assign ( resid 47 and name HD# or resid 25 and name HD# or resid 68 and name 
HD# ) ( resid 47 and name HB# or resid 25 and name HB# or resid 68 and name 
HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  2832
assign ( resid 47 and name HD# ) ( resid 47 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2833
assign ( resid 47 and name HD# ) ( resid 47 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2834
assign ( resid 82 and name HB# ) ( resid 83 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2839
assign ( resid 82 and name HB# ) ( resid 82 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2840
assign ( resid 56 and name HB ) ( resid 50 and name HE1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2843
assign ( resid 48 and name HB ) ( resid 34 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2844
assign ( resid 48 and name HB ) ( resid 50 and name HE1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2845
assign ( resid 77 and name HB ) ( resid 75 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2851
assign ( resid 19 and name HB# ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2852
assign ( resid 77 and name HB ) ( resid 77 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2855
assign ( resid 77 and name HB ) ( resid 77 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2856
assign ( resid 48 and name HB ) ( resid 48 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2857
assign ( resid 78 and name HB# ) ( resid 81 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2859
assign ( resid 67 and name HB# ) ( resid 75 and name HG# or resid 19 and 
name HD# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2861
assign ( resid 67 and name HB# ) ( resid 75 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2862
assign ( resid 67 and name HB# ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2863
assign ( resid 60 and name HE# ) ( resid 60 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2864
assign ( resid 51 and name HB# ) ( resid 52 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2865
assign ( resid 62 and name HB ) ( resid 62 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2868
assign ( resid 62 and name HB ) ( resid 62 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2869
assign ( resid 6 and name HB ) ( resid 6 and name HA ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  2871
assign ( resid 31 and name HB ) ( resid 31 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2872
assign ( resid 73 and name HG# ) ( resid 69 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2873
assign ( resid 21 and name HB ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2876
assign ( resid 21 and name HB ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2878
assign ( resid 58 and name HB ) ( resid 34 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2879
assign ( resid 75 and name HB ) ( resid 67 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2881
assign ( resid 22 and name HB# ) ( resid 66 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2882
assign ( resid 22 and name HB# ) ( resid 66 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2883
assign ( resid 32 and name HG# ) ( resid 26 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2884
assign ( resid 23 and name HB ) ( resid 33 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2885
assign ( resid 23 and name HB ) ( resid 23 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2886
assign ( resid 23 and name HB ) ( resid 23 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2887
assign ( resid 64 and name HB or resid 37 and name HB# ) ( resid 63 and name 
HA or resid 20 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  2891
assign ( resid 47 and name HB# ) ( resid 57 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2894
assign ( resid 64 and name HB ) ( resid 24 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2895
assign ( resid 55 and name HB# ) ( resid 49 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2898
assign ( resid 76 and name HB# ) ( resid 76 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2899
assign ( resid 49 and name HB# ) ( resid 49 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2900
assign ( resid 49 and name HB# ) ( resid 49 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2901
assign ( resid 4 and name HB# ) ( resid 4 and name HA ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  2904
assign ( resid 4 and name HB# ) ( resid 4 and name HA ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  2905
assign ( resid 4 and name HB# ) ( resid 6 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2906
assign ( resid 47 and name HB# ) ( resid 47 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2907
assign ( resid 55 and name HB# ) ( resid 49 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2908
assign ( resid 47 and name HB# ) ( resid 47 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2911
assign ( resid 47 and name HB# ) ( resid 47 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2912
assign ( resid 47 and name HB# ) ( resid 40 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2913
assign ( resid 47 and name HB# ) ( resid 40 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2914
assign ( resid 57 and name HB ) ( resid 59 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2917
assign ( resid 59 and name HB# ) ( resid 62 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2918
assign ( resid 59 and name HB# ) ( resid 62 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2919
assign ( resid 54 and name HB# ) ( resid 54 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2922
assign ( resid 35 and name HB# ) ( resid 22 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2934
assign ( resid 35 and name HB# ) ( resid 22 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2935
assign ( resid 17 and name HG11 ) ( resid 40 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2946
assign ( resid 59 and name HG# ) ( resid 58 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2951
assign ( resid 59 and name HG# ) ( resid 59 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2952
assign ( resid 90 and name HG11 ) ( resid 88 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2957
assign ( resid 70 and name HA ) ( resid 69 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2958
assign ( resid 26 and name HB# ) ( resid 63 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2959
assign ( resid 26 and name HB# ) ( resid 63 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2961
assign ( resid 26 and name HB# ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2962
assign ( resid 59 and name HG# ) ( resid 27 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2965
assign ( resid 77 and name HG12 ) ( resid 77 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2967
assign ( resid 47 and name HG# ) ( resid 57 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2968
assign ( resid 11 and name HG11 ) ( resid 11 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2969
assign ( resid 74 and name HG ) ( resid 74 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2970
assign ( resid 23 and name HG12 ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2972
assign ( resid 38 and name HA ) ( resid 38 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2974
assign ( resid 37 and name HG# ) ( resid 20 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2977
assign ( resid 86 and name HA ) ( resid 86 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2978
assign ( resid 25 and name HG# ) ( resid 24 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2980
assign ( resid 6 and name HG12 ) ( resid 6 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2981
assign ( resid 38 and name HA ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2985
assign ( resid 20 and name HB# ) ( resid 37 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2986
assign ( resid 20 and name HB# ) ( resid 37 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2987
assign ( resid 62 and name HG12 ) ( resid 59 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2991
assign ( resid 62 and name HG12 ) ( resid 62 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2993
assign ( resid 46 and name HD# ) ( resid 46 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2995
assign ( resid 46 and name HD# ) ( resid 16 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2997
assign ( resid 46 and name HD# ) ( resid 65 and name HZ ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2998
assign ( resid 57 and name HA ) ( resid 47 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  2999
assign ( resid 57 and name HA ) ( resid 58 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3000
assign ( resid 46 and name HD# ) ( resid 21 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3002
assign ( resid 59 and name HA ) ( resid 59 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3003
assign ( resid 39 and name HA ) ( resid 47 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3004
assign ( resid 90 and name HA ) ( resid 91 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3006
assign ( resid 46 and name HD# ) ( resid 38 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3007
assign ( resid 82 and name HD# ) ( resid 65 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3008
assign ( resid 74 and name HD# ) ( resid 66 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3009
assign ( resid 46 and name HD# ) ( resid 16 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3011
assign ( resid 74 and name HD# ) ( resid 76 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3012
assign ( resid 45 and name HA ) ( resid 59 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3015
assign ( resid 45 and name HA ) ( resid 46 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3016
assign ( resid 45 and name HA ) ( resid 59 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3017
assign ( resid 38 and name HG# ) ( resid 16 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3018
assign ( resid 43 and name HA ) ( resid 42 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3019
assign ( resid 82 and name HD# ) ( resid 82 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3021
assign ( resid 21 and name HG# ) ( resid 16 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3022
assign ( resid 43 and name HA ) ( resid 43 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3024
assign ( resid 38 and name HG# ) ( resid 17 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3026
assign ( resid 63 and name HB1 ) ( resid 65 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3027
assign ( resid 63 and name HB1 ) ( resid 64 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3028
assign ( resid 38 and name HG# ) ( resid 48 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3032
assign ( resid 38 and name HG# ) ( resid 67 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3034
assign ( resid 80 and name HA ) ( resid 80 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3035
assign ( resid 19 and name HD# ) ( resid 16 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3038
assign ( resid 77 and name HA ) ( resid 76 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3041
assign ( resid 56 and name HA ) ( resid 55 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3042
assign ( resid 19 and name HD# ) ( resid 16 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3043
assign ( resid 19 and name HD# ) ( resid 20 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3046
assign ( resid 83 and name HG# ) ( resid 85 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3048
assign ( resid 16 and name HD# ) ( resid 19 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3054
assign ( resid 16 and name HD# ) ( resid 65 and name HZ ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3057
assign ( resid 32 and name HA ) ( resid 34 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3059
assign ( resid 26 and name HA ) ( resid 27 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3075
assign ( resid 67 and name HA ) ( resid 21 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3076
assign ( resid 67 and name HA ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3077
assign ( resid 21 and name HG# ) ( resid 48 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3078
assign ( resid 27 and name HG# ) ( resid 26 and name HA or resid 28 and name 
HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3079
assign ( resid 21 and name HG# ) ( resid 35 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3080
assign ( resid 39 and name HG# ) ( resid 47 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3087
assign ( resid 41 and name HA ) ( resid 40 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3090
assign ( resid 23 and name HG2# ) ( resid 63 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3092
assign ( resid 16 and name HA ) ( resid 16 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3100
assign ( resid 82 and name HA ) ( resid 82 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3107
assign ( resid 78 and name HA ) ( resid 78 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3113
assign ( resid 25 and name HA ) ( resid 25 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3114
assign ( resid 96 and name HA ) ( resid 96 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3115
assign ( resid 46 and name HA ) ( resid 41 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3119
assign ( resid 46 and name HA ) ( resid 60 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3120
assign ( resid 37 and name HA ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3121
assign ( resid 22 and name HA ) ( resid 22 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3122
assign ( resid 22 and name HA ) ( resid 22 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3123
assign ( resid 11 and name HG2# ) ( resid 16 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3124
assign ( resid 28 and name HA ) ( resid 27 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3125
assign ( resid 56 and name HG2# ) ( resid 49 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3129
assign ( resid 48 and name HG2# ) ( resid 37 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3132
assign ( resid 48 and name HG2# ) ( resid 35 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3133
assign ( resid 48 and name HG2# ) ( resid 50 and name HE1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3135
assign ( resid 84 and name HA ) ( resid 83 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3136
assign ( resid 62 and name HD11 ) ( resid 59 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3137
assign ( resid 23 and name HD11 ) ( resid 22 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3139
assign ( resid 63 and name HA ) ( resid 64 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3140
assign ( resid 63 and name HA ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3141
assign ( resid 23 and name HD11 ) ( resid 67 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3142
assign ( resid 23 and name HD11 ) ( resid 65 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3143
assign ( resid 17 and name HD11 ) ( resid 16 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3150
assign ( resid 65 and name HB# ) ( resid 67 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3157
assign ( resid 65 and name HB# ) ( resid 67 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3158
assign ( resid 67 and name HB# ) ( resid 67 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3159
assign ( resid 67 and name HB# ) ( resid 65 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3160
assign ( resid 67 and name HB# ) ( resid 67 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3161
assign ( resid 67 and name HB# ) ( resid 67 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3163
assign ( resid 58 and name HB ) ( resid 48 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3164
assign ( resid 47 and name HG# ) ( resid 47 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3165
assign ( resid 38 and name HG# ) ( resid 37 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3166
assign ( resid 46 and name HB# ) ( resid 46 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3170
assign ( resid 46 and name HB# ) ( resid 46 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3171
assign ( resid 46 and name HB# ) ( resid 58 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3173
assign ( resid 46 and name HB# ) ( resid 48 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3174
assign ( resid 68 and name HG# ) ( resid 68 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3175
assign ( resid 82 and name HD# ) ( resid 82 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3177
assign ( resid 46 and name HD# ) ( resid 41 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3178
assign ( resid 37 and name HA ) ( resid 37 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3179
assign ( resid 85 and name HA ) ( resid 86 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3180
assign ( resid 68 and name HG# ) ( resid 20 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3182
assign ( resid 82 and name HD# ) ( resid 60 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3183
assign ( resid 25 and name HB# ) ( resid 25 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3185
assign ( resid 60 and name HE# ) ( resid 60 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3187
assign ( resid 60 and name HE# ) ( resid 82 and name HB# or resid 46 and 
name HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  3188
assign ( resid 60 and name HE# ) ( resid 60 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3192
assign ( resid 60 and name HE# ) ( resid 46 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3193
assign ( resid 80 and name HD# ) ( resid 79 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3198
assign ( resid 80 and name HD# ) ( resid 80 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3199
assign ( resid 50 and name HB# ) ( resid 50 and name HE1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3201
assign ( resid 66 and name HB# ) ( resid 22 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3203
assign ( resid 66 and name HB# ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3204
assign ( resid 47 and name HB# ) ( resid 40 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3205
assign ( resid 16 and name HA ) ( resid 19 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3207
assign ( resid 68 and name HB# ) ( resid 20 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3208
assign ( resid 68 and name HB# ) ( resid 20 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  3209



noenh033103sss

assign ( resid 61 and name HN ) ( resid 62 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  7
assign ( resid 61 and name HN ) ( resid 59 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  8
assign ( resid 61 and name HN ) ( resid 61 and name HA# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  10
assign ( resid 61 and name HN ) ( resid 61 and name HA# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  11
assign ( resid 61 and name HN ) ( resid 59 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  13
assign ( resid 61 and name HN ) ( resid 62 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  14
assign ( resid 61 and name HN ) ( resid 83 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  15
assign ( resid 61 and name HN ) ( resid 82 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  16
assign ( resid 24 and name HN ) ( resid 66 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  17
assign ( resid 24 and name HN ) ( resid 25 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  19
assign ( resid 24 and name HN ) ( resid 65 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  21
assign ( resid 24 and name HN ) ( resid 23 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  22
assign ( resid 24 and name HN ) ( resid 25 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  23
assign ( resid 24 and name HN ) ( resid 23 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  24
assign ( resid 24 and name HN ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  25
assign ( resid 24 and name HN ) ( resid 24 and name HB1 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  26
assign ( resid 24 and name HN ) ( resid 24 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  27
assign ( resid 78 and name HN ) ( resid 79 and name HN or resid 77 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  32
assign ( resid 78 and name HN ) ( resid 77 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  35
assign ( resid 78 and name HN ) ( resid 78 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  36
assign ( resid 78 and name HN ) ( resid 78 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  37
assign ( resid 78 and name HN ) ( resid 78 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  38
assign ( resid 78 and name HN ) ( resid 77 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  39
assign ( resid 78 and name HN ) ( resid 81 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  40
assign ( resid 78 and name HN ) ( resid 77 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  41
assign ( resid 78 and name HN ) ( resid 77 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  42
assign ( resid 78 and name HN ) ( resid 64 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  43
assign ( resid 78 and name HN ) ( resid 77 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  44
assign ( resid 78 and name HN ) ( resid 77 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  45
assign ( resid 50 and name HN ) ( resid 56 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  47
assign ( resid 50 and name HN ) ( resid 55 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  48
assign ( resid 50 and name HN ) ( resid 50 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  49
assign ( resid 50 and name HN ) ( resid 49 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  50
assign ( resid 50 and name HN ) ( resid 50 and name HE1 or resid 49 and name 
HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  51
assign ( resid 50 and name HN ) ( resid 49 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  52
assign ( resid 48 and name HN ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  53
assign ( resid 48 and name HN ) ( resid 48 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  54
assign ( resid 48 and name HN ) ( resid 56 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  56
assign ( resid 48 and name HN ) ( resid 47 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  57
assign ( resid 48 and name HN ) ( resid 47 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  58
assign ( resid 48 and name HN ) ( resid 57 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  59
assign ( resid 48 and name HN ) ( resid 48 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  60
assign ( resid 48 and name HN ) ( resid 47 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  61
assign ( resid 48 and name HN ) ( resid 48 and name HB or resid 47 and name 
HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  62
assign ( resid 48 and name HN ) ( resid 48 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  63
assign ( resid 48 and name HN ) ( resid 47 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  64
assign ( resid 48 and name HN ) ( resid 47 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  65
assign ( resid 48 and name HN ) ( resid 56 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  66
assign ( resid 48 and name HN ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  67
assign ( resid 50 and name HN ) ( resid 49 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  70
assign ( resid 50 and name HN ) ( resid 49 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  71
assign ( resid 50 and name HN ) ( resid 50 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  72
assign ( resid 76 and name HN ) ( resid 76 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  76
assign ( resid 76 and name HN ) ( resid 75 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  77
assign ( resid 76 and name HN ) ( resid 76 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  78
assign ( resid 76 and name HN ) ( resid 75 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  79
assign ( resid 76 and name HN ) ( resid 76 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  80
assign ( resid 76 and name HN ) ( resid 75 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  81
assign ( resid 84 and name HN ) ( resid 83 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  83
assign ( resid 84 and name HN ) ( resid 84 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  85
assign ( resid 84 and name HN ) ( resid 83 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  86
assign ( resid 84 and name HN ) ( resid 84 and name HB1 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  87
assign ( resid 49 and name HN ) ( resid 37 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  89
assign ( resid 49 and name HN ) ( resid 37 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  92
assign ( resid 49 and name HN ) ( resid 49 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  93
assign ( resid 49 and name HN ) ( resid 48 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  94
assign ( resid 49 and name HN ) ( resid 38 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  95
assign ( resid 49 and name HN ) ( resid 49 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  96
assign ( resid 49 and name HN ) ( resid 49 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  97
assign ( resid 49 and name HN ) ( resid 49 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  98
assign ( resid 49 and name HN ) ( resid 37 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  99
assign ( resid 49 and name HN ) ( resid 48 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  100
assign ( resid 49 and name HN ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  101
assign ( resid 49 and name HN ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  102
assign ( resid 49 and name HN ) ( resid 48 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  103
assign ( resid 49 and name HN ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  104
assign ( resid 77 and name HN ) ( resid 78 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  117
assign ( resid 77 and name HN ) ( resid 65 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  118
assign ( resid 77 and name HN ) ( resid 65 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  119
assign ( resid 77 and name HN ) ( resid 66 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  120
assign ( resid 77 and name HN ) ( resid 76 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  121
assign ( resid 77 and name HN ) ( resid 77 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  122
assign ( resid 77 and name HN ) ( resid 77 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  124
assign ( resid 77 and name HN ) ( resid 76 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  125
assign ( resid 77 and name HN ) ( resid 77 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  126
assign ( resid 77 and name HN ) ( resid 77 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  127
assign ( resid 77 and name HN ) ( resid 77 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  128
assign ( resid 77 and name HN ) ( resid 75 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  129
assign ( resid 58 and name HN ) ( resid 46 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  132
assign ( resid 58 and name HN ) ( resid 47 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  133
assign ( resid 58 and name HN ) ( resid 57 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  134
assign ( resid 58 and name HN ) ( resid 58 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  135
assign ( resid 58 and name HN ) ( resid 57 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  136
assign ( resid 58 and name HN ) ( resid 59 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  137
assign ( resid 58 and name HN ) ( resid 58 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  138
assign ( resid 58 and name HN ) ( resid 57 and name HG21 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  139
assign ( resid 58 and name HN ) ( resid 58 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  141
assign ( resid 23 and name HN ) ( resid 34 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  144
assign ( resid 23 and name HN ) ( resid 35 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  145
assign ( resid 23 and name HN ) ( resid 22 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  146
assign ( resid 23 and name HN ) ( resid 23 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  147
assign ( resid 23 and name HN ) ( resid 23 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  148
assign ( resid 23 and name HN ) ( resid 22 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  149
assign ( resid 23 and name HN ) ( resid 22 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  150
assign ( resid 23 and name HN ) ( resid 23 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  151
assign ( resid 23 and name HN ) ( resid 22 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  152
assign ( resid 23 and name HN ) ( resid 22 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  153
assign ( resid 23 and name HN ) ( resid 23 and name HG12 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  154
assign ( resid 23 and name HN ) ( resid 23 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  155
assign ( resid 23 and name HN ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  156
assign ( resid 58 and name HN ) ( resid 56 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  158
assign ( resid 75 and name HN ) ( resid 67 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  160
assign ( resid 75 and name HN ) ( resid 76 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  163
assign ( resid 75 and name HN ) ( resid 74 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  164
assign ( resid 75 and name HN ) ( resid 68 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  165
assign ( resid 75 and name HN ) ( resid 74 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  166
assign ( resid 75 and name HN ) ( resid 75 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  167
assign ( resid 75 and name HN ) ( resid 67 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  168
assign ( resid 75 and name HN ) ( resid 75 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  169
assign ( resid 75 and name HN ) ( resid 74 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  170
assign ( resid 75 and name HN ) ( resid 74 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  171
assign ( resid 75 and name HN ) ( resid 74 and name HG ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  172
assign ( resid 75 and name HN ) ( resid 75 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  173
assign ( resid 75 and name HN ) ( resid 74 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  174
assign ( resid 75 and name HN ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  175
assign ( resid 74 and name HN ) ( resid 68 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  177
assign ( resid 74 and name HN ) ( resid 74 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  178
assign ( resid 74 and name HN ) ( resid 73 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  180
assign ( resid 74 and name HN ) ( resid 68 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  181
assign ( resid 74 and name HN ) ( resid 73 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  182
assign ( resid 74 and name HN ) ( resid 74 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  184
assign ( resid 74 and name HN ) ( resid 74 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  185
assign ( resid 74 and name HN ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  186
assign ( resid 74 and name HN ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  187
assign ( resid 74 and name HN ) ( resid 75 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  188
assign ( resid 74 and name HN ) ( resid 73 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  191
assign ( resid 74 and name HN ) ( resid 73 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  194
assign ( resid 74 and name HN ) ( resid 68 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  195
assign ( resid 74 and name HN ) ( resid 74 and name HG ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  196
assign ( resid 65 and name HN ) ( resid 77 and name HN or resid 79 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  199
assign ( resid 65 and name HN ) ( resid 65 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  201
assign ( resid 65 and name HN ) ( resid 65 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  202
assign ( resid 65 and name HN ) ( resid 78 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  203
assign ( resid 65 and name HN ) ( resid 64 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  204
assign ( resid 65 and name HN ) ( resid 65 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  205
assign ( resid 65 and name HN ) ( resid 65 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  206
assign ( resid 65 and name HN ) ( resid 64 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  207
assign ( resid 65 and name HN ) ( resid 64 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  208
assign ( resid 65 and name HN ) ( resid 64 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  209
assign ( resid 22 and name HN ) ( resid 66 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  212
assign ( resid 22 and name HN ) ( resid 66 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  213
assign ( resid 22 and name HN ) ( resid 21 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  214
assign ( resid 22 and name HN ) ( resid 65 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  215
assign ( resid 22 and name HN ) ( resid 67 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  216
assign ( resid 22 and name HN ) ( resid 21 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  217
assign ( resid 22 and name HN ) ( resid 66 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  218
assign ( resid 22 and name HN ) ( resid 21 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  219
assign ( resid 22 and name HN ) ( resid 22 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  220
assign ( resid 22 and name HN ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  221
assign ( resid 22 and name HN ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  222
assign ( resid 96 and name HN ) ( resid 94 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  225
assign ( resid 96 and name HN ) ( resid 95 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  227
assign ( resid 96 and name HN ) ( resid 96 and name HB# or resid 96 and name 
HG# or resid 96 and name HD# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  228
assign ( resid 65 and name HN ) ( resid 77 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  230
assign ( resid 63 and name HN ) ( resid 79 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  231
assign ( resid 91 and name HN ) ( resid 91 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  237
assign ( resid 91 and name HN ) ( resid 90 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  238
assign ( resid 91 and name HN ) ( resid 91 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  239
assign ( resid 91 and name HN ) ( resid 91 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  240
assign ( resid 91 and name HN ) ( resid 90 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  241
assign ( resid 63 and name HN ) ( resid 80 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  245
assign ( resid 63 and name HN ) ( resid 61 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  246
assign ( resid 63 and name HN ) ( resid 64 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  247
assign ( resid 63 and name HN ) ( resid 65 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  255
assign ( resid 63 and name HN ) ( resid 62 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  256
assign ( resid 63 and name HN ) ( resid 63 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  258
assign ( resid 63 and name HN ) ( resid 26 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  259
assign ( resid 63 and name HN ) ( resid 62 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  260
assign ( resid 63 and name HN ) ( resid 80 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  261
assign ( resid 63 and name HN ) ( resid 79 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  263
assign ( resid 63 and name HN ) ( resid 61 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  264
assign ( resid 63 and name HN ) ( resid 62 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  265
assign ( resid 63 and name HN ) ( resid 59 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  266
assign ( resid 63 and name HN ) ( resid 62 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  267
assign ( resid 63 and name HN ) ( resid 60 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  268
assign ( resid 63 and name HN ) ( resid 62 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  270
assign ( resid 63 and name HN ) ( resid 62 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  271
assign ( resid 63 and name HN ) ( resid 63 and name HB1 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  272
assign ( resid 38 and name HN ) ( resid 49 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  274
assign ( resid 38 and name HN ) ( resid 18 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  275
assign ( resid 38 and name HN ) ( resid 21 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  276
assign ( resid 38 and name HN ) ( resid 19 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  279
assign ( resid 38 and name HN ) ( resid 37 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  280
assign ( resid 38 and name HN ) ( resid 20 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  281
assign ( resid 38 and name HN ) ( resid 38 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  282
assign ( resid 38 and name HN ) ( resid 38 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  284
assign ( resid 38 and name HN ) ( resid 21 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  285
assign ( resid 38 and name HN ) ( resid 37 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  286
assign ( resid 38 and name HN ) ( resid 37 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  287
assign ( resid 38 and name HN ) ( resid 38 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  288
assign ( resid 38 and name HN ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  289
assign ( resid 38 and name HN ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  290
assign ( resid 38 and name HN ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  291
assign ( resid 38 and name HN ) ( resid 37 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  292
assign ( resid 37 and name HN ) ( resid 20 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  298
assign ( resid 60 and name HN ) ( resid 45 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  300
assign ( resid 60 and name HN ) ( resid 59 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  301
assign ( resid 60 and name HN ) ( resid 59 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  302
assign ( resid 60 and name HN ) ( resid 45 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  303
assign ( resid 60 and name HN ) ( resid 59 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  304
assign ( resid 60 and name HN ) ( resid 59 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  305
assign ( resid 60 and name HN ) ( resid 60 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  306
assign ( resid 60 and name HN ) ( resid 46 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  307
assign ( resid 60 and name HN ) ( resid 60 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  308
assign ( resid 60 and name HN ) ( resid 45 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  309
assign ( resid 60 and name HN ) ( resid 46 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  310
assign ( resid 60 and name HN ) ( resid 60 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  311
assign ( resid 6 and name HN ) ( resid 5 and name HB# ) 2.60 0.80 0.80 !FROM 
PEAK NUMBER:  316
assign ( resid 57 and name HN ) ( resid 48 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  320
assign ( resid 57 and name HN ) ( resid 56 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  321
assign ( resid 37 and name HN ) ( resid 38 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  322
assign ( resid 37 and name HN ) ( resid 20 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  329
assign ( resid 57 and name HN ) ( resid 57 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  330
assign ( resid 57 and name HN ) ( resid 56 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  332
assign ( resid 57 and name HN ) ( resid 57 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  334
assign ( resid 37 and name HN ) ( resid 37 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  335
assign ( resid 57 and name HN ) ( resid 55 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  337
assign ( resid 57 and name HN ) ( resid 56 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  338
assign ( resid 57 and name HN ) ( resid 56 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  339
assign ( resid 57 and name HN ) ( resid 57 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  340
assign ( resid 57 and name HN ) ( resid 57 and name HG21 or resid 56 and 
name HG12 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  341
assign ( resid 57 and name HN ) ( resid 56 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  343
assign ( resid 57 and name HN ) ( resid 56 and name HD11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  344
assign ( resid 37 and name HN ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  347
assign ( resid 37 and name HN ) ( resid 49 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  348
assign ( resid 37 and name HN ) ( resid 37 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  349
assign ( resid 37 and name HN ) ( resid 50 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  350
assign ( resid 37 and name HN ) ( resid 36 and name HA# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  351
assign ( resid 37 and name HN ) ( resid 36 and name HA# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  352
assign ( resid 37 and name HN ) ( resid 50 and name HE1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  353
assign ( resid 37 and name HN ) ( resid 37 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  354
assign ( resid 37 and name HN ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  355
assign ( resid 47 and name HN ) ( resid 48 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  356
assign ( resid 47 and name HN ) ( resid 46 and name HN or resid 42 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  357
assign ( resid 47 and name HN ) ( resid 40 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  360
assign ( resid 47 and name HN ) ( resid 46 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  361
assign ( resid 47 and name HN ) ( resid 47 and name HG# or resid 46 and name 
HG ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  362
assign ( resid 47 and name HN ) ( resid 46 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  363
assign ( resid 47 and name HN ) ( resid 47 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  364
assign ( resid 47 and name HN ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  365
assign ( resid 47 and name HN ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  366
assign ( resid 47 and name HN ) ( resid 40 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  369
assign ( resid 47 and name HN ) ( resid 47 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  370
assign ( resid 47 and name HN ) ( resid 46 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  371
assign ( resid 47 and name HN ) ( resid 40 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  373
assign ( resid 47 and name HN ) ( resid 47 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  374
assign ( resid 47 and name HN ) ( resid 47 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  375
assign ( resid 47 and name HN ) ( resid 42 and name HG21 or resid 57 and 
name HG21 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  376
assign ( resid 47 and name HN ) ( resid 46 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  377
assign ( resid 6 and name HN ) ( resid 6 and name HA ) 2.60 0.80 0.80 !FROM 
PEAK NUMBER:  381
assign ( resid 6 and name HN ) ( resid 6 and name HB ) 2.30 0.50 0.50 !FROM 
PEAK NUMBER:  382
assign ( resid 6 and name HN ) ( resid 6 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  383
assign ( resid 6 and name HN ) ( resid 5 and name HG ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  384
assign ( resid 6 and name HN ) ( resid 6 and name HD11 or resid 6 and name 
HG2# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  385
assign ( resid 67 and name HN ) ( resid 67 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  388
assign ( resid 67 and name HN ) ( resid 65 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  389
assign ( resid 67 and name HN ) ( resid 66 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  390
assign ( resid 67 and name HN ) ( resid 67 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  391
assign ( resid 67 and name HN ) ( resid 66 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  392
assign ( resid 67 and name HN ) ( resid 66 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  393
assign ( resid 67 and name HN ) ( resid 67 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  394
assign ( resid 67 and name HN ) ( resid 75 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  395
assign ( resid 67 and name HN ) ( resid 67 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  396
assign ( resid 67 and name HN ) ( resid 75 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  397
assign ( resid 67 and name HN ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  398
assign ( resid 21 and name HN ) ( resid 38 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  404
assign ( resid 21 and name HN ) ( resid 20 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  405
assign ( resid 21 and name HN ) ( resid 36 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  406
assign ( resid 21 and name HN ) ( resid 22 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  407
assign ( resid 21 and name HN ) ( resid 37 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  408
assign ( resid 21 and name HN ) ( resid 20 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  409
assign ( resid 21 and name HN ) ( resid 20 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  410
assign ( resid 21 and name HN ) ( resid 21 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  411
assign ( resid 21 and name HN ) ( resid 21 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  413
assign ( resid 21 and name HN ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  414
assign ( resid 21 and name HN ) ( resid 21 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  415
assign ( resid 21 and name HN ) ( resid 20 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  416
assign ( resid 21 and name HN ) ( resid 37 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  417
assign ( resid 39 and name HN ) ( resid 40 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  421
assign ( resid 39 and name HN ) ( resid 39 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  422
assign ( resid 39 and name HN ) ( resid 38 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  423
assign ( resid 39 and name HN ) ( resid 39 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  424
assign ( resid 39 and name HN ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  425
assign ( resid 39 and name HN ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  426
assign ( resid 39 and name HN ) ( resid 38 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  427
assign ( resid 39 and name HN ) ( resid 39 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  428
assign ( resid 92 and name HN ) ( resid 91 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  432
assign ( resid 93 and name HN ) ( resid 93 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  433
assign ( resid 93 and name HN ) ( resid 92 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  435
assign ( resid 92 and name HN ) ( resid 92 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  439
assign ( resid 27 and name HN ) ( resid 26 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  441
assign ( resid 27 and name HN ) ( resid 26 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  442
assign ( resid 83 and name HN ) ( resid 82 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  444
assign ( resid 83 and name HN ) ( resid 81 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  445
assign ( resid 83 and name HN ) ( resid 84 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  446
assign ( resid 83 and name HN ) ( resid 82 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  447
assign ( resid 83 and name HN ) ( resid 82 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  452
assign ( resid 83 and name HN ) ( resid 83 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  453
assign ( resid 83 and name HN ) ( resid 80 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  454
assign ( resid 83 and name HN ) ( resid 83 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  455
assign ( resid 83 and name HN ) ( resid 82 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  456
assign ( resid 83 and name HN ) ( resid 81 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  458
assign ( resid 83 and name HN ) ( resid 83 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  462
assign ( resid 83 and name HN ) ( resid 83 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  463
assign ( resid 41 and name HN ) ( resid 42 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  468
assign ( resid 41 and name HN ) ( resid 47 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  474
assign ( resid 41 and name HN ) ( resid 40 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  475
assign ( resid 41 and name HN ) ( resid 40 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  477
assign ( resid 41 and name HN ) ( resid 40 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  479
assign ( resid 41 and name HN ) ( resid 40 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  480
assign ( resid 41 and name HN ) ( resid 41 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  482
assign ( resid 41 and name HN ) ( resid 41 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  483
assign ( resid 41 and name HN ) ( resid 17 and name HD11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  486
assign ( resid 92 and name HN ) ( resid 92 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  488
assign ( resid 27 and name HN ) ( resid 27 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  491
assign ( resid 27 and name HN ) ( resid 27 and name HB or resid 62 and name 
HB ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  493
assign ( resid 27 and name HN ) ( resid 27 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  494
assign ( resid 51 and name HN ) ( resid 52 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  500
assign ( resid 51 and name HN ) ( resid 50 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  501
assign ( resid 51 and name HN ) ( resid 51 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  503
assign ( resid 51 and name HN ) ( resid 51 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  505
assign ( resid 51 and name HN ) ( resid 50 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  507
assign ( resid 51 and name HN ) ( resid 50 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  508
assign ( resid 94 and name HN ) ( resid 93 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  514
assign ( resid 66 and name HN ) ( resid 65 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  517
assign ( resid 66 and name HN ) ( resid 66 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  518
assign ( resid 66 and name HN ) ( resid 66 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  519
assign ( resid 66 and name HN ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  520
assign ( resid 7 and name HN ) ( resid 7 and name HA ) 2.60 0.80 0.80 !FROM 
PEAK NUMBER:  522
assign ( resid 7 and name HN ) ( resid 6 and name HA ) 2.30 0.50 0.50 !FROM 
PEAK NUMBER:  523
assign ( resid 7 and name HN ) ( resid 7 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  524
assign ( resid 7 and name HN ) ( resid 6 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  525
assign ( resid 7 and name HN ) ( resid 7 and name HB ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  526
assign ( resid 54 and name HN ) ( resid 50 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  530
assign ( resid 54 and name HN ) ( resid 55 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  531
assign ( resid 54 and name HN ) ( resid 52 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  536
assign ( resid 54 and name HN ) ( resid 50 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  540
assign ( resid 54 and name HN ) ( resid 52 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  542
assign ( resid 54 and name HN ) ( resid 54 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  543
assign ( resid 54 and name HN ) ( resid 53 and name HA# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  544
assign ( resid 54 and name HN ) ( resid 54 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  546
assign ( resid 54 and name HN ) ( resid 52 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  547
assign ( resid 54 and name HN ) ( resid 52 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  548
assign ( resid 54 and name HN ) ( resid 50 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  549
assign ( resid 54 and name HN ) ( resid 54 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  551
assign ( resid 54 and name HN ) ( resid 54 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  552
assign ( resid 54 and name HN ) ( resid 54 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  553
assign ( resid 66 and name HN ) ( resid 22 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  555
assign ( resid 66 and name HN ) ( resid 76 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  557
assign ( resid 66 and name HN ) ( resid 65 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  558
assign ( resid 66 and name HN ) ( resid 23 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  559
assign ( resid 66 and name HN ) ( resid 66 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  560
assign ( resid 66 and name HN ) ( resid 65 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  561
assign ( resid 66 and name HN ) ( resid 24 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  562
assign ( resid 68 and name HN ) ( resid 67 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  564
assign ( resid 68 and name HN ) ( resid 67 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  565
assign ( resid 85 and name HN ) ( resid 86 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  573
assign ( resid 85 and name HN ) ( resid 84 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  578
assign ( resid 19 and name HN ) ( resid 19 and name HD# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  579
assign ( resid 73 and name HN ) ( resid 69 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  587
assign ( resid 73 and name HN ) ( resid 74 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  588
assign ( resid 73 and name HN ) ( resid 72 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  589
assign ( resid 73 and name HN ) ( resid 71 and name HE2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  591
assign ( resid 73 and name HN ) ( resid 71 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  592
assign ( resid 73 and name HN ) ( resid 68 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  596
assign ( resid 73 and name HN ) ( resid 69 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  598
assign ( resid 73 and name HN ) ( resid 73 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  600
assign ( resid 73 and name HN ) ( resid 72 and name HA# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  601
assign ( resid 73 and name HN ) ( resid 68 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  602
assign ( resid 73 and name HN ) ( resid 71 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  603
assign ( resid 73 and name HN ) ( resid 73 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  604
assign ( resid 73 and name HN ) ( resid 71 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  605
assign ( resid 73 and name HN ) ( resid 73 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  606
assign ( resid 73 and name HN ) ( resid 68 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  607
assign ( resid 73 and name HN ) ( resid 68 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  608
assign ( resid 73 and name HN ) ( resid 69 and name HG1 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  609
assign ( resid 34 and name HN ) ( resid 23 and name HG2# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  612
assign ( resid 32 and name HN ) ( resid 26 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  613
assign ( resid 56 and name HN ) ( resid 48 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  614
assign ( resid 56 and name HN ) ( resid 57 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  615
assign ( resid 68 and name HN ) ( resid 68 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  618
assign ( resid 68 and name HN ) ( resid 21 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  619
assign ( resid 68 and name HN ) ( resid 68 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  620
assign ( resid 68 and name HN ) ( resid 67 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  621
assign ( resid 68 and name HN ) ( resid 67 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  622
assign ( resid 68 and name HN ) ( resid 68 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  623
assign ( resid 68 and name HN ) ( resid 68 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  624
assign ( resid 68 and name HN ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  625
assign ( resid 68 and name HN ) ( resid 69 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  626
assign ( resid 68 and name HN ) ( resid 74 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  628
assign ( resid 88 and name HN ) ( resid 86 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  629
assign ( resid 68 and name HN ) ( resid 20 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  631
assign ( resid 68 and name HN ) ( resid 68 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  633
assign ( resid 28 and name HN ) ( resid 27 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  634
assign ( resid 68 and name HN ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  635
assign ( resid 68 and name HN ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  636
assign ( resid 68 and name HN ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  637
assign ( resid 88 and name HN ) ( resid 85 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  639
assign ( resid 88 and name HN ) ( resid 87 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  640
assign ( resid 88 and name HN ) ( resid 88 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  641
assign ( resid 88 and name HN ) ( resid 88 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  643
assign ( resid 88 and name HN ) ( resid 85 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  645
assign ( resid 19 and name HN ) ( resid 18 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  646
assign ( resid 85 and name HN ) ( resid 87 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  647
assign ( resid 19 and name HN ) ( resid 20 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  648
assign ( resid 19 and name HN ) ( resid 69 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  650
assign ( resid 19 and name HN ) ( resid 18 and name HA# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  651
assign ( resid 81 and name HN ) ( resid 80 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  652
assign ( resid 19 and name HN ) ( resid 19 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  654
assign ( resid 81 and name HN ) ( resid 82 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  655
assign ( resid 19 and name HN ) ( resid 38 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  656
assign ( resid 28 and name HN ) ( resid 27 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  657
assign ( resid 19 and name HN ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  658
assign ( resid 34 and name HN ) ( resid 33 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  662
assign ( resid 34 and name HN ) ( resid 35 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  663
assign ( resid 34 and name HN ) ( resid 33 and name HA# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  668
assign ( resid 34 and name HN ) ( resid 34 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  669
assign ( resid 34 and name HN ) ( resid 33 and name HA# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  670
assign ( resid 34 and name HN ) ( resid 23 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  671
assign ( resid 34 and name HN ) ( resid 32 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  672
assign ( resid 34 and name HN ) ( resid 32 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  673
assign ( resid 34 and name HN ) ( resid 34 and name HB or resid 58 and name 
HG# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  674
assign ( resid 34 and name HN ) ( resid 34 and name HG11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  675
assign ( resid 34 and name HN ) ( resid 34 and name HG12 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  676
assign ( resid 34 and name HN ) ( resid 23 and name HG12 or resid 58 and 
name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  678
assign ( resid 34 and name HN ) ( resid 34 and name HD11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  679
assign ( resid 34 and name HN or resid 32 and name HN ) ( resid 33 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  681
assign ( resid 32 and name HN ) ( resid 31 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  690
assign ( resid 32 and name HN ) ( resid 26 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  693
assign ( resid 32 and name HN or resid 34 and name HN ) ( resid 32 and name 
HA or resid 33 and name HA# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  694
assign ( resid 32 and name HN ) ( resid 26 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  695
assign ( resid 32 and name HN ) ( resid 32 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  698
assign ( resid 32 and name HN ) ( resid 32 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  699
assign ( resid 32 and name HN ) ( resid 32 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  700
assign ( resid 32 and name HN ) ( resid 31 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  701
assign ( resid 32 and name HN ) ( resid 31 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  702
assign ( resid 34 and name HN ) ( resid 23 and name HG12 or resid 58 and 
name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  703
assign ( resid 32 and name HN ) ( resid 31 and name HD11 or resid 31 and 
name HG2# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  704
assign ( resid 32 and name HN ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  705
assign ( resid 56 and name HN ) ( resid 48 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  706
assign ( resid 56 and name HN ) ( resid 55 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  709
assign ( resid 56 and name HN ) ( resid 55 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  710
assign ( resid 56 and name HN ) ( resid 49 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  712
assign ( resid 56 and name HN ) ( resid 56 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  713
assign ( resid 56 and name HN ) ( resid 50 and name HE1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  714
assign ( resid 56 and name HN ) ( resid 55 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  715
assign ( resid 56 and name HN ) ( resid 56 and name HB or resid 55 and name 
HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  716
assign ( resid 56 and name HN ) ( resid 56 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  717
assign ( resid 56 and name HN ) ( resid 56 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  718
assign ( resid 56 and name HN ) ( resid 56 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  719
assign ( resid 56 and name HN ) ( resid 56 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  720
assign ( resid 56 and name HN ) ( resid 50 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  721
assign ( resid 56 and name HN ) ( resid 47 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  722
assign ( resid 56 and name HN ) ( resid 55 and name HG# or resid 49 and name 
HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  723
assign ( resid 56 and name HN ) ( resid 48 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  724
assign ( resid 55 and name HN ) ( resid 56 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  727
assign ( resid 55 and name HN ) ( resid 54 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  732
assign ( resid 55 and name HN ) ( resid 55 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  733
assign ( resid 55 and name HN ) ( resid 49 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  734
assign ( resid 55 and name HN ) ( resid 54 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  737
assign ( resid 55 and name HN ) ( resid 54 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  739
assign ( resid 55 and name HN ) ( resid 55 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  740
assign ( resid 55 and name HN ) ( resid 54 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  741
assign ( resid 55 and name HN ) ( resid 55 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  742
assign ( resid 55 and name HN ) ( resid 54 and name HB# or resid 55 and name 
HB# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  743
assign ( resid 55 and name HN ) ( resid 54 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  744
assign ( resid 81 and name HN ) ( resid 79 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  747
assign ( resid 81 and name HN ) ( resid 78 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  750
assign ( resid 81 and name HN ) ( resid 79 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  751
assign ( resid 28 and name HN ) ( resid 26 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  752
assign ( resid 81 and name HN ) ( resid 80 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  753
assign ( resid 28 and name HN ) ( resid 31 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  756
assign ( resid 81 and name HN ) ( resid 80 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  757
assign ( resid 88 and name HN ) ( resid 88 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  760
assign ( resid 28 and name HN ) ( resid 27 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  762
assign ( resid 19 and name HN ) ( resid 19 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  763
assign ( resid 19 and name HN ) ( resid 19 and name HG ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  764
assign ( resid 81 and name HN ) ( resid 80 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  769
assign ( resid 81 and name HN ) ( resid 82 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  770
assign ( resid 81 and name HN ) ( resid 83 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  771
assign ( resid 81 and name HN ) ( resid 81 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  772
assign ( resid 81 and name HN ) ( resid 80 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  773
assign ( resid 81 and name HN ) ( resid 81 and name HB1 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  775
assign ( resid 81 and name HN ) ( resid 77 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  777
assign ( resid 28 and name HN ) ( resid 27 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  778
assign ( resid 11 and name HN ) ( resid 10 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  781
assign ( resid 11 and name HN ) ( resid 11 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  783
assign ( resid 11 and name HN ) ( resid 11 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  784
assign ( resid 11 and name HN ) ( resid 11 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  785
assign ( resid 35 and name HN ) ( resid 36 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  788
assign ( resid 35 and name HN ) ( resid 34 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  792
assign ( resid 35 and name HN ) ( resid 35 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  793
assign ( resid 35 and name HN ) ( resid 22 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  794
assign ( resid 35 and name HN ) ( resid 34 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  797
assign ( resid 35 and name HN ) ( resid 35 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  798
assign ( resid 35 and name HN ) ( resid 35 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  799
assign ( resid 35 and name HN ) ( resid 34 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  801
assign ( resid 35 and name HN ) ( resid 34 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  802
assign ( resid 35 and name HN ) ( resid 34 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  803
assign ( resid 35 and name HN ) ( resid 23 and name HG12 or resid 56 and 
name HG2# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  804
assign ( resid 35 and name HN ) ( resid 34 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  805
assign ( resid 90 and name HN ) ( resid 91 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  806
assign ( resid 90 and name HN ) ( resid 88 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  809
assign ( resid 90 and name HN ) ( resid 90 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  810
assign ( resid 90 and name HN ) ( resid 90 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  811
assign ( resid 90 and name HN ) ( resid 90 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  813
assign ( resid 90 and name HN ) ( resid 90 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  815
assign ( resid 43 and name HN ) ( resid 43 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  817
assign ( resid 43 and name HN ) ( resid 42 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  820
assign ( resid 43 and name HN ) ( resid 43 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  823
assign ( resid 64 and name HN ) ( resid 24 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  830
assign ( resid 64 and name HN ) ( resid 63 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  831
assign ( resid 64 and name HN ) ( resid 25 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  832
assign ( resid 64 and name HN ) ( resid 63 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  833
assign ( resid 64 and name HN ) ( resid 26 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  834
assign ( resid 64 and name HN ) ( resid 25 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  835
assign ( resid 64 and name HN ) ( resid 64 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  836
assign ( resid 64 and name HN ) ( resid 64 and name HB ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  838
assign ( resid 64 and name HN ) ( resid 25 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  839
assign ( resid 64 and name HN ) ( resid 64 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  840
assign ( resid 64 and name HN ) ( resid 64 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  841
assign ( resid 64 and name HN ) ( resid 63 and name HB1 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  842
assign ( resid 64 and name HN ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  843
assign ( resid 40 and name HN ) ( resid 39 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  844
assign ( resid 40 and name HN ) ( resid 47 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  845
assign ( resid 40 and name HN ) ( resid 46 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  850
assign ( resid 40 and name HN ) ( resid 40 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  851
assign ( resid 40 and name HN ) ( resid 39 and name HA or resid 48 and name 
HA ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  852
assign ( resid 40 and name HN ) ( resid 38 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  853
assign ( resid 40 and name HN ) ( resid 40 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  855
assign ( resid 40 and name HN ) ( resid 40 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  856
assign ( resid 40 and name HN ) ( resid 39 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  857
assign ( resid 40 and name HN ) ( resid 47 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  858
assign ( resid 40 and name HN ) ( resid 47 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  859
assign ( resid 40 and name HN ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  861
assign ( resid 40 and name HN ) ( resid 39 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  862
assign ( resid 40 and name HN ) ( resid 38 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  863
assign ( resid 40 and name HN ) ( resid 39 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  864
assign ( resid 46 and name HN ) ( resid 60 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  867
assign ( resid 46 and name HN ) ( resid 59 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  868
assign ( resid 80 and name HN ) ( resid 79 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  869
assign ( resid 46 and name HN ) ( resid 58 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  870
assign ( resid 46 and name HN ) ( resid 47 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  876
assign ( resid 80 and name HN ) ( resid 81 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  878
assign ( resid 46 and name HN ) ( resid 45 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  880
assign ( resid 80 and name HN ) ( resid 82 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  881
assign ( resid 80 and name HN ) ( resid 83 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  882
assign ( resid 80 and name HN ) ( resid 65 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  883
assign ( resid 46 and name HN ) ( resid 45 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  885
assign ( resid 80 and name HN ) ( resid 63 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  886
assign ( resid 46 and name HN ) ( resid 46 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  887
assign ( resid 46 and name HN ) ( resid 58 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  889
assign ( resid 46 and name HN ) ( resid 59 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  890
assign ( resid 80 and name HN ) ( resid 78 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  891
assign ( resid 46 and name HN ) ( resid 41 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  892
assign ( resid 80 and name HN ) ( resid 80 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  893
assign ( resid 46 and name HN ) ( resid 45 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  894
assign ( resid 80 and name HN ) ( resid 79 and name HA# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  895
assign ( resid 80 and name HN ) ( resid 80 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  897
assign ( resid 80 and name HN ) ( resid 80 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  898
assign ( resid 80 and name HN ) ( resid 78 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  899
assign ( resid 80 and name HN ) ( resid 78 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  900
assign ( resid 80 and name HN ) ( resid 83 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  901
assign ( resid 46 and name HN ) ( resid 58 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  902
assign ( resid 80 and name HN ) ( resid 80 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  903
assign ( resid 46 and name HN ) ( resid 58 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  904
assign ( resid 80 and name HN ) ( resid 81 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  905
assign ( resid 46 and name HN ) ( resid 46 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  906
assign ( resid 46 and name HN ) ( resid 46 and name HG ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  907
assign ( resid 46 and name HN ) ( resid 46 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  908
assign ( resid 46 and name HN ) ( resid 42 and name HG21 or resid 57 and 
name HG21 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  909
assign ( resid 46 and name HN ) ( resid 45 and name HG21 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  910
assign ( resid 46 and name HN ) ( resid 58 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  911
assign ( resid 46 and name HN ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  912
assign ( resid 46 and name HN ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  913
assign ( resid 40 and name HN ) ( resid 41 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  916
assign ( resid 79 and name HN ) ( resid 80 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  922
assign ( resid 79 and name HN ) ( resid 65 and name HZ ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  923
assign ( resid 79 and name HN ) ( resid 65 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  924
assign ( resid 79 and name HN ) ( resid 78 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  926
assign ( resid 79 and name HN ) ( resid 64 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  927
assign ( resid 79 and name HN ) ( resid 79 and name HA# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  928
assign ( resid 79 and name HN ) ( resid 64 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  930
assign ( resid 42 and name HN ) ( resid 43 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  933
assign ( resid 20 and name HN ) ( resid 19 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  934
assign ( resid 20 and name HN ) ( resid 19 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  936
assign ( resid 20 and name HN ) ( resid 20 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  937
assign ( resid 20 and name HN ) ( resid 19 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  938
assign ( resid 20 and name HN ) ( resid 20 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  939
assign ( resid 20 and name HN ) ( resid 20 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  940
assign ( resid 20 and name HN ) ( resid 19 and name HG or resid 68 and name 
HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  941
assign ( resid 20 and name HN ) ( resid 19 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  942
assign ( resid 20 and name HN ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  943
assign ( resid 42 and name HN ) ( resid 47 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  949
assign ( resid 20 and name HN ) ( resid 68 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  950
assign ( resid 42 and name HN ) ( resid 42 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  951
assign ( resid 42 and name HN ) ( resid 42 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  952
assign ( resid 20 and name HN ) ( resid 37 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  953
assign ( resid 42 and name HN ) ( resid 40 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  954
assign ( resid 42 and name HN ) ( resid 41 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  957
assign ( resid 42 and name HN or resid 20 and name HN ) ( resid 41 and name 
HG# or resid 68 and name HB# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  958
assign ( resid 42 and name HN ) ( resid 45 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  959
assign ( resid 42 and name HN ) ( resid 46 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  960
assign ( resid 20 and name HN ) ( resid 21 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  961
assign ( resid 42 and name HN ) ( resid 41 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  964
assign ( resid 42 and name HN ) ( resid 45 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  965
assign ( resid 20 and name HN ) ( resid 69 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  967
assign ( resid 42 and name HN ) ( resid 42 and name HG21 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  968
assign ( resid 69 and name HN ) ( resid 73 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  975
assign ( resid 18 and name HN ) ( resid 38 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  987
assign ( resid 69 and name HN ) ( resid 74 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  988
assign ( resid 69 and name HN ) ( resid 72 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  989
assign ( resid 69 and name HN ) ( resid 68 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  990
assign ( resid 18 and name HN ) ( resid 19 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  991
assign ( resid 69 and name HN ) ( resid 73 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  992
assign ( resid 69 and name HN ) ( resid 68 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  993
assign ( resid 69 and name HN ) ( resid 74 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  996
assign ( resid 69 and name HN ) ( resid 69 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  997
assign ( resid 69 and name HN ) ( resid 19 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  999
assign ( resid 69 and name HN or resid 18 and name HN ) ( resid 69 and name 
HA or resid 18 and name HA# ) 2.60 0.80 0.80 !FROM PEAK NUMBER:  1000
assign ( resid 69 and name HN ) ( resid 73 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1001
assign ( resid 18 and name HN ) ( resid 18 and name HA# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1002
assign ( resid 69 and name HN ) ( resid 72 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1003
assign ( resid 18 and name HN ) ( resid 17 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1005
assign ( resid 18 and name HN ) ( resid 37 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1007
assign ( resid 69 and name HN ) ( resid 68 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1008
assign ( resid 69 and name HN ) ( resid 73 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1010
assign ( resid 69 and name HN ) ( resid 19 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1011
assign ( resid 69 and name HN ) ( resid 68 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1014
assign ( resid 69 and name HN ) ( resid 68 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1015
assign ( resid 69 and name HN ) ( resid 68 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1016
assign ( resid 18 and name HN ) ( resid 37 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1017
assign ( resid 69 and name HN ) ( resid 69 and name HG1 or resid 69 and name 
HG21 ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1018
assign ( resid 18 and name HN ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1019
assign ( resid 18 and name HN ) ( resid 17 and name HG2# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1020
assign ( resid 69 and name HN ) ( resid 19 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1021
assign ( resid 69 and name HN ) ( resid 74 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1022
assign ( resid 52 and name HN ) ( resid 51 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1024
assign ( resid 52 and name HN ) ( resid 53 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1025
assign ( resid 52 and name HN ) ( resid 50 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1030
assign ( resid 52 and name HN ) ( resid 52 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1032
assign ( resid 52 and name HN ) ( resid 51 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1033
assign ( resid 52 and name HN ) ( resid 53 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1035
assign ( resid 52 and name HN ) ( resid 52 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1036
assign ( resid 52 and name HN ) ( resid 51 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1037
assign ( resid 52 and name HN ) ( resid 52 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1038
assign ( resid 52 and name HN ) ( resid 50 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1039
assign ( resid 52 and name HN ) ( resid 50 and name HE1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1041
assign ( resid 30 and name HN ) ( resid 29 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1044
assign ( resid 30 and name HN ) ( resid 30 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1045
assign ( resid 30 and name HN ) ( resid 29 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1046
assign ( resid 30 and name HN ) ( resid 31 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1047
assign ( resid 30 and name HN ) ( resid 30 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1049
assign ( resid 30 and name HN ) ( resid 29 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1050
assign ( resid 30 and name HN ) ( resid 30 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1051
assign ( resid 30 and name HN ) ( resid 29 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1052
assign ( resid 26 and name HN ) ( resid 26 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1056
assign ( resid 26 and name HN ) ( resid 25 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1057
assign ( resid 26 and name HN ) ( resid 26 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1058
assign ( resid 26 and name HN ) ( resid 32 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1059
assign ( resid 26 and name HN ) ( resid 32 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1060
assign ( resid 26 and name HN ) ( resid 25 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1061
assign ( resid 26 and name HN ) ( resid 25 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1062
assign ( resid 26 and name HN ) ( resid 25 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1063
assign ( resid 26 and name HN ) ( resid 25 and name HN or resid 31 and name 
HN or resid 32 and name HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1066
assign ( resid 26 and name HN ) ( resid 26 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1067
assign ( resid 26 and name HN ) ( resid 31 and name HB or resid 32 and name 
HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1068
assign ( resid 82 and name HN ) ( resid 81 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1072
assign ( resid 82 and name HN ) ( resid 83 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1074
assign ( resid 82 and name HN ) ( resid 82 and name HA or resid 81 and name 
HA ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1076
assign ( resid 82 and name HN ) ( resid 80 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1077
assign ( resid 82 and name HN ) ( resid 79 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1078
assign ( resid 82 and name HN ) ( resid 83 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1079
assign ( resid 82 and name HN ) ( resid 81 and name HB1 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1081
assign ( resid 82 and name HN ) ( resid 83 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1082
assign ( resid 82 and name HN ) ( resid 77 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1083
assign ( resid 82 and name HN ) ( resid 82 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1084
assign ( resid 82 and name HN ) ( resid 82 and name HD# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1085
assign ( resid 82 and name HN ) ( resid 82 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1086
assign ( resid 82 and name HN ) ( resid 82 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1087
assign ( resid 33 and name HN ) ( resid 34 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1089
assign ( resid 33 and name HN ) ( resid 32 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1090
assign ( resid 33 and name HN ) ( resid 33 and name HA# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1092
assign ( resid 33 and name HN ) ( resid 33 and name HA# or resid 32 and name 
HA ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1093
assign ( resid 33 and name HN ) ( resid 23 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1094
assign ( resid 33 and name HN ) ( resid 32 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1095
assign ( resid 33 and name HN ) ( resid 32 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1096
assign ( resid 33 and name HN ) ( resid 32 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1097
assign ( resid 33 and name HN ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1098
assign ( resid 44 and name HD2# ) ( resid 45 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1102
assign ( resid 44 and name HD2# ) ( resid 44 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1105
assign ( resid 71 and name HN ) ( resid 70 and name HG# or resid 70 and name 
HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1114
assign ( resid 71 and name HN ) ( resid 72 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1116
assign ( resid 71 and name HN ) ( resid 73 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1118
assign ( resid 71 and name HN ) ( resid 71 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1121
assign ( resid 71 and name HN ) ( resid 71 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1122
assign ( resid 71 and name HN ) ( resid 71 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1123
assign ( resid 71 and name HN ) ( resid 71 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1124
assign ( resid 71 and name HN ) ( resid 71 and name HB# or resid 70 and name 
HG# ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1125
assign ( resid 45 and name HN ) ( resid 46 and name HN or resid 42 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1131
assign ( resid 45 and name HN ) ( resid 45 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1136
assign ( resid 45 and name HN ) ( resid 44 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1137
assign ( resid 45 and name HN ) ( resid 45 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1139
assign ( resid 45 and name HN ) ( resid 44 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1140
assign ( resid 45 and name HN ) ( resid 45 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1142
assign ( resid 45 and name HN ) ( resid 42 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1143
assign ( resid 45 and name HN ) ( resid 42 and name HG21 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1144
assign ( resid 71 and name HE2# ) ( resid 71 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1151
assign ( resid 71 and name HE2# ) ( resid 71 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1154
assign ( resid 71 and name HE2# ) ( resid 71 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1155
assign ( resid 71 and name HE2# ) ( resid 70 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1161
assign ( resid 71 and name HE2# ) ( resid 71 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1169
assign ( resid 25 and name HN ) ( resid 26 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1177
assign ( resid 25 and name HN ) ( resid 64 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1178
assign ( resid 25 and name HN ) ( resid 24 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1179
assign ( resid 25 and name HN ) ( resid 63 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1185
assign ( resid 25 and name HN ) ( resid 25 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1187
assign ( resid 25 and name HN ) ( resid 23 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1188
assign ( resid 25 and name HN ) ( resid 24 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1189
assign ( resid 25 and name HN ) ( resid 23 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1191
assign ( resid 25 and name HN ) ( resid 25 and name HB# or resid 64 and name 
HB ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1192
assign ( resid 25 and name HN ) ( resid 25 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1193
assign ( resid 25 and name HN ) ( resid 25 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1194
assign ( resid 25 and name HN ) ( resid 64 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1195
assign ( resid 25 and name HN ) ( resid 63 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1196
assign ( resid 25 and name HN ) ( resid 23 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1197
assign ( resid 25 and name HN ) ( resid 24 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1198
assign ( resid 25 and name HN ) ( resid 64 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1200
assign ( resid 25 and name HN ) ( resid 33 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1201
assign ( resid 25 and name HN ) ( resid 26 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1202
assign ( resid 25 and name HN ) ( resid 32 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1203
assign ( resid 10 and name HD2# ) ( resid 10 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1206
assign ( resid 31 and name HN ) ( resid 28 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1210
assign ( resid 31 and name HN ) ( resid 30 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1211
assign ( resid 31 and name HN ) ( resid 30 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1212
assign ( resid 10 and name HD2# ) ( resid 10 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1215
assign ( resid 25 and name HN ) ( resid 32 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1218
assign ( resid 31 and name HN ) ( resid 31 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1219
assign ( resid 31 and name HN ) ( resid 31 and name HG2# or resid 31 and 
name HD11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1220
assign ( resid 31 and name HN ) ( resid 30 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1221
assign ( resid 31 and name HN ) ( resid 31 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1224
assign ( resid 31 and name HN ) ( resid 30 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1225
assign ( resid 31 and name HN or resid 25 and name HN ) ( resid 29 and name 
HA or resid 23 and name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1226
assign ( resid 31 and name HN ) ( resid 29 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1228
assign ( resid 31 and name HN ) ( resid 31 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1229
assign ( resid 31 and name HN ) ( resid 31 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1230
assign ( resid 32 and name HE2# ) ( resid 23 and name HA or resid 59 and 
name HD# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1248
assign ( resid 32 and name HE2# ) ( resid 32 and name HG# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1249
assign ( resid 32 and name HE2# ) ( resid 32 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1250
assign ( resid 32 and name HE2# ) ( resid 32 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1251
assign ( resid 32 and name HE2# ) ( resid 32 and name HG# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1260
assign ( resid 53 and name HN ) ( resid 50 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1270
assign ( resid 53 and name HN ) ( resid 51 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1271
assign ( resid 53 and name HN ) ( resid 54 and name HN or resid 52 and name 
HN ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1276
assign ( resid 53 and name HN ) ( resid 52 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1277
assign ( resid 53 and name HN ) ( resid 53 and name HA# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1278
assign ( resid 53 and name HN ) ( resid 53 and name HA# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1279
assign ( resid 53 and name HN ) ( resid 52 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1280
assign ( resid 53 and name HN ) ( resid 52 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1281
assign ( resid 53 and name HN ) ( resid 49 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1282
assign ( resid 53 and name HN ) ( resid 50 and name HE1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1283
assign ( resid 53 and name HN ) ( resid 54 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1284
assign ( resid 62 and name HN ) ( resid 61 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1286
assign ( resid 62 and name HN ) ( resid 63 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1287
assign ( resid 62 and name HN ) ( resid 62 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1291
assign ( resid 62 and name HN ) ( resid 61 and name HA# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1292
assign ( resid 62 and name HN ) ( resid 61 and name HA# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1293
assign ( resid 62 and name HN ) ( resid 59 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1294
assign ( resid 62 and name HN ) ( resid 62 and name HB ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1295
assign ( resid 62 and name HN ) ( resid 59 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1296
assign ( resid 62 and name HN ) ( resid 62 and name HG11 ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1297
assign ( resid 62 and name HN ) ( resid 62 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1298
assign ( resid 62 and name HN ) ( resid 27 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1299
assign ( resid 62 and name HN ) ( resid 62 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1300
assign ( resid 62 and name HN ) ( resid 63 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1301
assign ( resid 62 and name HN ) ( resid 62 and name HD11 ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1306
assign ( resid 36 and name HN ) ( resid 21 and name HN ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1308
assign ( resid 36 and name HN ) ( resid 35 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1315
assign ( resid 36 and name HN ) ( resid 35 and name HA ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1316
assign ( resid 36 and name HN ) ( resid 22 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1319
assign ( resid 36 and name HN ) ( resid 20 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1320
assign ( resid 36 and name HN ) ( resid 36 and name HA# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1321
assign ( resid 36 and name HN ) ( resid 36 and name HA# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1322
assign ( resid 36 and name HN ) ( resid 35 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1324
assign ( resid 36 and name HN ) ( resid 35 and name HB# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1325
assign ( resid 36 and name HN ) ( resid 22 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1327
assign ( resid 36 and name HN ) ( resid 34 and name HG2# or resid 21 and 
name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1330
assign ( resid 36 and name HN ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1331
assign ( resid 36 and name HN ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1332
assign ( resid 72 and name HN ) ( resid 69 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1335
assign ( resid 72 and name HN ) ( resid 71 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1342
assign ( resid 72 and name HN ) ( resid 73 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1343
assign ( resid 72 and name HN ) ( resid 69 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1346
assign ( resid 72 and name HN ) ( resid 72 and name HA# or resid 71 and name 
HA ) 2.30 0.50 0.50 !FROM PEAK NUMBER:  1348
assign ( resid 72 and name HN ) ( resid 72 and name HA# ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1349
assign ( resid 72 and name HN ) ( resid 68 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1350
assign ( resid 72 and name HN ) ( resid 71 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1351
assign ( resid 72 and name HN ) ( resid 71 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1352
assign ( resid 72 and name HN ) ( resid 71 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1353
assign ( resid 72 and name HN ) ( resid 73 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1354
assign ( resid 72 and name HN ) ( resid 71 and name HB# ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1355
assign ( resid 72 and name HN ) ( resid 70 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1356
assign ( resid 72 and name HN ) ( resid 68 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1357
assign ( resid 72 and name HN ) ( resid 68 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1358
assign ( resid 72 and name HN ) ( resid 68 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1359
assign ( resid 72 and name HN ) ( resid 69 and name HG1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1360
assign ( resid 61 and name HN ) ( resid 63 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1372
assign ( resid 61 and name HN ) ( resid 45 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1375
assign ( resid 61 and name HN ) ( resid 44 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1376
assign ( resid 61 and name HN ) ( resid 59 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1380
assign ( resid 61 and name HN ) ( resid 62 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1385
assign ( resid 24 and name HN ) ( resid 23 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1387
assign ( resid 24 and name HN ) ( resid 65 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1388
assign ( resid 24 and name HN ) ( resid 65 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1390
assign ( resid 24 and name HN ) ( resid 23 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1391
assign ( resid 24 and name HN ) ( resid 32 and name HG# or resid 65 and name 
HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1392
assign ( resid 24 and name HN ) ( resid 64 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1393
assign ( resid 24 and name HN ) ( resid 25 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1394
assign ( resid 24 and name HN ) ( resid 22 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1395
assign ( resid 24 and name HN ) ( resid 23 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1396
assign ( resid 24 and name HN ) ( resid 23 and name HG12 or resid 64 and 
name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1397
assign ( resid 24 and name HN ) ( resid 23 and name HD11 or resid 64 and 
name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1398
assign ( resid 24 and name HN ) ( resid 63 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1399
assign ( resid 48 and name HN ) ( resid 57 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1401
assign ( resid 76 and name HN ) ( resid 66 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1403
assign ( resid 76 and name HN ) ( resid 77 and name HN or resid 67 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1406
assign ( resid 76 and name HN ) ( resid 75 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1407
assign ( resid 84 and name HN ) ( resid 83 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1408
assign ( resid 84 and name HN ) ( resid 83 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1409
assign ( resid 84 and name HN ) ( resid 83 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1411
assign ( resid 49 and name HN ) ( resid 36 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1415
assign ( resid 49 and name HN ) ( resid 55 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1416
assign ( resid 49 and name HN ) ( resid 50 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1417
assign ( resid 77 and name HN ) ( resid 76 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1418
assign ( resid 77 and name HN ) ( resid 67 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1419
assign ( resid 77 and name HN ) ( resid 66 and name HB# or resid 65 and name 
HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1420
assign ( resid 77 and name HN ) ( resid 65 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1421
assign ( resid 77 and name HN ) ( resid 77 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1422
assign ( resid 58 and name HN ) ( resid 48 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1423
assign ( resid 23 and name HN ) ( resid 36 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1424
assign ( resid 23 and name HN ) ( resid 22 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1425
assign ( resid 23 and name HN ) ( resid 24 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1426
assign ( resid 23 and name HN ) ( resid 35 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1427
assign ( resid 23 and name HN ) ( resid 22 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1428
assign ( resid 23 and name HN ) ( resid 34 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1429
assign ( resid 23 and name HN ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1430
assign ( resid 75 and name HN ) ( resid 66 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1431
assign ( resid 75 and name HN ) ( resid 67 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1432
assign ( resid 75 and name HN ) ( resid 68 and name HD# or resid 66 and name 
HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1433
assign ( resid 96 and name HN ) ( resid 96 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1434
assign ( resid 96 and name HN ) ( resid 96 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1435
assign ( resid 96 and name HN ) ( resid 96 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1436
assign ( resid 65 and name HN ) ( resid 77 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1439
assign ( resid 65 and name HN ) ( resid 23 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1440
assign ( resid 65 and name HN ) ( resid 65 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1442
assign ( resid 65 and name HN ) ( resid 64 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1443
assign ( resid 51 and name HN ) ( resid 36 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1445
assign ( resid 51 and name HN ) ( resid 53 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1446
assign ( resid 51 and name HN ) ( resid 50 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1447
assign ( resid 51 and name HN ) ( resid 50 and name HE1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1448
assign ( resid 66 and name HN ) ( resid 21 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1451
assign ( resid 66 and name HN ) ( resid 65 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1452
assign ( resid 66 and name HN ) ( resid 22 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1453
assign ( resid 66 and name HN ) ( resid 22 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1454
assign ( resid 66 and name HN ) ( resid 23 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1455
assign ( resid 7 and name HN ) ( resid 6 and name HB ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  1457
assign ( resid 64 and name HN ) ( resid 65 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1461
assign ( resid 64 and name HN ) ( resid 78 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1462
assign ( resid 64 and name HN ) ( resid 23 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1463
assign ( resid 64 and name HN ) ( resid 79 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1464
assign ( resid 64 and name HN ) ( resid 26 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1465
assign ( resid 64 and name HN ) ( resid 24 and name HB1 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1467
assign ( resid 40 and name HN ) ( resid 47 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1469
assign ( resid 40 and name HN ) ( resid 38 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1470
assign ( resid 79 and name HN ) ( resid 64 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1471
assign ( resid 79 and name HN ) ( resid 77 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1472
assign ( resid 79 and name HN ) ( resid 78 and name HB# or resid 65 and name 
HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1473
assign ( resid 79 and name HN ) ( resid 78 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1474
assign ( resid 79 and name HN ) ( resid 78 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1475
assign ( resid 26 and name HN ) ( resid 27 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1476
assign ( resid 26 and name HN ) ( resid 32 and name HE2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1477
assign ( resid 26 and name HN ) ( resid 63 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1478
assign ( resid 26 and name HN ) ( resid 32 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1480
assign ( resid 82 and name HN ) ( resid 80 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1483
assign ( resid 82 and name HN ) ( resid 83 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1484
assign ( resid 82 and name HN ) ( resid 80 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1485
assign ( resid 33 and name HN ) ( resid 34 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1488
assign ( resid 33 and name HN ) ( resid 34 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1489
assign ( resid 71 and name HN ) ( resid 69 and name HG21 or resid 69 and 
name HG1 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1491
assign ( resid 71 and name HN ) ( resid 70 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1493
assign ( resid 71 and name HN ) ( resid 70 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1494
assign ( resid 71 and name HN ) ( resid 72 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1495
assign ( resid 71 and name HN ) ( resid 69 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1496
assign ( resid 71 and name HE2# ) ( resid 71 and name HB# or resid 70 and 
name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1497
assign ( resid 71 and name HE2# ) ( resid 70 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1498
assign ( resid 71 and name HE2# ) ( resid 71 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1499
assign ( resid 71 and name HE2# ) ( resid 71 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1500
assign ( resid 45 and name HN ) ( resid 60 and name HN or resid 61 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1503
assign ( resid 30 and name HN ) ( resid 31 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1507
assign ( resid 30 and name HN ) ( resid 28 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1508
assign ( resid 31 and name HN ) ( resid 29 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1510
assign ( resid 10 and name HD2# ) ( resid 10 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1511
assign ( resid 10 and name HD2# ) ( resid 10 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1512
assign ( resid 10 and name HD2# ) ( resid 11 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1513
assign ( resid 32 and name HE2# ) ( resid 58 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1514
assign ( resid 32 and name HE2# ) ( resid 25 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1515
assign ( resid 32 and name HE2# ) ( resid 26 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1516
assign ( resid 32 and name HE2# ) ( resid 25 and name HA or resid 59 and 
name HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1517
assign ( resid 32 and name HE2# ) ( resid 23 and name HA or resid 59 and 
name HD# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1518
assign ( resid 32 and name HE2# ) ( resid 32 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1519
assign ( resid 32 and name HE2# ) ( resid 32 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1520
assign ( resid 53 and name HN ) ( resid 50 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1522
assign ( resid 53 and name HN ) ( resid 50 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1524
assign ( resid 53 and name HN ) ( resid 54 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1525
assign ( resid 62 and name HN ) ( resid 63 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1527
assign ( resid 62 and name HN ) ( resid 26 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1528
assign ( resid 62 and name HN ) ( resid 80 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1529
assign ( resid 36 and name HN ) ( resid 23 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1530
assign ( resid 36 and name HN ) ( resid 22 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1532
assign ( resid 36 and name HN ) ( resid 23 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1533
assign ( resid 23 and name HN ) ( resid 35 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1537
assign ( resid 23 and name HN ) ( resid 65 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1538
assign ( resid 23 and name HN ) ( resid 34 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1539
assign ( resid 23 and name HN ) ( resid 33 and name HA# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1541
assign ( resid 23 and name HN ) ( resid 21 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1542
assign ( resid 50 and name HN ) ( resid 53 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1544
assign ( resid 50 and name HN ) ( resid 54 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1545
assign ( resid 50 and name HN ) ( resid 54 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1546
assign ( resid 50 and name HN ) ( resid 54 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1547
assign ( resid 50 and name HN ) ( resid 48 and name HB or resid 54 and name 
HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1548
assign ( resid 50 and name HN ) ( resid 56 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1549
assign ( resid 50 and name HN ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1550
assign ( resid 76 and name HN ) ( resid 77 and name HG11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1551
assign ( resid 76 and name HN ) ( resid 77 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1552
assign ( resid 49 and name HN ) ( resid 47 and name HA or resid 37 and name 
HA ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1554
assign ( resid 50 and name HN ) ( resid 51 and name HN or resid 56 and name 
HN ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1555
assign ( resid 49 and name HN ) ( resid 56 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1557
assign ( resid 49 and name HN ) ( resid 37 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1560
assign ( resid 11 and name HN ) ( resid 10 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1569
assign ( resid 11 and name HN ) ( resid 10 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1570
assign ( resid 64 and name HN ) ( resid 32 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1574
assign ( resid 79 and name HN ) ( resid 77 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1575
assign ( resid 79 and name HN ) ( resid 80 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1576
assign ( resid 79 and name HN ) ( resid 63 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1577
assign ( resid 79 and name HN ) ( resid 81 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1578
assign ( resid 26 and name HN ) ( resid 32 and name HE2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1580
assign ( resid 26 and name HN ) ( resid 64 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1583
assign ( resid 26 and name HN ) ( resid 27 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1584
assign ( resid 26 and name HN ) ( resid 25 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1585
assign ( resid 82 and name HN ) ( resid 80 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1589
assign ( resid 33 and name HN ) ( resid 34 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1592
assign ( resid 33 and name HN ) ( resid 58 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1594
assign ( resid 60 and name HN ) ( resid 59 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1598
assign ( resid 38 and name HN ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1599
assign ( resid 48 and name HN ) ( resid 55 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1602
assign ( resid 48 and name HN ) ( resid 47 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1603
assign ( resid 48 and name HN ) ( resid 47 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1604
assign ( resid 63 and name HN ) ( resid 80 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1605
assign ( resid 27 and name HN ) ( resid 62 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1607
assign ( resid 27 and name HN ) ( resid 26 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1609
assign ( resid 27 and name HN ) ( resid 62 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1610
assign ( resid 27 and name HN ) ( resid 26 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1611
assign ( resid 78 and name HN ) ( resid 64 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1615
assign ( resid 48 and name HN ) ( resid 39 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1619
assign ( resid 84 and name HN ) ( resid 43 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1623
assign ( resid 58 and name HN ) ( resid 56 and name HG11 or resid 48 and 
name HG11 or resid 46 and name HB# or resid 34 and name HG11 ) 3.40 1.60 
1.60 !FROM PEAK NUMBER:  1624
assign ( resid 74 and name HN ) ( resid 75 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1625
assign ( resid 22 and name HN ) ( resid 35 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1626
assign ( resid 22 and name HN ) ( resid 67 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1627
assign ( resid 22 and name HN ) ( resid 68 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1628
assign ( resid 22 and name HN ) ( resid 23 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1631
assign ( resid 91 and name HN ) ( resid 91 and name HG# or resid 90 and name 
HG11 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1633
assign ( resid 91 and name HN ) ( resid 91 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1634
assign ( resid 91 and name HN ) ( resid 91 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1636
assign ( resid 91 and name HN ) ( resid 90 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1637
assign ( resid 38 and name HN ) ( resid 37 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1638
assign ( resid 60 and name HN ) ( resid 45 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1639
assign ( resid 60 and name HN ) ( resid 44 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1640
assign ( resid 60 and name HN ) ( resid 60 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1642
assign ( resid 60 and name HN ) ( resid 60 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1643
assign ( resid 47 and name HN ) ( resid 39 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1645
assign ( resid 47 and name HN ) ( resid 48 and name HD11 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1646
assign ( resid 47 and name HN ) ( resid 46 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1647
assign ( resid 6 and name HN ) ( resid 7 and name HN ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  1648
assign ( resid 6 and name HN ) ( resid 4 and name HE1 or resid 4 and name 
HB# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1649
assign ( resid 6 and name HN ) ( resid 4 and name HB# ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  1650
assign ( resid 6 and name HN ) ( resid 7 and name HG21 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1651
assign ( resid 67 and name HN ) ( resid 68 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1652
assign ( resid 67 and name HN ) ( resid 21 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1653
assign ( resid 67 and name HN ) ( resid 76 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1654
assign ( resid 39 and name HN ) ( resid 47 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1655
assign ( resid 39 and name HN ) ( resid 37 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1656
assign ( resid 21 and name HN ) ( resid 38 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1657
assign ( resid 21 and name HN ) ( resid 37 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1659
assign ( resid 21 and name HN ) ( resid 22 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1661
assign ( resid 67 and name HN ) ( resid 74 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1662
assign ( resid 39 and name HN ) ( resid 40 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1663
assign ( resid 39 and name HN ) ( resid 38 and name HB ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1664
assign ( resid 39 and name HN ) ( resid 37 and name HG# or resid 47 and name 
HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1665
assign ( resid 39 and name HN ) ( resid 48 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1666
assign ( resid 92 and name HN ) ( resid 91 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1670
assign ( resid 92 and name HN ) ( resid 91 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1671
assign ( resid 93 and name HN ) ( resid 90 and name HG2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1672
assign ( resid 51 and name HN ) ( resid 37 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1680
assign ( resid 66 and name HN ) ( resid 67 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1684
assign ( resid 7 and name HN ) ( resid 6 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1685
assign ( resid 66 and name HN ) ( resid 65 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1686
assign ( resid 43 and name HN ) ( resid 43 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1691
assign ( resid 79 and name HN ) ( resid 65 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1699
assign ( resid 79 and name HN ) ( resid 77 and name HD11 or resid 63 and 
name HB1 ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1702
assign ( resid 42 and name HN or resid 20 and name HN ) ( resid 41 and name 
HB# or resid 37 and name HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1703
assign ( resid 42 and name HN or resid 20 and name HN ) ( resid 45 and name 
HA or resid 37 and name HA or resid 67 and name HA ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  1704
assign ( resid 52 and name HN ) ( resid 50 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1705
assign ( resid 33 and name HN ) ( resid 58 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1716
assign ( resid 31 and name HN ) ( resid 26 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1719
assign ( resid 57 and name HN ) ( resid 47 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1720
assign ( resid 32 and name HN ) ( resid 25 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1724
assign ( resid 34 and name HN ) ( resid 23 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1726
assign ( resid 24 and name HN ) ( resid 64 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1728
assign ( resid 24 and name HN ) ( resid 64 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1730
assign ( resid 28 and name HN ) ( resid 27 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1733
assign ( resid 54 and name HN ) ( resid 53 and name HN ) 2.30 0.50 0.50 
!FROM PEAK NUMBER:  1734
assign ( resid 78 and name HN ) ( resid 65 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1737
assign ( resid 48 and name HN ) ( resid 57 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1739
assign ( resid 75 and name HN ) ( resid 67 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1741
assign ( resid 22 and name HN ) ( resid 65 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1744
assign ( resid 22 and name HN ) ( resid 22 and name HA ) 2.60 0.80 0.80 
!FROM PEAK NUMBER:  1745
assign ( resid 60 and name HN ) ( resid 60 and name HE# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1753
assign ( resid 60 and name HN ) ( resid 62 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1754
assign ( resid 83 and name HN ) ( resid 82 and name HD# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1759
assign ( resid 27 and name HN ) ( resid 32 and name HE2# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1760
assign ( resid 94 and name HN ) ( resid 94 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1761
assign ( resid 94 and name HN ) ( resid 94 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1762
assign ( resid 94 and name HN ) ( resid 93 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1763
assign ( resid 66 and name HN ) ( resid 22 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1768
assign ( resid 66 and name HN ) ( resid 23 and name HG12 ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1769
assign ( resid 73 and name HN ) ( resid 74 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1772
assign ( resid 56 and name HN ) ( resid 47 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1774
assign ( resid 56 and name HN ) ( resid 49 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1775
assign ( resid 40 and name HN ) ( resid 47 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1776
assign ( resid 40 and name HN ) ( resid 47 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1777
assign ( resid 60 and name HN ) ( resid 46 and name HB# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1782
assign ( resid 60 and name HN ) ( resid 60 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1783
assign ( resid 47 and name HN ) ( resid 41 and name HN ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1788
assign ( resid 9 and name HN ) ( resid 9 and name HB# or resid 9 and name 
HG# ) 3.40 1.60 1.60 !FROM PEAK NUMBER:  1795
assign ( resid 9 and name HN ) ( resid 9 and name HB# ) 3.40 1.60 1.60 !FROM 
PEAK NUMBER:  1796
assign ( resid 22 and name HN ) ( resid 22 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1805
assign ( resid 22 and name HN ) ( resid 22 and name HG# ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1807
assign ( resid 47 and name HN ) ( resid 38 and name HA ) 3.40 1.60 1.60 
!FROM PEAK NUMBER:  1808


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    ARG   9           H        ARG   9 -10.122 -14.557  -2.476
    2    HA   ARG   9           HA       ARG   9  -9.001 -12.987  -0.295
    3   1HB   ARG   9          2HB       ARG   9  -7.996 -13.472  -3.106
    4   2HB   ARG   9          1HB       ARG   9  -7.129 -12.576  -1.866
    5   1HG   ARG   9          2HG       ARG   9  -7.047 -14.594  -0.478
    6   2HG   ARG   9          1HG       ARG   9  -7.889 -15.488  -1.744
    7   1HD   ARG   9          2HD       ARG   9  -6.046 -15.043  -3.287
    8   2HD   ARG   9          1HD       ARG   9  -5.210 -14.130  -2.031
    9    HE   ARG   9           HE       ARG   9  -5.755 -16.697  -1.054
   10   1HH1  ARG   9          1HH1      ARG   9  -3.768 -15.143  -3.464
   11   2HH1  ARG   9          2HH1      ARG   9  -2.529 -16.352  -3.402
   12   1HH2  ARG   9          1HH2      ARG   9  -4.128 -18.287  -0.971
   13   2HH2  ARG   9          2HH2      ARG   9  -2.733 -18.136  -1.986
   14    H    HIS  10           H        HIS  10  -9.973 -12.408  -3.684
   15    HA   HIS  10           HA       HIS  10 -10.825 -10.568  -4.723
   16   1HB   HIS  10          2HB       HIS  10 -12.477 -10.678  -2.854
   17   2HB   HIS  10          1HB       HIS  10 -11.447  -9.597  -1.923
   18    HD1  HIS  10           1HD      HIS  10 -13.886  -8.269  -2.052
   19    HD2  HIS  10           2HD      HIS  10 -11.500  -8.302  -5.453
   20    HE1  HIS  10           1HE      HIS  10 -14.716  -6.370  -3.476
   21    HE2  HIS  10           2HE      HIS  10 -13.198  -6.354  -5.485
   22    H    GLU  11           H        GLU  11  -9.791  -8.883  -5.626
   23    HA   GLU  11           HA       GLU  11  -7.266  -8.068  -4.898
   24   1HB   GLU  11          2HB       GLU  11  -9.322  -6.450  -6.415
   25   2HB   GLU  11          1HB       GLU  11  -7.588  -6.160  -6.416
   26   1HG   GLU  11          2HG       GLU  11  -8.961  -8.631  -7.452
   27   2HG   GLU  11          1HG       GLU  11  -8.319  -7.314  -8.433
   28    H    LEU  12           H        LEU  12  -6.915  -5.454  -4.676
   29    HA   LEU  12           HA       LEU  12  -8.451  -4.624  -2.308
   30   1HB   LEU  12          2HB       LEU  12  -6.455  -3.787  -1.251
   31   2HB   LEU  12          1HB       LEU  12  -6.256  -5.489  -1.620
   32    HG   LEU  12           HG       LEU  12  -5.096  -3.239  -3.265
   33   1HD1  LEU  12          1HD1      LEU  12  -3.020  -4.661  -2.136
   34   2HD1  LEU  12          2HD1      LEU  12  -4.185  -4.520  -0.820
   35   3HD1  LEU  12          3HD1      LEU  12  -3.589  -3.071  -1.632
   36   1HD2  LEU  12          1HD2      LEU  12  -5.262  -6.153  -3.593
   37   2HD2  LEU  12          2HD2      LEU  12  -3.654  -5.466  -3.828
   38   3HD2  LEU  12          3HD2      LEU  12  -5.010  -4.886  -4.793
   39    H    ILE  13           H        ILE  13  -8.717  -3.864  -5.125
   40    HA   ILE  13           HA       ILE  13  -7.656  -1.183  -5.316
   41    HB   ILE  13           HB       ILE  13  -9.648  -2.595  -7.099
   42   1HG1  ILE  13          2HG1      ILE  13  -6.659  -2.207  -7.389
   43   2HG1  ILE  13          1HG1      ILE  13  -7.473  -3.729  -7.043
   44   1HG2  ILE  13          1HG2      ILE  13  -9.928  -0.307  -7.502
   45   2HG2  ILE  13          2HG2      ILE  13  -8.798  -0.831  -8.750
   46   3HG2  ILE  13          3HG2      ILE  13  -8.206   0.027  -7.327
   47   1HD1  ILE  13          1HD1      ILE  13  -7.475  -2.142  -9.581
   48   2HD1  ILE  13          2HD1      ILE  13  -8.686  -3.382  -9.256
   49   3HD1  ILE  13          3HD1      ILE  13  -6.976  -3.812  -9.318
   50    H    GLY  14           H        GLY  14  -8.528   0.224  -3.900
   51   1HA   GLY  14          2HA       GLY  14 -10.396   1.832  -3.792
   52   2HA   GLY  14          1HA       GLY  14 -11.476   0.447  -3.877
   53    H    LEU  15           H        LEU  15  -9.585  -1.042  -2.039
   54    HA   LEU  15           HA       LEU  15 -10.933  -0.606   0.368
   55   1HB   LEU  15          2HB       LEU  15  -8.179  -1.791   0.008
   56   2HB   LEU  15          1HB       LEU  15  -9.227  -2.011   1.396
   57    HG   LEU  15           HG       LEU  15  -9.738  -3.033  -1.397
   58   1HD1  LEU  15          1HD1      LEU  15  -9.286  -4.629   1.106
   59   2HD1  LEU  15          2HD1      LEU  15  -7.964  -4.146   0.043
   60   3HD1  LEU  15          3HD1      LEU  15  -9.259  -5.177  -0.570
   61   1HD2  LEU  15          1HD2      LEU  15 -11.789  -2.341  -0.154
   62   2HD2  LEU  15          2HD2      LEU  15 -11.354  -3.500   1.104
   63   3HD2  LEU  15          3HD2      LEU  15 -11.716  -4.063  -0.528
   64    H    SER  16           H        SER  16  -9.872   0.002   2.467
   65    HA   SER  16           HA       SER  16  -8.532   2.569   2.129
   66   1HB   SER  16          2HB       SER  16  -9.613   1.231   4.627
   67   2HB   SER  16          1HB       SER  16  -8.985   2.877   4.534
   68    HG   SER  16           HG       SER  16 -10.682   3.166   2.864
   69    H    VAL  17           H        VAL  17  -6.522   3.067   3.098
   70    HA   VAL  17           HA       VAL  17  -5.035   0.885   4.325
   71    HB   VAL  17           HB       VAL  17  -4.557   0.541   1.988
   72   1HG1  VAL  17          1HG1      VAL  17  -3.276   2.450   0.796
   73   2HG1  VAL  17          2HG1      VAL  17  -4.066   3.489   1.981
   74   3HG1  VAL  17          3HG1      VAL  17  -5.039   2.511   0.880
   75   1HG2  VAL  17          1HG2      VAL  17  -2.095   0.885   1.986
   76   2HG2  VAL  17          2HG2      VAL  17  -2.706   0.147   3.466
   77   3HG2  VAL  17          3HG2      VAL  17  -2.269   1.856   3.448
   78    H    ARG  18           H        ARG  18  -3.605   1.558   5.821
   79    HA   ARG  18           HA       ARG  18  -3.042   4.450   5.962
   80   1HB   ARG  18          2HB       ARG  18  -3.520   2.555   8.268
   81   2HB   ARG  18          1HB       ARG  18  -3.076   4.249   8.418
   82   1HG   ARG  18          2HG       ARG  18  -5.164   4.894   7.323
   83   2HG   ARG  18          1HG       ARG  18  -5.610   3.192   7.179
   84   1HD   ARG  18          2HD       ARG  18  -6.717   4.222   9.089
   85   2HD   ARG  18          1HD       ARG  18  -5.585   2.977   9.613
   86    HE   ARG  18           HE       ARG  18  -4.260   5.440   9.638
   87   1HH1  ARG  18          1HH1      ARG  18  -6.844   3.807  11.321
   88   2HH1  ARG  18          2HH1      ARG  18  -6.590   4.668  12.802
   89   1HH2  ARG  18          1HH2      ARG  18  -3.925   6.571  11.587
   90   2HH2  ARG  18          2HH2      ARG  18  -4.932   6.237  12.954
   91    H    ILE  19           H        ILE  19  -0.975   5.051   6.229
   92    HA   ILE  19           HA       ILE  19   1.043   2.933   6.348
   93    HB   ILE  19           HB       ILE  19   1.310   5.849   5.590
   94   1HG1  ILE  19          2HG1      ILE  19   1.731   4.947   3.313
   95   2HG1  ILE  19          1HG1      ILE  19   1.364   3.332   3.906
   96   1HG2  ILE  19          1HG2      ILE  19   3.299   4.071   6.471
   97   2HG2  ILE  19          2HG2      ILE  19   3.516   5.659   5.736
   98   3HG2  ILE  19          3HG2      ILE  19   3.496   4.213   4.726
   99   1HD1  ILE  19          1HD1      ILE  19  -0.912   3.819   4.166
  100   2HD1  ILE  19          2HD1      ILE  19  -0.474   4.606   2.650
  101   3HD1  ILE  19          3HD1      ILE  19  -0.636   5.560   4.124
  102    H    ALA  20           H        ALA  20   2.506   2.755   7.964
  103    HA   ALA  20           HA       ALA  20   2.137   4.499  10.287
  104   1HB   ALA  20          1HB       ALA  20   2.609   2.736  11.604
  105   2HB   ALA  20          2HB       ALA  20   3.902   2.165  10.550
  106   3HB   ALA  20          3HB       ALA  20   2.222   1.798  10.162
  107    H    ARG  21           H        ARG  21   4.473   3.501   7.933
  108    HA   ARG  21           HA       ARG  21   6.122   5.750   8.399
  109   1HB   ARG  21          2HB       ARG  21   8.176   4.564   9.072
  110   2HB   ARG  21          1HB       ARG  21   6.917   4.454  10.294
  111   1HG   ARG  21          2HG       ARG  21   6.379   2.197   9.549
  112   2HG   ARG  21          1HG       ARG  21   7.631   2.305   8.310
  113   1HD   ARG  21          2HD       ARG  21   9.324   2.604  10.062
  114   2HD   ARG  21          1HD       ARG  21   8.068   2.476  11.293
  115    HE   ARG  21           HE       ARG  21   7.961   0.192   9.679
  116   1HH1  ARG  21          1HH1      ARG  21  10.081   1.697  12.008
  117   2HH1  ARG  21          2HH1      ARG  21  10.760   0.196  12.544
  118   1HH2  ARG  21          1HH2      ARG  21   8.856  -1.781  10.382
  119   2HH2  ARG  21          2HH2      ARG  21  10.066  -1.779  11.620
  120    H    SER  22           H        SER  22   7.132   6.254   6.551
  121    HA   SER  22           HA       SER  22   7.541   4.120   4.565
  122   1HB   SER  22          2HB       SER  22   6.444   6.893   4.070
  123   2HB   SER  22          1HB       SER  22   6.887   5.752   2.801
  124    HG   SER  22           HG       SER  22   4.578   5.899   3.688
  125    H    VAL  23           H        VAL  23   9.067   4.736   2.824
  126    HA   VAL  23           HA       VAL  23  11.561   5.413   3.798
  127    HB   VAL  23           HB       VAL  23  11.289   4.226   1.700
  128   1HG1  VAL  23          1HG1      VAL  23  10.522   5.293  -0.325
  129   2HG1  VAL  23          2HG1      VAL  23  10.308   6.824   0.524
  130   3HG1  VAL  23          3HG1      VAL  23   9.282   5.445   0.922
  131   1HG2  VAL  23          1HG2      VAL  23  12.680   6.857   1.204
  132   2HG2  VAL  23          2HG2      VAL  23  12.997   5.323   0.395
  133   3HG2  VAL  23          3HG2      VAL  23  13.370   5.508   2.109
  134    H    HIS  24           H        HIS  24   9.250   7.502   2.076
  135    HA   HIS  24           HA       HIS  24  10.963   9.812   2.617
  136   1HB   HIS  24          2HB       HIS  24   8.479   9.560   0.910
  137   2HB   HIS  24          1HB       HIS  24   9.433  11.029   1.094
  138    HD1  HIS  24           1HD      HIS  24  12.175  10.411   0.509
  139    HD2  HIS  24           2HD      HIS  24   9.128   8.318  -1.386
  140    HE1  HIS  24           1HE      HIS  24  13.214   9.447  -1.568
  141    HE2  HIS  24           2HE      HIS  24  11.372   8.114  -2.654
  142    H    ARG  25           H        ARG  25  10.418  11.437   3.975
  143    HA   ARG  25           HA       ARG  25   8.491  10.941   5.986
  144   1HB   ARG  25          2HB       ARG  25   9.984  13.486   5.341
  145   2HB   ARG  25          1HB       ARG  25   9.094  13.178   6.827
  146   1HG   ARG  25          2HG       ARG  25  10.617  11.349   7.366
  147   2HG   ARG  25          1HG       ARG  25  11.508  11.651   5.872
  148   1HD   ARG  25          2HD       ARG  25  12.051  13.905   6.659
  149   2HD   ARG  25          1HD       ARG  25  11.164  13.598   8.152
  150    HE   ARG  25           HE       ARG  25  13.101  11.603   7.853
  151   1HH1  ARG  25          1HH1      ARG  25  12.909  15.038   8.438
  152   2HH1  ARG  25          2HH1      ARG  25  14.392  15.096   9.330
  153   1HH2  ARG  25          1HH2      ARG  25  15.051  11.676   9.027
  154   2HH2  ARG  25          2HH2      ARG  25  15.609  13.188   9.665
  155    H    ASP  26           H        ASP  26   8.395  12.647   2.986
  156    HA   ASP  26           HA       ASP  26   6.212  14.341   3.478
  157   1HB   ASP  26          2HB       ASP  26   7.091  13.082   0.875
  158   2HB   ASP  26          1HB       ASP  26   5.967  14.429   1.021
  159    H    ILE  27           H        ILE  27   6.407  10.970   2.854
  160    HA   ILE  27           HA       ILE  27   3.500  10.799   2.638
  161    HB   ILE  27           HB       ILE  27   3.830   8.565   1.648
  162   1HG1  ILE  27          2HG1      ILE  27   6.758   9.320   1.784
  163   2HG1  ILE  27          1HG1      ILE  27   5.974   8.009   2.655
  164   1HG2  ILE  27          1HG2      ILE  27   3.486  10.231   0.056
  165   2HG2  ILE  27          2HG2      ILE  27   4.951   9.422  -0.501
  166   3HG2  ILE  27          3HG2      ILE  27   5.062  10.967   0.344
  167   1HD1  ILE  27          1HD1      ILE  27   6.406   8.208  -0.314
  168   2HD1  ILE  27          2HD1      ILE  27   5.451   6.951   0.469
  169   3HD1  ILE  27          3HD1      ILE  27   7.175   7.089   0.809
  170    H    GLN  28           H        GLN  28   6.210  10.045   4.570
  171    HA   GLN  28           HA       GLN  28   5.520   7.754   5.922
  172   1HB   GLN  28          2HB       GLN  28   7.633   8.914   6.275
  173   2HB   GLN  28          1HB       GLN  28   6.796  10.265   7.026
  174   1HG   GLN  28          2HG       GLN  28   6.077   8.795   8.849
  175   2HG   GLN  28          1HG       GLN  28   6.947   7.458   8.099
  176   1HE2  GLN  28          1HE2      GLN  28   8.815   7.058   9.017
  177   2HE2  GLN  28          2HE2      GLN  28   9.873   8.219   9.738
  178    H    GLY  29           H        GLY  29   3.905   7.160   7.205
  179   1HA   GLY  29          2HA       GLY  29   2.218   7.284   8.774
  180   2HA   GLY  29          1HA       GLY  29   2.660   8.960   9.056
  181    H    ILE  30           H        ILE  30   2.022   8.122   5.787
  182    HA   ILE  30           HA       ILE  30  -0.213   9.888   5.706
  183    HB   ILE  30           HB       ILE  30   1.349   9.694   3.811
  184   1HG1  ILE  30          2HG1      ILE  30  -1.482   8.888   3.113
  185   2HG1  ILE  30          1HG1      ILE  30  -0.947  10.531   3.458
  186   1HG2  ILE  30          1HG2      ILE  30   1.997   7.703   3.080
  187   2HG2  ILE  30          2HG2      ILE  30   0.366   7.413   2.476
  188   3HG2  ILE  30          3HG2      ILE  30   0.803   6.910   4.107
  189   1HD1  ILE  30          1HD1      ILE  30  -1.165  10.154   1.064
  190   2HD1  ILE  30          2HD1      ILE  30  -0.019   8.816   1.158
  191   3HD1  ILE  30          3HD1      ILE  30   0.517  10.461   1.500
  192    H    SER  31           H        SER  31  -2.340   9.326   4.897
  193    HA   SER  31           HA       SER  31  -3.139   6.533   5.214
  194   1HB   SER  31          2HB       SER  31  -5.034   7.159   6.672
  195   2HB   SER  31          1HB       SER  31  -3.484   7.520   7.432
  196    HG   SER  31           HG       SER  31  -5.222   9.197   7.464
  197    H    GLY  32           H        GLY  32  -4.811   5.934   3.870
  198   1HA   GLY  32          2HA       GLY  32  -6.714   7.690   2.780
  199   2HA   GLY  32          1HA       GLY  32  -5.374   7.565   1.652
  200    H    ARG  33           H        ARG  33  -6.995   6.686   0.214
  201    HA   ARG  33           HA       ARG  33  -7.717   3.931   0.828
  202   1HB   ARG  33          2HB       ARG  33  -8.934   5.878  -1.071
  203   2HB   ARG  33          1HB       ARG  33  -9.285   4.157  -1.148
  204   1HG   ARG  33          2HG       ARG  33  -9.896   4.292   1.280
  205   2HG   ARG  33          1HG       ARG  33  -9.838   6.047   1.115
  206   1HD   ARG  33          2HD       ARG  33 -11.569   5.948  -0.601
  207   2HD   ARG  33          1HD       ARG  33 -11.598   4.189  -0.484
  208    HE   ARG  33           HE       ARG  33 -12.082   5.297   2.052
  209   1HH1  ARG  33          1HH1      ARG  33 -13.624   4.934  -1.057
  210   2HH1  ARG  33          2HH1      ARG  33 -15.227   4.986  -0.407
  211   1HH2  ARG  33          1HH2      ARG  33 -14.189   5.362   2.908
  212   2HH2  ARG  33          2HH2      ARG  33 -15.550   5.229   1.843
  213    H    VAL  34           H        VAL  34  -7.934   2.563  -1.226
  214    HA   VAL  34           HA       VAL  34  -5.225   2.486  -2.339
  215    HB   VAL  34           HB       VAL  34  -7.271   0.272  -2.257
  216   1HG1  VAL  34          1HG1      VAL  34  -4.384   0.381  -3.083
  217   2HG1  VAL  34          2HG1      VAL  34  -5.769  -0.229  -3.990
  218   3HG1  VAL  34          3HG1      VAL  34  -5.164  -1.124  -2.596
  219   1HG2  VAL  34          1HG2      VAL  34  -4.833   0.353  -0.540
  220   2HG2  VAL  34          2HG2      VAL  34  -6.364  -0.488  -0.286
  221   3HG2  VAL  34          3HG2      VAL  34  -6.267   1.257  -0.051
  222    H    VAL  35           H        VAL  35  -4.807   1.870  -4.514
  223    HA   VAL  35           HA       VAL  35  -7.061   2.088  -6.349
  224    HB   VAL  35           HB       VAL  35  -5.775   4.320  -6.129
  225   1HG1  VAL  35          1HG1      VAL  35  -3.923   4.548  -7.725
  226   2HG1  VAL  35          2HG1      VAL  35  -3.871   2.792  -7.854
  227   3HG1  VAL  35          3HG1      VAL  35  -3.550   3.576  -6.311
  228   1HG2  VAL  35          1HG2      VAL  35  -7.493   3.699  -7.836
  229   2HG2  VAL  35          2HG2      VAL  35  -6.171   3.197  -8.889
  230   3HG2  VAL  35          3HG2      VAL  35  -6.305   4.881  -8.384
  231    H    ASP  36           H        ASP  36  -3.593   1.414  -6.008
  232    HA   ASP  36           HA       ASP  36  -3.893  -1.074  -7.395
  233   1HB   ASP  36          2HB       ASP  36  -3.673   0.454  -9.302
  234   2HB   ASP  36          1HB       ASP  36  -2.186   1.103  -8.618
  235    H    GLU  37           H        GLU  37  -1.827  -2.308  -7.429
  236    HA   GLU  37           HA       GLU  37   0.041  -1.383  -5.348
  237   1HB   GLU  37          2HB       GLU  37  -1.454  -3.068  -4.387
  238   2HB   GLU  37          1HB       GLU  37  -1.047  -4.186  -5.684
  239   1HG   GLU  37          2HG       GLU  37   1.269  -4.239  -4.914
  240   2HG   GLU  37          1HG       GLU  37   0.864  -3.116  -3.619
  241    H    THR  38           H        THR  38   2.147  -1.524  -5.863
  242    HA   THR  38           HA       THR  38   2.871  -3.133  -8.228
  243    HB   THR  38           HB       THR  38   4.009  -0.451  -7.423
  244    HG1  THR  38           1HG      THR  38   2.999   0.257  -9.322
  245   1HG2  THR  38          1HG2      THR  38   5.222  -0.486  -9.508
  246   2HG2  THR  38          2HG2      THR  38   4.598  -2.096  -9.869
  247   3HG2  THR  38          3HG2      THR  38   5.692  -1.859  -8.506
  248    H    ARG  39           H        ARG  39   5.041  -3.939  -8.287
  249    HA   ARG  39           HA       ARG  39   5.880  -5.337  -6.116
  250   1HB   ARG  39          2HB       ARG  39   8.071  -5.537  -7.202
  251   2HB   ARG  39          1HB       ARG  39   6.755  -5.721  -8.353
  252   1HG   ARG  39          2HG       ARG  39   7.085  -3.443  -9.126
  253   2HG   ARG  39          1HG       ARG  39   8.371  -3.214  -7.940
  254   1HD   ARG  39          2HD       ARG  39   9.289  -3.691 -10.150
  255   2HD   ARG  39          1HD       ARG  39   9.682  -4.974  -9.006
  256    HE   ARG  39           HE       ARG  39   8.570  -6.416 -10.363
  257   1HH1  ARG  39          1HH1      ARG  39   7.363  -3.203 -11.004
  258   2HH1  ARG  39          2HH1      ARG  39   6.286  -3.724 -12.255
  259   1HH2  ARG  39          1HH2      ARG  39   7.163  -7.099 -12.012
  260   2HH2  ARG  39          2HH2      ARG  39   6.173  -5.935 -12.829
  261    H    ASN  40           H        ASN  40   6.982  -2.079  -7.003
  262    HA   ASN  40           HA       ASN  40   7.997  -1.799  -4.259
  263   1HB   ASN  40          2HB       ASN  40   9.909  -0.499  -5.088
  264   2HB   ASN  40          1HB       ASN  40   9.922  -2.146  -5.696
  265   1HD2  ASN  40          1HD2      ASN  40   7.555  -0.466  -7.372
  266   2HD2  ASN  40          2HD2      ASN  40   8.492  -0.009  -8.739
  267    H    THR  41           H        THR  41   5.476  -0.920  -5.494
  268    HA   THR  41           HA       THR  41   5.575   1.802  -4.551
  269    HB   THR  41           HB       THR  41   4.833   1.248  -7.430
  270    HG1  THR  41           1HG      THR  41   6.733   1.998  -7.905
  271   1HG2  THR  41          1HG2      THR  41   4.710   3.753  -7.567
  272   2HG2  THR  41          2HG2      THR  41   4.654   3.763  -5.803
  273   3HG2  THR  41          3HG2      THR  41   3.380   2.961  -6.720
  274    H    LEU  42           H        LEU  42   3.734   2.327  -3.572
  275    HA   LEU  42           HA       LEU  42   1.424   0.552  -3.966
  276   1HB   LEU  42          2HB       LEU  42   2.484   0.741  -1.674
  277   2HB   LEU  42          1HB       LEU  42   1.941   2.405  -1.639
  278    HG   LEU  42           HG       LEU  42   0.456   0.943  -0.364
  279   1HD1  LEU  42          1HD1      LEU  42  -1.200   1.620  -2.736
  280   2HD1  LEU  42          2HD1      LEU  42  -0.312   2.929  -1.956
  281   3HD1  LEU  42          3HD1      LEU  42  -1.468   1.974  -1.029
  282   1HD2  LEU  42          1HD2      LEU  42   0.740  -1.144  -1.511
  283   2HD2  LEU  42          2HD2      LEU  42   0.092  -0.471  -3.007
  284   3HD2  LEU  42          3HD2      LEU  42  -0.963  -0.695  -1.611
  285    H    ARG  43           H        ARG  43  -0.327   1.361  -4.947
  286    HA   ARG  43           HA       ARG  43  -0.450   4.265  -5.313
  287   1HB   ARG  43          2HB       ARG  43  -0.514   2.339  -7.174
  288   2HB   ARG  43          1HB       ARG  43  -2.230   2.434  -6.833
  289   1HG   ARG  43          2HG       ARG  43  -1.862   3.890  -8.640
  290   2HG   ARG  43          1HG       ARG  43  -2.014   4.938  -7.226
  291   1HD   ARG  43          2HD       ARG  43  -0.151   5.647  -8.632
  292   2HD   ARG  43          1HD       ARG  43   0.425   5.076  -7.066
  293    HE   ARG  43           HE       ARG  43   0.487   2.919  -8.829
  294   1HH1  ARG  43          1HH1      ARG  43   2.053   6.014  -8.442
  295   2HH1  ARG  43          2HH1      ARG  43   3.528   5.501  -9.188
  296   1HH2  ARG  43          1HH2      ARG  43   2.426   2.244  -9.811
  297   2HH2  ARG  43          2HH2      ARG  43   3.739   3.361  -9.967
  298    H    ILE  44           H        ILE  44  -1.939   5.413  -4.291
  299    HA   ILE  44           HA       ILE  44  -4.051   4.027  -2.780
  300    HB   ILE  44           HB       ILE  44  -2.457   6.525  -2.285
  301   1HG1  ILE  44          2HG1      ILE  44  -2.924   4.025  -0.661
  302   2HG1  ILE  44          1HG1      ILE  44  -1.474   4.421  -1.578
  303   1HG2  ILE  44          1HG2      ILE  44  -3.866   7.457  -0.839
  304   2HG2  ILE  44          2HG2      ILE  44  -4.404   5.908  -0.198
  305   3HG2  ILE  44          3HG2      ILE  44  -5.106   6.540  -1.685
  306   1HD1  ILE  44          1HD1      ILE  44  -0.736   5.115   0.422
  307   2HD1  ILE  44          2HD1      ILE  44  -2.363   5.363   1.058
  308   3HD1  ILE  44          3HD1      ILE  44  -1.628   6.580   0.015
  309    H    GLU  45           H        GLU  45  -6.095   4.238  -3.571
  310    HA   GLU  45           HA       GLU  45  -6.908   6.918  -4.410
  311   1HB   GLU  45          2HB       GLU  45  -6.701   5.711  -6.489
  312   2HB   GLU  45          1HB       GLU  45  -7.660   4.376  -5.856
  313   1HG   GLU  45          2HG       GLU  45  -9.600   5.859  -5.708
  314   2HG   GLU  45          1HG       GLU  45  -8.631   7.179  -6.363
  315    H    MET  46           H        MET  46  -8.901   7.532  -3.907
  316    HA   MET  46           HA       MET  46 -10.485   5.776  -2.161
  317   1HB   MET  46          2HB       MET  46 -11.228   7.867  -0.996
  318   2HB   MET  46          1HB       MET  46  -9.529   7.485  -0.777
  319   1HG   MET  46          2HG       MET  46  -9.514   9.113  -2.985
  320   2HG   MET  46          1HG       MET  46 -10.785   9.806  -1.979
  321   1HE   MET  46          1HE       MET  46  -6.776   9.129  -2.149
  322   2HE   MET  46          2HE       MET  46  -7.601   7.855  -1.251
  323   3HE   MET  46          3HE       MET  46  -6.546   8.985  -0.405
  324    H    ASP  47           H        ASP  47 -12.582   5.574  -2.546
  325    HA   ASP  47           HA       ASP  47 -13.719   5.850  -4.969
  326   1HB   ASP  47          2HB       ASP  47 -14.727   4.581  -3.135
  327   2HB   ASP  47          1HB       ASP  47 -15.174   6.083  -2.332
  328    H    ASP  48           H        ASP  48 -13.329   8.412  -2.673
  329    HA   ASP  48           HA       ASP  48 -15.267  10.204  -3.605
  330   1HB   ASP  48          2HB       ASP  48 -13.926  10.519  -1.529
  331   2HB   ASP  48          1HB       ASP  48 -12.518  10.875  -2.524
  332    H    GLY  49           H        GLY  49 -12.470   8.991  -5.111
  333   1HA   GLY  49          2HA       GLY  49 -12.089   9.293  -7.435
  334   2HA   GLY  49          1HA       GLY  49 -12.805  10.893  -7.317
  335    H    ARG  50           H        ARG  50 -10.668  10.040  -4.806
  336    HA   ARG  50           HA       ARG  50  -8.627  11.813  -5.979
  337   1HB   ARG  50          2HB       ARG  50  -9.208  11.148  -3.104
  338   2HB   ARG  50          1HB       ARG  50  -7.840  12.114  -3.628
  339   1HG   ARG  50          2HG       ARG  50  -9.358  13.771  -4.562
  340   2HG   ARG  50          1HG       ARG  50 -10.741  12.790  -4.070
  341   1HD   ARG  50          2HD       ARG  50  -8.691  14.020  -2.230
  342   2HD   ARG  50          1HD       ARG  50 -10.335  14.603  -2.486
  343    HE   ARG  50           HE       ARG  50 -10.463  11.927  -1.684
  344   1HH1  ARG  50          1HH1      ARG  50  -9.563  15.039  -0.387
  345   2HH1  ARG  50          2HH1      ARG  50  -9.961  14.615   1.243
  346   1HH2  ARG  50          1HH2      ARG  50 -10.989  11.367   0.460
  347   2HH2  ARG  50          2HH2      ARG  50 -10.772  12.530   1.724
  348    H    GLU  51           H        GLU  51  -6.733  11.011  -6.578
  349    HA   GLU  51           HA       GLU  51  -5.947   8.387  -5.503
  350   1HB   GLU  51          2HB       GLU  51  -4.909   7.903  -7.642
  351   2HB   GLU  51          1HB       GLU  51  -6.596   8.339  -7.883
  352   1HG   GLU  51          2HG       GLU  51  -5.931  10.583  -8.559
  353   2HG   GLU  51          1HG       GLU  51  -4.238  10.155  -8.316
  354    H    ILE  52           H        ILE  52  -3.737   8.026  -5.114
  355    HA   ILE  52           HA       ILE  52  -1.776  10.093  -5.485
  356    HB   ILE  52           HB       ILE  52  -2.906  10.914  -3.464
  357   1HG1  ILE  52          2HG1      ILE  52  -0.155   9.765  -2.936
  358   2HG1  ILE  52          1HG1      ILE  52  -0.499  11.300  -3.733
  359   1HG2  ILE  52          1HG2      ILE  52  -3.196   9.693  -1.522
  360   2HG2  ILE  52          2HG2      ILE  52  -1.965   8.508  -1.960
  361   3HG2  ILE  52          3HG2      ILE  52  -3.529   8.498  -2.776
  362   1HD1  ILE  52          1HD1      ILE  52  -1.173  10.619  -0.870
  363   2HD1  ILE  52          2HD1      ILE  52  -1.486  12.160  -1.670
  364   3HD1  ILE  52          3HD1      ILE  52   0.175  11.626  -1.403
  365    H    THR  53           H        THR  53   0.283   9.248  -5.481
  366    HA   THR  53           HA       THR  53   0.467   6.356  -5.168
  367    HB   THR  53           HB       THR  53   1.323   7.309  -7.224
  368    HG1  THR  53           1HG      THR  53   2.440   5.512  -6.430
  369   1HG2  THR  53          1HG2      THR  53   1.959   9.517  -6.532
  370   2HG2  THR  53          2HG2      THR  53   3.347   8.693  -7.242
  371   3HG2  THR  53          3HG2      THR  53   3.223   8.861  -5.491
  372    H    VAL  54           H        VAL  54   2.182   5.326  -4.024
  373    HA   VAL  54           HA       VAL  54   3.729   6.879  -2.121
  374    HB   VAL  54           HB       VAL  54   1.800   4.767  -1.141
  375   1HG1  VAL  54          1HG1      VAL  54   3.489   6.641   0.502
  376   2HG1  VAL  54          2HG1      VAL  54   4.023   5.022   0.052
  377   3HG1  VAL  54          3HG1      VAL  54   2.582   5.230   1.047
  378   1HG2  VAL  54          1HG2      VAL  54   0.702   6.671   0.032
  379   2HG2  VAL  54          2HG2      VAL  54   0.560   6.743  -1.723
  380   3HG2  VAL  54          3HG2      VAL  54   1.724   7.773  -0.890
  381    HA   PRO  55           HA       PRO  55   6.463   3.636  -3.789
  382   1HB   PRO  55          2HB       PRO  55   8.119   4.914  -1.651
  383   2HB   PRO  55          1HB       PRO  55   8.572   4.450  -3.297
  384   1HG   PRO  55          2HG       PRO  55   8.082   6.991  -2.717
  385   2HG   PRO  55          1HG       PRO  55   7.513   6.292  -4.245
  386   1HD   PRO  55          2HD       PRO  55   5.978   6.974  -1.785
  387   2HD   PRO  55          1HD       PRO  55   5.477   7.045  -3.484
  388    H    LYS  56           H        LYS  56   6.918   1.609  -3.137
  389    HA   LYS  56           HA       LYS  56   6.199   0.866  -0.395
  390   1HB   LYS  56          2HB       LYS  56   6.321  -0.689  -2.961
  391   2HB   LYS  56          1HB       LYS  56   6.316  -1.504  -1.405
  392   1HG   LYS  56          2HG       LYS  56   4.191  -0.415  -0.854
  393   2HG   LYS  56          1HG       LYS  56   4.195   0.352  -2.441
  394   1HD   LYS  56          2HD       LYS  56   2.764  -1.625  -2.428
  395   2HD   LYS  56          1HD       LYS  56   4.136  -1.844  -3.511
  396   1HE   LYS  56          2HE       LYS  56   4.152  -2.845  -0.674
  397   2HE   LYS  56          1HE       LYS  56   3.510  -3.806  -2.005
  398   1HZ   LYS  56          1HZ       LYS  56   5.997  -2.902  -2.819
  399   2HZ   LYS  56          2HZ       LYS  56   5.568  -4.479  -2.388
  400   3HZ   LYS  56          3HZ       LYS  56   6.198  -3.429  -1.223
  401    H    GLY  57           H        GLY  57   8.978   1.584  -2.033
  402   1HA   GLY  57          2HA       GLY  57  10.757  -0.458  -1.619
  403   2HA   GLY  57          1HA       GLY  57  11.188   1.238  -1.475
  404    H    ILE  58           H        ILE  58   9.529   1.780   0.813
  405    HA   ILE  58           HA       ILE  58  10.314  -0.013   2.909
  406    HB   ILE  58           HB       ILE  58  11.385   2.812   2.985
  407   1HG1  ILE  58          2HG1      ILE  58  13.646   1.546   3.049
  408   2HG1  ILE  58          1HG1      ILE  58  12.749   0.203   2.350
  409   1HG2  ILE  58          1HG2      ILE  58  12.253   0.697   4.880
  410   2HG2  ILE  58          2HG2      ILE  58  10.662   1.420   5.107
  411   3HG2  ILE  58          3HG2      ILE  58  12.101   2.438   5.114
  412   1HD1  ILE  58          1HD1      ILE  58  13.144   1.085   0.363
  413   2HD1  ILE  58          2HD1      ILE  58  13.823   2.543   1.088
  414   3HD1  ILE  58          3HD1      ILE  58  12.086   2.427   0.800
  415    H    ALA  59           H        ALA  59   7.830   0.253   2.489
  416    HA   ALA  59           HA       ALA  59   6.910   2.233   4.438
  417   1HB   ALA  59          1HB       ALA  59   6.114   3.484   2.778
  418   2HB   ALA  59          2HB       ALA  59   4.842   2.268   2.657
  419   3HB   ALA  59          3HB       ALA  59   6.255   2.174   1.606
  420    H    VAL  60           H        VAL  60   6.025   1.123   6.055
  421    HA   VAL  60           HA       VAL  60   4.552  -1.340   5.519
  422    HB   VAL  60           HB       VAL  60   6.119  -1.294   7.426
  423   1HG1  VAL  60          1HG1      VAL  60   4.305   0.352   9.072
  424   2HG1  VAL  60          2HG1      VAL  60   5.290   1.214   7.890
  425   3HG1  VAL  60          3HG1      VAL  60   6.063   0.207   9.114
  426   1HG2  VAL  60          1HG2      VAL  60   3.235  -1.576   8.270
  427   2HG2  VAL  60          2HG2      VAL  60   4.632  -2.304   9.062
  428   3HG2  VAL  60          3HG2      VAL  60   4.182  -2.807   7.432
  429    H    PHE  61           H        PHE  61   2.370  -1.504   5.554
  430    HA   PHE  61           HA       PHE  61   0.764   0.501   6.866
  431   1HB   PHE  61          2HB       PHE  61  -0.519   0.959   4.705
  432   2HB   PHE  61          1HB       PHE  61   1.053   1.727   4.883
  433    HD1  PHE  61           1HD      PHE  61   2.366   1.755   3.022
  434    HD2  PHE  61           2HD      PHE  61  -0.305  -1.510   3.587
  435    HE1  PHE  61           1HE      PHE  61   3.088   0.798   0.875
  436    HE2  PHE  61           2HE      PHE  61   0.419  -2.475   1.441
  437    HZ   PHE  61           HZ       PHE  61   2.116  -1.320   0.084
  438    H    HIS  62           H        HIS  62  -1.415  -0.049   7.080
  439    HA   HIS  62           HA       HIS  62  -2.036  -2.853   6.428
  440   1HB   HIS  62          2HB       HIS  62  -2.881  -1.205   8.821
  441   2HB   HIS  62          1HB       HIS  62  -3.508  -2.807   8.454
  442    HD1  HIS  62           1HD      HIS  62  -2.332  -2.893  11.043
  443    HD2  HIS  62           2HD      HIS  62   0.108  -3.075   7.687
  444    HE1  HIS  62           1HE      HIS  62  -0.177  -3.921  11.832
  445    HE2  HIS  62           2HE      HIS  62   1.319  -3.925   9.807
  446    H    PHE  63           H        PHE  63  -4.092  -3.329   5.645
  447    HA   PHE  63           HA       PHE  63  -5.555  -0.995   4.647
  448   1HB   PHE  63          2HB       PHE  63  -5.705  -3.886   3.771
  449   2HB   PHE  63          1HB       PHE  63  -6.585  -2.552   3.040
  450    HD1  PHE  63           1HD      PHE  63  -3.045  -3.306   3.979
  451    HD2  PHE  63           2HD      PHE  63  -5.748  -1.801   1.057
  452    HE1  PHE  63           1HE      PHE  63  -1.163  -2.893   2.457
  453    HE2  PHE  63           2HE      PHE  63  -3.867  -1.387  -0.472
  454    HZ   PHE  63           HZ       PHE  63  -1.570  -1.933   0.227
  455    H    ARG  64           H        ARG  64  -7.864  -0.973   4.689
  456    HA   ARG  64           HA       ARG  64  -9.072  -2.681   6.753
  457   1HB   ARG  64          2HB       ARG  64  -9.518   0.296   6.440
  458   2HB   ARG  64          1HB       ARG  64 -10.318  -0.748   7.608
  459   1HG   ARG  64          2HG       ARG  64  -7.364  -0.171   7.509
  460   2HG   ARG  64          1HG       ARG  64  -8.523   0.552   8.625
  461   1HD   ARG  64          2HD       ARG  64  -7.879  -2.387   8.416
  462   2HD   ARG  64          1HD       ARG  64  -7.276  -1.292   9.658
  463    HE   ARG  64           HE       ARG  64  -9.787  -2.590   9.631
  464   1HH1  ARG  64          1HH1      ARG  64  -8.269   0.428  10.514
  465   2HH1  ARG  64          2HH1      ARG  64  -9.475   0.833  11.688
  466   1HH2  ARG  64          1HH2      ARG  64 -11.368  -2.059  11.181
  467   2HH2  ARG  64          2HH2      ARG  64 -11.232  -0.578  12.069
  468    H    THR  65           H        THR  65 -10.937  -3.599   6.142
  469    HA   THR  65           HA       THR  65 -12.184  -2.629   3.662
  470    HB   THR  65           HB       THR  65 -12.397  -5.345   4.971
  471    HG1  THR  65           1HG      THR  65 -10.577  -5.659   3.997
  472   1HG2  THR  65          1HG2      THR  65 -13.041  -5.268   2.176
  473   2HG2  THR  65          2HG2      THR  65 -14.104  -4.202   3.096
  474   3HG2  THR  65          3HG2      THR  65 -13.973  -5.907   3.531
  475    HA   PRO  66           HA       PRO  66 -15.611  -1.016   5.994
  476   1HB   PRO  66          2HB       PRO  66 -17.512  -1.536   3.990
  477   2HB   PRO  66          1HB       PRO  66 -16.596  -0.043   4.203
  478   1HG   PRO  66          2HG       PRO  66 -16.094  -2.331   2.366
  479   2HG   PRO  66          1HG       PRO  66 -15.805  -0.600   2.114
  480   1HD   PRO  66          2HD       PRO  66 -13.791  -2.285   2.622
  481   2HD   PRO  66          1HD       PRO  66 -13.802  -0.639   3.291
  482    H    GLN  67           H        GLN  67 -15.688  -4.147   4.407
  483    HA   GLN  67           HA       GLN  67 -18.032  -5.149   5.593
  484   1HB   GLN  67          2HB       GLN  67 -15.563  -6.643   4.691
  485   2HB   GLN  67          1HB       GLN  67 -17.120  -7.378   5.045
  486   1HG   GLN  67          2HG       GLN  67 -18.134  -6.100   3.225
  487   2HG   GLN  67          1HG       GLN  67 -16.571  -5.373   2.868
  488   1HE2  GLN  67          1HE2      GLN  67 -15.924  -8.467   3.801
  489   2HE2  GLN  67          2HE2      GLN  67 -15.917  -9.233   2.256
  490    H    GLY  68           H        GLY  68 -14.980  -4.433   6.927
  491   1HA   GLY  68          2HA       GLY  68 -14.708  -4.371   9.304
  492   2HA   GLY  68          1HA       GLY  68 -15.773  -5.764   9.424
  493    H    GLU  69           H        GLU  69 -12.901  -5.171   7.402
  494    HA   GLU  69           HA       GLU  69 -11.670  -7.532   8.683
  495   1HB   GLU  69          2HB       GLU  69 -11.377  -6.673   5.800
  496   2HB   GLU  69          1HB       GLU  69 -10.607  -8.064   6.545
  497   1HG   GLU  69          2HG       GLU  69 -12.794  -9.069   6.944
  498   2HG   GLU  69          1HG       GLU  69 -13.571  -7.673   6.198
  499    H    LEU  70           H        LEU  70  -9.396  -7.542   8.900
  500    HA   LEU  70           HA       LEU  70  -8.123  -4.897   8.658
  501   1HB   LEU  70          2HB       LEU  70  -8.715  -5.424  10.999
  502   2HB   LEU  70          1HB       LEU  70  -7.766  -6.893  10.899
  503    HG   LEU  70           HG       LEU  70  -6.627  -5.052  12.109
  504   1HD1  LEU  70          1HD1      LEU  70  -5.492  -6.894  10.638
  505   2HD1  LEU  70          2HD1      LEU  70  -4.535  -5.576  11.315
  506   3HD1  LEU  70          3HD1      LEU  70  -5.043  -5.522   9.627
  507   1HD2  LEU  70          1HD2      LEU  70  -5.806  -3.125  10.924
  508   2HD2  LEU  70          2HD2      LEU  70  -7.556  -3.217  10.724
  509   3HD2  LEU  70          3HD2      LEU  70  -6.491  -3.717   9.409
  510    H    VAL  71           H        VAL  71  -6.635  -5.056   7.109
  511    HA   VAL  71           HA       VAL  71  -5.013  -7.518   6.976
  512    HB   VAL  71           HB       VAL  71  -5.556  -5.552   4.746
  513   1HG1  VAL  71          1HG1      VAL  71  -3.532  -6.466   4.161
  514   2HG1  VAL  71          2HG1      VAL  71  -4.640  -7.633   3.439
  515   3HG1  VAL  71          3HG1      VAL  71  -3.860  -7.992   4.979
  516   1HG2  VAL  71          1HG2      VAL  71  -7.580  -6.630   4.937
  517   2HG2  VAL  71          2HG2      VAL  71  -6.853  -8.120   5.536
  518   3HG2  VAL  71          3HG2      VAL  71  -6.727  -7.705   3.828
  519    H    GLU  72           H        GLU  72  -2.767  -7.330   6.661
  520    HA   GLU  72           HA       GLU  72  -1.656  -4.639   7.103
  521   1HB   GLU  72          2HB       GLU  72   0.056  -5.635   8.559
  522   2HB   GLU  72          1HB       GLU  72  -1.565  -5.869   9.198
  523   1HG   GLU  72          2HG       GLU  72  -1.570  -8.160   8.355
  524   2HG   GLU  72          1HG       GLU  72   0.055  -7.925   7.712
  525    H    ILE  73           H        ILE  73   0.169  -4.106   5.992
  526    HA   ILE  73           HA       ILE  73   1.487  -6.169   4.376
  527    HB   ILE  73           HB       ILE  73   0.535  -3.519   3.273
  528   1HG1  ILE  73          2HG1      ILE  73  -1.273  -5.179   3.535
  529   2HG1  ILE  73          1HG1      ILE  73  -0.928  -4.847   1.841
  530   1HG2  ILE  73          1HG2      ILE  73   1.418  -4.325   1.135
  531   2HG2  ILE  73          2HG2      ILE  73   2.041  -5.765   1.938
  532   3HG2  ILE  73          3HG2      ILE  73   2.689  -4.176   2.348
  533   1HD1  ILE  73          1HD1      ILE  73   0.197  -7.213   3.315
  534   2HD1  ILE  73          2HD1      ILE  73   0.195  -6.918   1.577
  535   3HD1  ILE  73          3HD1      ILE  73  -1.319  -7.255   2.417
  536    H    ASP  74           H        ASP  74   3.676  -5.874   4.165
  537    HA   ASP  74           HA       ASP  74   4.772  -3.523   5.550
  538   1HB   ASP  74          2HB       ASP  74   6.024  -6.237   5.120
  539   2HB   ASP  74          1HB       ASP  74   6.785  -4.889   5.954
  540    H    GLY  75           H        GLY  75   5.776  -2.064   4.417
  541   1HA   GLY  75          2HA       GLY  75   6.536  -2.605   1.657
  542   2HA   GLY  75          1HA       GLY  75   6.424  -1.026   2.408
  543    H    ARG  76           H        ARG  76   8.020  -2.524   4.699
  544    HA   ARG  76           HA       ARG  76  10.583  -1.734   3.615
  545   1HB   ARG  76          2HB       ARG  76   9.961  -0.660   5.682
  546   2HB   ARG  76          1HB       ARG  76   9.686  -2.220   6.444
  547   1HG   ARG  76          2HG       ARG  76  12.074  -2.732   6.239
  548   2HG   ARG  76          1HG       ARG  76  12.341  -1.153   5.502
  549   1HD   ARG  76          2HD       ARG  76  11.534  -0.064   7.537
  550   2HD   ARG  76          1HD       ARG  76  11.251  -1.642   8.272
  551    HE   ARG  76           HE       ARG  76  13.930  -1.493   7.460
  552   1HH1  ARG  76          1HH1      ARG  76  11.777  -0.095   9.824
  553   2HH1  ARG  76          2HH1      ARG  76  13.033   0.204  10.977
  554   1HH2  ARG  76          1HH2      ARG  76  15.585  -1.102   8.977
  555   2HH2  ARG  76          2HH2      ARG  76  15.195  -0.367  10.496
  556    H    ALA  77           H        ALA  77   9.198  -4.417   5.432
  557    HA   ALA  77           HA       ALA  77  11.561  -5.999   4.845
  558   1HB   ALA  77          1HB       ALA  77  10.263  -7.600   6.504
  559   2HB   ALA  77          2HB       ALA  77   9.510  -6.073   6.965
  560   3HB   ALA  77          3HB       ALA  77  11.260  -6.260   7.069
  561    H    LEU  78           H        LEU  78   8.311  -5.739   3.785
  562    HA   LEU  78           HA       LEU  78   8.471  -8.461   2.672
  563   1HB   LEU  78          2HB       LEU  78   6.069  -6.749   3.259
  564   2HB   LEU  78          1HB       LEU  78   5.989  -8.237   2.338
  565    HG   LEU  78           HG       LEU  78   6.886  -7.995   5.214
  566   1HD1  LEU  78          1HD1      LEU  78   4.836  -9.141   5.762
  567   2HD1  LEU  78          2HD1      LEU  78   4.395  -9.239   4.058
  568   3HD1  LEU  78          3HD1      LEU  78   4.463  -7.671   4.863
  569   1HD2  LEU  78          1HD2      LEU  78   8.080  -9.777   4.109
  570   2HD2  LEU  78          2HD2      LEU  78   6.577 -10.409   3.435
  571   3HD2  LEU  78          3HD2      LEU  78   6.853 -10.462   5.175
  572    H    VAL  79           H        VAL  79   9.785  -6.179   1.443
  573    HA   VAL  79           HA       VAL  79   8.218  -5.373  -0.805
  574    HB   VAL  79           HB       VAL  79  10.052  -3.961  -0.001
  575   1HG1  VAL  79          1HG1      VAL  79  11.468  -6.210   0.365
  576   2HG1  VAL  79          2HG1      VAL  79  12.202  -4.612   0.236
  577   3HG1  VAL  79          3HG1      VAL  79  12.150  -5.675  -1.171
  578   1HG2  VAL  79          1HG2      VAL  79  10.671  -4.979  -2.769
  579   2HG2  VAL  79          2HG2      VAL  79  10.989  -3.369  -2.123
  580   3HG2  VAL  79          3HG2      VAL  79   9.329  -3.901  -2.386
  581    H    ALA  80           H        ALA  80   7.510  -7.046  -2.048
  582    HA   ALA  80           HA       ALA  80   9.500  -9.008  -2.968
  583   1HB   ALA  80          1HB       ALA  80   6.613  -9.182  -2.352
  584   2HB   ALA  80          2HB       ALA  80   7.908 -10.347  -2.076
  585   3HB   ALA  80          3HB       ALA  80   7.212 -10.167  -3.687
  586    H    ARG  81           H        ARG  81   9.534  -9.669  -5.136
  587    HA   ARG  81           HA       ARG  81   8.385  -7.724  -7.027
  588   1HB   ARG  81          2HB       ARG  81  10.347  -8.277  -8.486
  589   2HB   ARG  81          1HB       ARG  81  10.756  -7.441  -6.996
  590   1HG   ARG  81          2HG       ARG  81  11.419  -9.576  -5.993
  591   2HG   ARG  81          1HG       ARG  81  11.034 -10.395  -7.506
  592   1HD   ARG  81          2HD       ARG  81  13.427  -9.999  -7.341
  593   2HD   ARG  81          1HD       ARG  81  12.737  -9.054  -8.659
  594    HE   ARG  81           HE       ARG  81  13.945  -8.054  -6.237
  595   1HH1  ARG  81          1HH1      ARG  81  11.930  -7.314  -8.992
  596   2HH1  ARG  81          2HH1      ARG  81  12.072  -5.602  -8.791
  597   1HH2  ARG  81          1HH2      ARG  81  14.140  -5.804  -5.984
  598   2HH2  ARG  81          2HH2      ARG  81  13.331  -4.745  -7.088
  599    HA   PRO  82           HA       PRO  82   6.386 -11.687  -8.101
  600   1HB   PRO  82          2HB       PRO  82   4.236 -10.560  -9.322
  601   2HB   PRO  82          1HB       PRO  82   4.353 -10.796  -7.576
  602   1HG   PRO  82          2HG       PRO  82   4.844  -8.325  -9.190
  603   2HG   PRO  82          1HG       PRO  82   4.006  -8.504  -7.639
  604   1HD   PRO  82          2HD       PRO  82   6.557  -7.613  -7.829
  605   2HD   PRO  82          1HD       PRO  82   5.967  -8.544  -6.438
  606    H    GLU  83           H        GLU  83   5.263  -9.544 -10.600
  607    HA   GLU  83           HA       GLU  83   5.869 -11.182 -12.710
  608   1HB   GLU  83          2HB       GLU  83   5.686  -8.170 -12.727
  609   2HB   GLU  83          1HB       GLU  83   5.610  -9.192 -14.155
  610   1HG   GLU  83          2HG       GLU  83   3.659  -9.258 -11.863
  611   2HG   GLU  83          1HG       GLU  83   3.396  -8.454 -13.411
  612    H    GLU  84           H        GLU  84   8.010  -9.059 -11.031
  613    HA   GLU  84           HA       GLU  84  10.005  -9.088 -13.124
  614   1HB   GLU  84          2HB       GLU  84   9.784  -7.099 -11.750
  615   2HB   GLU  84          1HB       GLU  84  10.094  -8.033 -10.296
  616   1HG   GLU  84          2HG       GLU  84  12.045  -6.750 -10.952
  617   2HG   GLU  84          1HG       GLU  84  12.368  -8.478 -11.050
  618    H    ARG  85           H        ARG  85   9.003 -11.402 -11.071
  619    HA   ARG  85           HA       ARG  85   9.873 -13.366 -10.342
  620   1HB   ARG  85          2HB       ARG  85  10.816 -13.511 -12.601
  621   2HB   ARG  85          1HB       ARG  85  12.220 -12.586 -12.084
  622   1HG   ARG  85          2HG       ARG  85  12.834 -14.375 -10.540
  623   2HG   ARG  85          1HG       ARG  85  11.423 -15.302 -11.056
  624   1HD   ARG  85          2HD       ARG  85  12.304 -15.368 -13.338
  625   2HD   ARG  85          1HD       ARG  85  13.711 -14.439 -12.822
  626    HE   ARG  85           HE       ARG  85  13.523 -16.725 -11.220
  627   1HH1  ARG  85          1HH1      ARG  85  14.175 -15.866 -14.540
  628   2HH1  ARG  85          2HH1      ARG  85  15.190 -17.240 -14.827
  629   1HH2  ARG  85          1HH2      ARG  85  14.857 -18.532 -11.596
  630   2HH2  ARG  85          2HH2      ARG  85  15.577 -18.754 -13.156
  631    H    ILE  86           H        ILE  86  11.291 -14.245  -8.774
  632    HA   ILE  86           HA       ILE  86  12.465 -12.218  -7.060
  633    HB   ILE  86           HB       ILE  86  12.128 -15.190  -6.620
  634   1HG1  ILE  86          2HG1      ILE  86  10.364 -14.455  -5.007
  635   2HG1  ILE  86          1HG1      ILE  86  10.561 -12.811  -5.600
  636   1HG2  ILE  86          1HG2      ILE  86  13.125 -13.009  -4.803
  637   2HG2  ILE  86          2HG2      ILE  86  13.957 -14.488  -5.287
  638   3HG2  ILE  86          3HG2      ILE  86  12.558 -14.573  -4.216
  639   1HD1  ILE  86          1HD1      ILE  86   8.641 -14.259  -6.512
  640   2HD1  ILE  86          2HD1      ILE  86   9.895 -15.030  -7.484
  641   3HD1  ILE  86          3HD1      ILE  86   9.595 -13.300  -7.642
  Start of MODEL    2
    1    H    ARG   9           H        ARG   9  -8.629  -7.664 -11.038
    2    HA   ARG   9           HA       ARG   9 -11.066  -6.609 -11.992
    3   1HB   ARG   9          2HB       ARG   9 -12.467  -8.624 -11.848
    4   2HB   ARG   9          1HB       ARG   9 -11.268  -8.757 -13.127
    5   1HG   ARG   9          2HG       ARG   9  -9.872 -10.138 -11.663
    6   2HG   ARG   9          1HG       ARG   9 -11.095 -10.020 -10.399
    7   1HD   ARG   9          2HD       ARG   9 -11.292 -12.126 -11.607
    8   2HD   ARG   9          1HD       ARG   9 -12.716 -11.118 -11.862
    9    HE   ARG   9           HE       ARG   9 -10.908 -10.624 -13.937
   10   1HH1  ARG   9          1HH1      ARG   9 -12.930 -13.209 -12.752
   11   2HH1  ARG   9          2HH1      ARG   9 -13.151 -13.921 -14.314
   12   1HH2  ARG   9          1HH2      ARG   9 -11.196 -11.559 -15.993
   13   2HH2  ARG   9          2HH2      ARG   9 -12.166 -12.985 -16.155
   14    H    HIS  10           H        HIS  10  -9.534  -8.745  -9.626
   15    HA   HIS  10           HA       HIS  10 -10.322  -7.095  -7.448
   16   1HB   HIS  10          2HB       HIS  10 -12.479  -8.200  -7.815
   17   2HB   HIS  10          1HB       HIS  10 -11.702  -9.776  -7.705
   18    HD1  HIS  10           1HD      HIS  10 -13.792  -9.686  -5.771
   19    HD2  HIS  10           2HD      HIS  10 -10.161  -7.840  -4.949
   20    HE1  HIS  10           1HE      HIS  10 -13.701  -9.466  -3.269
   21    HE2  HIS  10           2HE      HIS  10 -11.533  -8.270  -2.799
   22    H    GLU  11           H        GLU  11  -8.459  -7.150  -6.376
   23    HA   GLU  11           HA       GLU  11  -7.413  -9.743  -5.526
   24   1HB   GLU  11          2HB       GLU  11  -6.185  -9.080  -7.593
   25   2HB   GLU  11          1HB       GLU  11  -5.661  -7.616  -6.775
   26   1HG   GLU  11          2HG       GLU  11  -5.038 -10.392  -5.799
   27   2HG   GLU  11          1HG       GLU  11  -3.978  -9.454  -6.849
   28    H    LEU  12           H        LEU  12  -6.316  -6.348  -5.382
   29    HA   LEU  12           HA       LEU  12  -6.712  -6.397  -2.480
   30   1HB   LEU  12          2HB       LEU  12  -4.372  -7.034  -2.937
   31   2HB   LEU  12          1HB       LEU  12  -4.147  -5.539  -3.823
   32    HG   LEU  12           HG       LEU  12  -4.515  -4.254  -1.760
   33   1HD1  LEU  12          1HD1      LEU  12  -5.421  -5.130   0.067
   34   2HD1  LEU  12          2HD1      LEU  12  -4.206  -6.407   0.121
   35   3HD1  LEU  12          3HD1      LEU  12  -5.673  -6.626  -0.834
   36   1HD2  LEU  12          1HD2      LEU  12  -2.255  -5.177  -2.500
   37   2HD2  LEU  12          2HD2      LEU  12  -2.452  -6.360  -1.208
   38   3HD2  LEU  12          3HD2      LEU  12  -2.405  -4.638  -0.827
   39    H    ILE  13           H        ILE  13  -7.603  -4.948  -5.172
   40    HA   ILE  13           HA       ILE  13  -7.188  -2.186  -4.349
   41    HB   ILE  13           HB       ILE  13  -8.645  -3.280  -6.762
   42   1HG1  ILE  13          2HG1      ILE  13  -6.641  -2.423  -7.999
   43   2HG1  ILE  13          1HG1      ILE  13  -5.866  -2.123  -6.447
   44   1HG2  ILE  13          1HG2      ILE  13  -9.550  -1.156  -6.356
   45   2HG2  ILE  13          2HG2      ILE  13  -8.301  -0.885  -7.572
   46   3HG2  ILE  13          3HG2      ILE  13  -7.989  -0.486  -5.883
   47   1HD1  ILE  13          1HD1      ILE  13  -5.359  -4.296  -7.771
   48   2HD1  ILE  13          2HD1      ILE  13  -6.882  -4.851  -7.077
   49   3HD1  ILE  13          3HD1      ILE  13  -5.561  -4.358  -6.020
   50    H    GLY  14           H        GLY  14  -9.015  -0.698  -4.184
   51   1HA   GLY  14          2HA       GLY  14 -11.214  -0.131  -3.655
   52   2HA   GLY  14          1HA       GLY  14 -11.644  -1.833  -3.724
   53    H    LEU  15           H        LEU  15  -8.912  -1.456  -1.842
   54    HA   LEU  15           HA       LEU  15 -10.520  -1.591   0.612
   55   1HB   LEU  15          2HB       LEU  15  -7.664  -2.466   0.184
   56   2HB   LEU  15          1HB       LEU  15  -8.650  -2.765   1.604
   57    HG   LEU  15           HG       LEU  15  -9.168  -3.910  -1.142
   58   1HD1  LEU  15          1HD1      LEU  15  -7.349  -5.116  -0.467
   59   2HD1  LEU  15          2HD1      LEU  15  -8.638  -6.050   0.291
   60   3HD1  LEU  15          3HD1      LEU  15  -7.701  -4.902   1.247
   61   1HD2  LEU  15          1HD2      LEU  15 -10.955  -5.091  -0.224
   62   2HD2  LEU  15          2HD2      LEU  15 -11.132  -3.473   0.454
   63   3HD2  LEU  15          3HD2      LEU  15 -10.442  -4.769   1.432
   64    H    SER  16           H        SER  16  -9.415  -0.717   2.591
   65    HA   SER  16           HA       SER  16  -8.350   1.935   1.980
   66   1HB   SER  16          2HB       SER  16  -9.321   0.758   4.600
   67   2HB   SER  16          1HB       SER  16  -8.806   2.427   4.364
   68    HG   SER  16           HG       SER  16 -10.556   2.788   3.078
   69    H    VAL  17           H        VAL  17  -6.497   2.756   3.224
   70    HA   VAL  17           HA       VAL  17  -4.738   0.706   4.331
   71    HB   VAL  17           HB       VAL  17  -3.799   2.579   2.158
   72   1HG1  VAL  17          1HG1      VAL  17  -1.948   2.107   3.485
   73   2HG1  VAL  17          2HG1      VAL  17  -1.852   0.895   2.209
   74   3HG1  VAL  17          3HG1      VAL  17  -2.473   0.452   3.799
   75   1HG2  VAL  17          1HG2      VAL  17  -5.114   1.080   0.973
   76   2HG2  VAL  17          2HG2      VAL  17  -4.743  -0.260   2.059
   77   3HG2  VAL  17          3HG2      VAL  17  -3.524   0.316   0.922
   78    H    ARG  18           H        ARG  18  -3.147   1.480   5.724
   79    HA   ARG  18           HA       ARG  18  -3.223   4.357   6.329
   80   1HB   ARG  18          2HB       ARG  18  -4.619   3.188   7.968
   81   2HB   ARG  18          1HB       ARG  18  -3.284   2.108   8.349
   82   1HG   ARG  18          2HG       ARG  18  -1.990   3.993   9.196
   83   2HG   ARG  18          1HG       ARG  18  -3.316   5.085   8.801
   84   1HD   ARG  18          2HD       ARG  18  -3.440   2.795  10.763
   85   2HD   ARG  18          1HD       ARG  18  -3.286   4.498  11.183
   86    HE   ARG  18           HE       ARG  18  -5.525   4.786  10.756
   87   1HH1  ARG  18          1HH1      ARG  18  -4.548   1.609   9.684
   88   2HH1  ARG  18          2HH1      ARG  18  -6.158   1.114   9.289
   89   1HH2  ARG  18          1HH2      ARG  18  -7.641   4.127  10.249
   90   2HH2  ARG  18          2HH2      ARG  18  -7.913   2.539   9.612
   91    H    ILE  19           H        ILE  19  -1.258   5.191   6.129
   92    HA   ILE  19           HA       ILE  19   1.079   3.496   6.087
   93    HB   ILE  19           HB       ILE  19   0.883   6.501   5.834
   94   1HG1  ILE  19          2HG1      ILE  19  -0.354   5.362   4.059
   95   2HG1  ILE  19          1HG1      ILE  19   1.110   6.101   3.414
   96   1HG2  ILE  19          1HG2      ILE  19   3.130   4.909   6.265
   97   2HG2  ILE  19          2HG2      ILE  19   3.100   6.584   5.712
   98   3HG2  ILE  19          3HG2      ILE  19   3.144   5.268   4.538
   99   1HD1  ILE  19          1HD1      ILE  19   2.214   3.858   3.569
  100   2HD1  ILE  19          2HD1      ILE  19   0.873   3.937   2.424
  101   3HD1  ILE  19          3HD1      ILE  19   0.644   3.180   4.001
  102    H    ALA  20           H        ALA  20   2.203   2.971   7.834
  103    HA   ALA  20           HA       ALA  20   1.970   4.615  10.242
  104   1HB   ALA  20          1HB       ALA  20   2.456   1.771   9.713
  105   2HB   ALA  20          2HB       ALA  20   1.663   2.553  11.082
  106   3HB   ALA  20          3HB       ALA  20   3.425   2.457  11.019
  107    H    ARG  21           H        ARG  21   4.249   3.500   7.883
  108    HA   ARG  21           HA       ARG  21   6.174   5.455   8.774
  109   1HB   ARG  21          2HB       ARG  21   6.867   2.526   8.529
  110   2HB   ARG  21          1HB       ARG  21   8.048   3.815   8.680
  111   1HG   ARG  21          2HG       ARG  21   5.943   3.164  10.731
  112   2HG   ARG  21          1HG       ARG  21   7.624   2.634  10.796
  113   1HD   ARG  21          2HD       ARG  21   8.314   5.027  10.750
  114   2HD   ARG  21          1HD       ARG  21   6.614   5.476  10.864
  115    HE   ARG  21           HE       ARG  21   8.296   4.698  12.995
  116   1HH1  ARG  21          1HH1      ARG  21   5.014   4.371  11.855
  117   2HH1  ARG  21          2HH1      ARG  21   4.362   4.086  13.432
  118   1HH2  ARG  21          1HH2      ARG  21   7.438   4.329  15.069
  119   2HH2  ARG  21          2HH2      ARG  21   5.738   4.064  15.258
  120    H    SER  22           H        SER  22   7.549   6.171   7.125
  121    HA   SER  22           HA       SER  22   7.242   4.894   4.504
  122   1HB   SER  22          2HB       SER  22   6.866   7.859   4.979
  123   2HB   SER  22          1HB       SER  22   6.833   7.044   3.415
  124    HG   SER  22           HG       SER  22   5.058   6.516   5.564
  125    H    VAL  23           H        VAL  23   8.803   5.741   2.894
  126    HA   VAL  23           HA       VAL  23  11.426   5.808   4.028
  127    HB   VAL  23           HB       VAL  23  11.001   4.654   1.914
  128   1HG1  VAL  23          1HG1      VAL  23  10.357   7.408   0.871
  129   2HG1  VAL  23          2HG1      VAL  23   9.279   6.014   0.955
  130   3HG1  VAL  23          3HG1      VAL  23  10.649   6.004  -0.156
  131   1HG2  VAL  23          1HG2      VAL  23  12.911   6.978   1.826
  132   2HG2  VAL  23          2HG2      VAL  23  12.846   5.755   0.555
  133   3HG2  VAL  23          3HG2      VAL  23  13.256   5.290   2.207
  134    H    HIS  24           H        HIS  24   9.254   8.164   2.586
  135    HA   HIS  24           HA       HIS  24  11.223  10.276   3.182
  136   1HB   HIS  24          2HB       HIS  24   9.055  10.227   1.073
  137   2HB   HIS  24          1HB       HIS  24  10.043  11.634   1.452
  138    HD1  HIS  24           1HD      HIS  24  10.351  10.947  -1.324
  139    HD2  HIS  24           2HD      HIS  24  12.497   8.893   1.580
  140    HE1  HIS  24           1HE      HIS  24  12.309   9.930  -2.528
  141    HE2  HIS  24           2HE      HIS  24  13.548   8.623  -0.766
  142    H    ARG  25           H        ARG  25  10.623  11.949   4.457
  143    HA   ARG  25           HA       ARG  25   8.425  11.659   6.178
  144   1HB   ARG  25          2HB       ARG  25   8.997  13.920   6.977
  145   2HB   ARG  25          1HB       ARG  25  10.411  12.883   6.848
  146   1HG   ARG  25          2HG       ARG  25  10.990  13.943   4.720
  147   2HG   ARG  25          1HG       ARG  25   9.580  14.995   4.868
  148   1HD   ARG  25          2HD       ARG  25  10.492  15.931   6.933
  149   2HD   ARG  25          1HD       ARG  25  11.892  14.870   6.801
  150    HE   ARG  25           HE       ARG  25  11.686  16.367   4.444
  151   1HH1  ARG  25          1HH1      ARG  25  12.387  16.832   7.830
  152   2HH1  ARG  25          2HH1      ARG  25  13.407  18.206   7.559
  153   1HH2  ARG  25          1HH2      ARG  25  13.026  18.172   4.085
  154   2HH2  ARG  25          2HH2      ARG  25  13.769  18.969   5.432
  155    H    ASP  26           H        ASP  26   8.751  13.219   3.116
  156    HA   ASP  26           HA       ASP  26   6.536  14.963   3.285
  157   1HB   ASP  26          2HB       ASP  26   7.822  13.713   0.850
  158   2HB   ASP  26          1HB       ASP  26   6.689  15.060   0.822
  159    H    ILE  27           H        ILE  27   6.708  11.580   3.038
  160    HA   ILE  27           HA       ILE  27   3.905  11.463   2.222
  161    HB   ILE  27           HB       ILE  27   4.363   9.210   1.296
  162   1HG1  ILE  27          2HG1      ILE  27   7.247   9.984   1.799
  163   2HG1  ILE  27          1HG1      ILE  27   6.361   8.701   2.615
  164   1HG2  ILE  27          1HG2      ILE  27   5.672  11.658   0.194
  165   2HG2  ILE  27          2HG2      ILE  27   4.237  10.800  -0.369
  166   3HG2  ILE  27          3HG2      ILE  27   5.839  10.118  -0.650
  167   1HD1  ILE  27          1HD1      ILE  27   7.859   7.830   0.897
  168   2HD1  ILE  27          2HD1      ILE  27   7.007   8.778  -0.323
  169   3HD1  ILE  27          3HD1      ILE  27   6.170   7.479   0.525
  170    H    GLN  28           H        GLN  28   5.320  11.547   4.905
  171    HA   GLN  28           HA       GLN  28   4.754   8.954   6.032
  172   1HB   GLN  28          2HB       GLN  28   6.730  10.224   6.758
  173   2HB   GLN  28          1HB       GLN  28   5.689  11.513   7.338
  174   1HG   GLN  28          2HG       GLN  28   6.368  10.242   9.216
  175   2HG   GLN  28          1HG       GLN  28   4.670   9.874   8.918
  176   1HE2  GLN  28          1HE2      GLN  28   7.552   8.561   9.694
  177   2HE2  GLN  28          2HE2      GLN  28   7.303   6.940   9.153
  178    H    GLY  29           H        GLY  29   3.233   8.539   7.665
  179   1HA   GLY  29          2HA       GLY  29   1.262   8.758   8.821
  180   2HA   GLY  29          1HA       GLY  29   1.465  10.496   8.701
  181    H    ILE  30           H        ILE  30   1.424   8.781   5.717
  182    HA   ILE  30           HA       ILE  30  -0.962  10.127   4.922
  183    HB   ILE  30           HB       ILE  30   0.636   8.020   3.466
  184   1HG1  ILE  30          2HG1      ILE  30   0.612  11.038   3.247
  185   2HG1  ILE  30          1HG1      ILE  30   1.920  10.053   3.897
  186   1HG2  ILE  30          1HG2      ILE  30  -0.546   8.742   1.462
  187   2HG2  ILE  30          2HG2      ILE  30  -1.499   9.877   2.417
  188   3HG2  ILE  30          3HG2      ILE  30  -1.680   8.141   2.670
  189   1HD1  ILE  30          1HD1      ILE  30   0.952   9.748   1.070
  190   2HD1  ILE  30          2HD1      ILE  30   2.471   9.200   1.777
  191   3HD1  ILE  30          3HD1      ILE  30   2.188  10.923   1.523
  192    H    SER  31           H        SER  31  -2.998   9.399   4.835
  193    HA   SER  31           HA       SER  31  -3.503   6.531   5.197
  194   1HB   SER  31          2HB       SER  31  -3.768   7.577   7.402
  195   2HB   SER  31          1HB       SER  31  -4.892   8.752   6.720
  196    HG   SER  31           HG       SER  31  -6.294   7.020   6.232
  197    H    GLY  32           H        GLY  32  -4.944   5.756   3.760
  198   1HA   GLY  32          2HA       GLY  32  -7.237   7.141   2.892
  199   2HA   GLY  32          1HA       GLY  32  -5.964   7.358   1.703
  200    H    ARG  33           H        ARG  33  -7.456   6.255   0.284
  201    HA   ARG  33           HA       ARG  33  -7.633   3.387   0.740
  202   1HB   ARG  33          2HB       ARG  33  -9.201   5.171  -1.066
  203   2HB   ARG  33          1HB       ARG  33  -9.255   3.422  -1.197
  204   1HG   ARG  33          2HG       ARG  33  -9.979   3.263   1.116
  205   2HG   ARG  33          1HG       ARG  33  -9.958   5.023   1.247
  206   1HD   ARG  33          2HD       ARG  33 -11.682   5.182  -0.468
  207   2HD   ARG  33          1HD       ARG  33 -11.677   3.428  -0.651
  208    HE   ARG  33           HE       ARG  33 -12.184   4.078   2.036
  209   1HH1  ARG  33          1HH1      ARG  33 -13.720   4.215  -1.093
  210   2HH1  ARG  33          2HH1      ARG  33 -15.323   4.124  -0.450
  211   1HH2  ARG  33          1HH2      ARG  33 -14.292   3.956   2.884
  212   2HH2  ARG  33          2HH2      ARG  33 -15.649   3.977   1.808
  213    H    VAL  34           H        VAL  34  -7.626   2.105  -1.371
  214    HA   VAL  34           HA       VAL  34  -4.958   2.525  -2.497
  215    HB   VAL  34           HB       VAL  34  -5.414   0.414  -1.303
  216   1HG1  VAL  34          1HG1      VAL  34  -7.790   0.249  -2.132
  217   2HG1  VAL  34          2HG1      VAL  34  -6.857  -1.247  -2.162
  218   3HG1  VAL  34          3HG1      VAL  34  -7.126  -0.344  -3.653
  219   1HG2  VAL  34          1HG2      VAL  34  -4.234  -0.975  -2.812
  220   2HG2  VAL  34          2HG2      VAL  34  -3.702   0.674  -3.143
  221   3HG2  VAL  34          3HG2      VAL  34  -4.864  -0.110  -4.214
  222    H    VAL  35           H        VAL  35  -4.428   2.038  -4.688
  223    HA   VAL  35           HA       VAL  35  -6.680   2.162  -6.584
  224    HB   VAL  35           HB       VAL  35  -4.201   3.167  -7.701
  225   1HG1  VAL  35          1HG1      VAL  35  -5.989   5.068  -8.239
  226   2HG1  VAL  35          2HG1      VAL  35  -7.060   3.719  -7.884
  227   3HG1  VAL  35          3HG1      VAL  35  -5.842   3.562  -9.145
  228   1HG2  VAL  35          1HG2      VAL  35  -4.689   4.159  -5.185
  229   2HG2  VAL  35          2HG2      VAL  35  -5.316   5.398  -6.264
  230   3HG2  VAL  35          3HG2      VAL  35  -3.649   4.864  -6.404
  231    H    ASP  36           H        ASP  36  -3.256   1.470  -6.134
  232    HA   ASP  36           HA       ASP  36  -3.479  -1.122  -7.325
  233   1HB   ASP  36          2HB       ASP  36  -3.299   0.275  -9.342
  234   2HB   ASP  36          1HB       ASP  36  -1.821   0.996  -8.716
  235    H    GLU  37           H        GLU  37  -1.387  -2.306  -7.216
  236    HA   GLU  37           HA       GLU  37   0.467  -1.123  -5.259
  237   1HB   GLU  37          2HB       GLU  37  -0.982  -2.719  -4.093
  238   2HB   GLU  37          1HB       GLU  37  -0.564  -3.967  -5.260
  239   1HG   GLU  37          2HG       GLU  37   1.758  -3.890  -4.522
  240   2HG   GLU  37          1HG       GLU  37   1.349  -2.629  -3.360
  241    H    THR  38           H        THR  38   2.466  -1.007  -6.091
  242    HA   THR  38           HA       THR  38   3.271  -3.084  -8.017
  243    HB   THR  38           HB       THR  38   4.006  -0.155  -8.038
  244    HG1  THR  38           1HG      THR  38   2.304   0.000  -9.223
  245   1HG2  THR  38          1HG2      THR  38   4.802  -2.345  -9.938
  246   2HG2  THR  38          2HG2      THR  38   5.871  -1.439  -8.866
  247   3HG2  THR  38          3HG2      THR  38   5.060  -0.620 -10.201
  248    H    ARG  39           H        ARG  39   5.580  -3.464  -8.140
  249    HA   ARG  39           HA       ARG  39   6.747  -4.151  -5.763
  250   1HB   ARG  39          2HB       ARG  39   7.420  -4.831  -8.107
  251   2HB   ARG  39          1HB       ARG  39   8.301  -3.316  -8.214
  252   1HG   ARG  39          2HG       ARG  39   8.823  -5.445  -6.153
  253   2HG   ARG  39          1HG       ARG  39   9.714  -5.271  -7.663
  254   1HD   ARG  39          2HD       ARG  39  10.275  -2.924  -6.921
  255   2HD   ARG  39          1HD       ARG  39   9.608  -3.351  -5.349
  256    HE   ARG  39           HE       ARG  39  12.168  -4.029  -6.323
  257   1HH1  ARG  39          1HH1      ARG  39   9.541  -5.297  -4.406
  258   2HH1  ARG  39          2HH1      ARG  39  10.550  -6.395  -3.527
  259   1HH2  ARG  39          1HH2      ARG  39  13.495  -5.468  -5.160
  260   2HH2  ARG  39          2HH2      ARG  39  12.792  -6.489  -3.950
  261    H    ASN  40           H        ASN  40   7.445  -1.192  -7.648
  262    HA   ASN  40           HA       ASN  40   8.774  -0.122  -5.257
  263   1HB   ASN  40          2HB       ASN  40   9.944   1.421  -6.750
  264   2HB   ASN  40          1HB       ASN  40  10.216  -0.255  -7.200
  265   1HD2  ASN  40          1HD2      ASN  40   7.114   0.520  -8.168
  266   2HD2  ASN  40          2HD2      ASN  40   7.458   0.977  -9.790
  267    H    THR  41           H        THR  41   5.754   0.018  -6.054
  268    HA   THR  41           HA       THR  41   5.479   2.717  -5.097
  269    HB   THR  41           HB       THR  41   3.905   3.337  -7.019
  270    HG1  THR  41           1HG      THR  41   3.715   1.894  -8.501
  271   1HG2  THR  41          1HG2      THR  41   6.191   4.297  -6.649
  272   2HG2  THR  41          2HG2      THR  41   5.594   4.335  -8.309
  273   3HG2  THR  41          3HG2      THR  41   6.783   3.125  -7.827
  274    H    LEU  42           H        LEU  42   3.325   3.308  -4.548
  275    HA   LEU  42           HA       LEU  42   1.407   1.089  -4.439
  276   1HB   LEU  42          2HB       LEU  42   2.687   1.182  -2.323
  277   2HB   LEU  42          1HB       LEU  42   2.157   2.828  -2.087
  278    HG   LEU  42           HG       LEU  42   0.914   1.215  -0.703
  279   1HD1  LEU  42          1HD1      LEU  42  -1.026   2.279  -2.722
  280   2HD1  LEU  42          2HD1      LEU  42  -0.070   3.386  -1.735
  281   3HD1  LEU  42          3HD1      LEU  42  -1.156   2.229  -0.964
  282   1HD2  LEU  42          1HD2      LEU  42   0.846  -0.281  -3.102
  283   2HD2  LEU  42          2HD2      LEU  42  -0.820   0.130  -2.703
  284   3HD2  LEU  42          3HD2      LEU  42   0.183  -0.719  -1.527
  285    H    ARG  43           H        ARG  43  -0.177   1.876  -5.658
  286    HA   ARG  43           HA       ARG  43  -0.837   4.669  -5.721
  287   1HB   ARG  43          2HB       ARG  43  -1.430   2.295  -7.254
  288   2HB   ARG  43          1HB       ARG  43  -2.882   3.212  -6.950
  289   1HG   ARG  43          2HG       ARG  43  -0.393   4.159  -8.327
  290   2HG   ARG  43          1HG       ARG  43  -1.986   3.901  -9.036
  291   1HD   ARG  43          2HD       ARG  43  -2.897   5.733  -7.738
  292   2HD   ARG  43          1HD       ARG  43  -1.348   5.966  -6.929
  293    HE   ARG  43           HE       ARG  43  -0.698   7.213  -8.714
  294   1HH1  ARG  43          1HH1      ARG  43  -3.272   5.100  -9.763
  295   2HH1  ARG  43          2HH1      ARG  43  -3.290   5.719 -11.379
  296   1HH2  ARG  43          1HH2      ARG  43  -0.727   8.031 -10.839
  297   2HH2  ARG  43          2HH2      ARG  43  -1.847   7.383 -11.989
  298    H    ILE  44           H        ILE  44  -2.236   5.703  -4.477
  299    HA   ILE  44           HA       ILE  44  -4.023   4.162  -2.715
  300    HB   ILE  44           HB       ILE  44  -2.818   6.917  -2.400
  301   1HG1  ILE  44          2HG1      ILE  44  -2.360   4.351  -0.874
  302   2HG1  ILE  44          1HG1      ILE  44  -1.250   5.076  -2.032
  303   1HG2  ILE  44          1HG2      ILE  44  -5.187   6.533  -1.418
  304   2HG2  ILE  44          2HG2      ILE  44  -3.938   7.298  -0.439
  305   3HG2  ILE  44          3HG2      ILE  44  -4.324   5.595  -0.197
  306   1HD1  ILE  44          1HD1      ILE  44  -1.028   7.030  -0.561
  307   2HD1  ILE  44          2HD1      ILE  44  -0.529   5.529   0.221
  308   3HD1  ILE  44          3HD1      ILE  44  -2.092   6.247   0.607
  309    H    GLU  45           H        GLU  45  -6.008   4.048  -3.700
  310    HA   GLU  45           HA       GLU  45  -7.198   6.591  -4.548
  311   1HB   GLU  45          2HB       GLU  45  -6.934   5.275  -6.529
  312   2HB   GLU  45          1HB       GLU  45  -7.591   3.845  -5.755
  313   1HG   GLU  45          2HG       GLU  45  -9.745   5.213  -5.498
  314   2HG   GLU  45          1HG       GLU  45  -9.022   6.322  -6.656
  315    H    MET  46           H        MET  46  -9.194   7.032  -4.009
  316    HA   MET  46           HA       MET  46 -10.581   5.319  -2.062
  317   1HB   MET  46          2HB       MET  46 -10.400   8.336  -2.220
  318   2HB   MET  46          1HB       MET  46 -11.468   7.469  -1.125
  319   1HG   MET  46          2HG       MET  46  -9.698   6.647   0.145
  320   2HG   MET  46          1HG       MET  46  -8.518   6.984  -1.118
  321   1HE   MET  46          1HE       MET  46  -7.461   8.772  -1.640
  322   2HE   MET  46          2HE       MET  46  -6.905   9.862  -0.367
  323   3HE   MET  46          3HE       MET  46  -8.144  10.395  -1.500
  324    H    ASP  47           H        ASP  47 -12.578   4.743  -2.543
  325    HA   ASP  47           HA       ASP  47 -13.733   4.837  -4.973
  326   1HB   ASP  47          2HB       ASP  47 -14.537   3.434  -3.134
  327   2HB   ASP  47          1HB       ASP  47 -15.222   4.853  -2.349
  328    H    ASP  48           H        ASP  48 -13.796   7.446  -2.678
  329    HA   ASP  48           HA       ASP  48 -15.984   8.835  -3.806
  330   1HB   ASP  48          2HB       ASP  48 -15.269  10.743  -2.503
  331   2HB   ASP  48          1HB       ASP  48 -15.117   9.285  -1.531
  332    H    GLY  49           H        GLY  49 -12.984   8.183  -5.112
  333   1HA   GLY  49          2HA       GLY  49 -12.489   8.809  -7.350
  334   2HA   GLY  49          1HA       GLY  49 -13.359  10.310  -7.096
  335    H    ARG  50           H        ARG  50 -11.190   9.302  -4.627
  336    HA   ARG  50           HA       ARG  50  -9.336  11.436  -5.452
  337   1HB   ARG  50          2HB       ARG  50  -9.821  10.213  -2.736
  338   2HB   ARG  50          1HB       ARG  50  -8.596  11.427  -3.078
  339   1HG   ARG  50          2HG       ARG  50 -11.552  11.810  -3.484
  340   2HG   ARG  50          1HG       ARG  50 -10.641  12.367  -2.078
  341   1HD   ARG  50          2HD       ARG  50  -9.255  13.760  -3.540
  342   2HD   ARG  50          1HD       ARG  50 -10.169  13.200  -4.940
  343    HE   ARG  50           HE       ARG  50 -11.965  14.286  -3.089
  344   1HH1  ARG  50          1HH1      ARG  50  -9.382  15.323  -5.194
  345   2HH1  ARG  50          2HH1      ARG  50 -10.028  16.913  -5.412
  346   1HH2  ARG  50          1HH2      ARG  50 -12.818  16.378  -3.375
  347   2HH2  ARG  50          2HH2      ARG  50 -11.980  17.513  -4.379
  348    H    GLU  51           H        GLU  51  -7.418  10.874  -6.244
  349    HA   GLU  51           HA       GLU  51  -6.312   8.255  -5.459
  350   1HB   GLU  51          2HB       GLU  51  -6.144   9.608  -8.159
  351   2HB   GLU  51          1HB       GLU  51  -5.296   8.131  -7.722
  352   1HG   GLU  51          2HG       GLU  51  -7.408   6.989  -7.397
  353   2HG   GLU  51          1HG       GLU  51  -8.287   8.473  -7.763
  354    H    ILE  52           H        ILE  52  -4.150   8.129  -5.011
  355    HA   ILE  52           HA       ILE  52  -2.366  10.345  -5.527
  356    HB   ILE  52           HB       ILE  52  -3.443  11.102  -3.469
  357   1HG1  ILE  52          2HG1      ILE  52  -1.414  11.390  -2.088
  358   2HG1  ILE  52          1HG1      ILE  52  -0.613  10.124  -3.017
  359   1HG2  ILE  52          1HG2      ILE  52  -3.645   9.880  -1.536
  360   2HG2  ILE  52          2HG2      ILE  52  -2.299   8.815  -1.941
  361   3HG2  ILE  52          3HG2      ILE  52  -3.849   8.624  -2.758
  362   1HD1  ILE  52          1HD1      ILE  52  -1.586  12.766  -4.109
  363   2HD1  ILE  52          2HD1      ILE  52  -0.782  11.500  -5.038
  364   3HD1  ILE  52          3HD1      ILE  52   0.092  12.342  -3.756
  365    H    THR  53           H        THR  53  -0.268   9.669  -5.681
  366    HA   THR  53           HA       THR  53   0.202   6.812  -5.290
  367    HB   THR  53           HB       THR  53   0.750   7.757  -7.469
  368    HG1  THR  53           1HG      THR  53   2.095   6.081  -6.495
  369   1HG2  THR  53          1HG2      THR  53   3.143   9.185  -6.709
  370   2HG2  THR  53          2HG2      THR  53   1.683   9.962  -6.097
  371   3HG2  THR  53          3HG2      THR  53   1.855   9.643  -7.823
  372    H    VAL  54           H        VAL  54   1.827   5.948  -4.052
  373    HA   VAL  54           HA       VAL  54   3.650   7.671  -2.597
  374    HB   VAL  54           HB       VAL  54   1.713   5.908  -1.089
  375   1HG1  VAL  54          1HG1      VAL  54   3.935   7.718  -0.144
  376   2HG1  VAL  54          2HG1      VAL  54   3.864   5.963  -0.001
  377   3HG1  VAL  54          3HG1      VAL  54   2.739   6.970   0.912
  378   1HG2  VAL  54          1HG2      VAL  54   1.881   8.914  -1.308
  379   2HG2  VAL  54          2HG2      VAL  54   0.873   8.047  -0.150
  380   3HG2  VAL  54          3HG2      VAL  54   0.571   7.880  -1.880
  381    HA   PRO  55           HA       PRO  55   6.099   4.010  -3.483
  382   1HB   PRO  55          2HB       PRO  55   8.049   5.227  -1.630
  383   2HB   PRO  55          1HB       PRO  55   8.234   4.793  -3.332
  384   1HG   PRO  55          2HG       PRO  55   8.065   7.350  -2.552
  385   2HG   PRO  55          1HG       PRO  55   7.352   6.794  -4.077
  386   1HD   PRO  55          2HD       PRO  55   6.016   7.376  -1.462
  387   2HD   PRO  55          1HD       PRO  55   5.477   7.748  -3.113
  388    H    LYS  56           H        LYS  56   5.736   2.107  -2.530
  389    HA   LYS  56           HA       LYS  56   5.550   1.980   0.393
  390   1HB   LYS  56          2HB       LYS  56   4.481  -0.210   0.052
  391   2HB   LYS  56          1HB       LYS  56   3.629   1.086  -0.770
  392   1HG   LYS  56          2HG       LYS  56   4.583   0.422  -2.889
  393   2HG   LYS  56          1HG       LYS  56   5.559  -0.813  -2.090
  394   1HD   LYS  56          2HD       LYS  56   2.542  -0.736  -2.159
  395   2HD   LYS  56          1HD       LYS  56   3.563  -1.765  -3.163
  396   1HE   LYS  56          2HE       LYS  56   3.385  -1.820  -0.152
  397   2HE   LYS  56          1HE       LYS  56   2.686  -3.002  -1.257
  398   1HZ   LYS  56          1HZ       LYS  56   5.397  -2.740  -0.326
  399   2HZ   LYS  56          2HZ       LYS  56   5.280  -2.961  -1.998
  400   3HZ   LYS  56          3HZ       LYS  56   4.591  -4.092  -0.946
  401    H    GLY  57           H        GLY  57   7.888   1.493  -1.896
  402   1HA   GLY  57          2HA       GLY  57   9.021  -0.967  -1.443
  403   2HA   GLY  57          1HA       GLY  57   9.958   0.485  -1.754
  404    H    ILE  58           H        ILE  58   8.834   1.671   0.788
  405    HA   ILE  58           HA       ILE  58   9.970   0.009   2.841
  406    HB   ILE  58           HB       ILE  58  11.067   2.788   2.428
  407   1HG1  ILE  58          2HG1      ILE  58  13.253   1.467   2.020
  408   2HG1  ILE  58          1HG1      ILE  58  12.200   0.096   1.692
  409   1HG2  ILE  58          1HG2      ILE  58  12.406   2.442   4.297
  410   2HG2  ILE  58          2HG2      ILE  58  12.190   0.692   4.250
  411   3HG2  ILE  58          3HG2      ILE  58  10.865   1.730   4.766
  412   1HD1  ILE  58          1HD1      ILE  58  11.192   2.225   0.178
  413   2HD1  ILE  58          2HD1      ILE  58  12.045   0.792  -0.397
  414   3HD1  ILE  58          3HD1      ILE  58  12.944   2.261  -0.015
  415    H    ALA  59           H        ALA  59   7.438   0.360   2.864
  416    HA   ALA  59           HA       ALA  59   6.989   2.367   4.925
  417   1HB   ALA  59          1HB       ALA  59   5.044   2.239   2.658
  418   2HB   ALA  59          2HB       ALA  59   6.462   3.288   2.598
  419   3HB   ALA  59          3HB       ALA  59   5.259   3.503   3.869
  420    H    VAL  60           H        VAL  60   6.208   1.249   6.602
  421    HA   VAL  60           HA       VAL  60   4.649  -1.142   6.297
  422    HB   VAL  60           HB       VAL  60   6.109  -0.834   8.254
  423   1HG1  VAL  60          1HG1      VAL  60   5.065   1.709   8.350
  424   2HG1  VAL  60          2HG1      VAL  60   6.056   0.951   9.597
  425   3HG1  VAL  60          3HG1      VAL  60   4.298   0.911   9.723
  426   1HG2  VAL  60          1HG2      VAL  60   3.159  -1.149   8.788
  427   2HG2  VAL  60          2HG2      VAL  60   4.403  -1.466   9.999
  428   3HG2  VAL  60          3HG2      VAL  60   4.356  -2.417   8.515
  429    H    PHE  61           H        PHE  61   2.463  -1.358   6.249
  430    HA   PHE  61           HA       PHE  61   0.773   0.749   7.260
  431   1HB   PHE  61          2HB       PHE  61  -0.405   1.124   5.120
  432   2HB   PHE  61          1HB       PHE  61   1.273   1.649   5.064
  433    HD1  PHE  61           1HD      PHE  61  -0.752  -1.410   4.325
  434    HD2  PHE  61           2HD      PHE  61   2.479   1.122   3.197
  435    HE1  PHE  61           1HE      PHE  61  -0.383  -2.781   2.318
  436    HE2  PHE  61           2HE      PHE  61   2.851  -0.243   1.185
  437    HZ   PHE  61           HZ       PHE  61   1.418  -2.197   0.743
  438    H    HIS  62           H        HIS  62  -1.348   0.155   7.566
  439    HA   HIS  62           HA       HIS  62  -1.899  -2.719   7.229
  440   1HB   HIS  62          2HB       HIS  62  -3.175  -0.821   9.209
  441   2HB   HIS  62          1HB       HIS  62  -3.307  -2.575   9.181
  442    HD1  HIS  62           1HD      HIS  62  -0.673  -3.700   9.345
  443    HD2  HIS  62           2HD      HIS  62  -1.475  -0.036  11.131
  444    HE1  HIS  62           1HE      HIS  62   1.125  -3.387  11.072
  445    HE2  HIS  62           2HE      HIS  62   0.566  -1.206  12.203
  446    H    PHE  63           H        PHE  63  -3.526  -3.251   5.851
  447    HA   PHE  63           HA       PHE  63  -5.299  -1.062   5.004
  448   1HB   PHE  63          2HB       PHE  63  -5.584  -2.176   2.901
  449   2HB   PHE  63          1HB       PHE  63  -3.863  -2.100   3.249
  450    HD1  PHE  63           1HD      PHE  63  -2.586  -4.000   3.016
  451    HD2  PHE  63           2HD      PHE  63  -6.787  -4.385   3.578
  452    HE1  PHE  63           1HE      PHE  63  -2.416  -6.418   2.604
  453    HE2  PHE  63           2HE      PHE  63  -6.622  -6.806   3.175
  454    HZ   PHE  63           HZ       PHE  63  -4.435  -7.827   2.686
  455    H    ARG  64           H        ARG  64  -7.436  -1.184   5.190
  456    HA   ARG  64           HA       ARG  64  -8.531  -3.497   6.615
  457   1HB   ARG  64          2HB       ARG  64  -9.634  -0.714   6.177
  458   2HB   ARG  64          1HB       ARG  64 -10.464  -1.986   7.061
  459   1HG   ARG  64          2HG       ARG  64  -7.780  -0.853   7.820
  460   2HG   ARG  64          1HG       ARG  64  -9.322  -0.346   8.511
  461   1HD   ARG  64          2HD       ARG  64  -8.148  -3.122   8.623
  462   2HD   ARG  64          1HD       ARG  64  -8.200  -1.964   9.952
  463    HE   ARG  64           HE       ARG  64 -10.278  -3.707   9.155
  464   1HH1  ARG  64          1HH1      ARG  64  -9.722  -0.480  10.367
  465   2HH1  ARG  64          2HH1      ARG  64 -11.299  -0.337  11.063
  466   1HH2  ARG  64          1HH2      ARG  64 -12.351  -3.519  10.075
  467   2HH2  ARG  64          2HH2      ARG  64 -12.791  -2.061  10.901
  468    H    THR  65           H        THR  65 -10.626  -4.335   6.016
  469    HA   THR  65           HA       THR  65 -11.170  -4.072   3.132
  470    HB   THR  65           HB       THR  65 -11.647  -6.473   4.906
  471    HG1  THR  65           1HG      THR  65  -9.717  -6.032   2.875
  472   1HG2  THR  65          1HG2      THR  65 -11.693  -6.583   1.937
  473   2HG2  THR  65          2HG2      THR  65 -13.130  -6.044   2.805
  474   3HG2  THR  65          3HG2      THR  65 -12.457  -7.644   3.121
  475    HA   PRO  66           HA       PRO  66 -15.110  -2.255   4.003
  476   1HB   PRO  66          2HB       PRO  66 -16.005  -4.189   1.901
  477   2HB   PRO  66          1HB       PRO  66 -16.359  -2.464   2.065
  478   1HG   PRO  66          2HG       PRO  66 -14.539  -3.308   0.320
  479   2HG   PRO  66          1HG       PRO  66 -14.282  -1.824   1.255
  480   1HD   PRO  66          2HD       PRO  66 -13.016  -4.496   1.554
  481   2HD   PRO  66          1HD       PRO  66 -12.360  -2.886   1.914
  482    H    GLN  67           H        GLN  67 -14.922  -5.779   3.628
  483    HA   GLN  67           HA       GLN  67 -17.366  -6.370   4.902
  484   1HB   GLN  67          2HB       GLN  67 -14.861  -8.010   4.525
  485   2HB   GLN  67          1HB       GLN  67 -16.327  -8.652   5.255
  486   1HG   GLN  67          2HG       GLN  67 -16.194  -9.265   2.921
  487   2HG   GLN  67          1HG       GLN  67 -17.559  -8.185   3.200
  488   1HE2  GLN  67          1HE2      GLN  67 -17.811  -6.718   1.693
  489   2HE2  GLN  67          2HE2      GLN  67 -16.559  -5.996   0.744
  490    H    GLY  68           H        GLY  68 -14.416  -5.226   6.146
  491   1HA   GLY  68          2HA       GLY  68 -14.308  -4.417   8.394
  492   2HA   GLY  68          1HA       GLY  68 -15.389  -5.718   8.875
  493    H    GLU  69           H        GLU  69 -12.341  -5.670   7.018
  494    HA   GLU  69           HA       GLU  69 -11.250  -7.543   9.027
  495   1HB   GLU  69          2HB       GLU  69 -10.693  -7.570   6.057
  496   2HB   GLU  69          1HB       GLU  69 -10.025  -8.677   7.247
  497   1HG   GLU  69          2HG       GLU  69 -12.932  -8.419   6.512
  498   2HG   GLU  69          1HG       GLU  69 -11.838  -9.703   5.998
  499    H    LEU  70           H        LEU  70  -8.955  -7.535   9.311
  500    HA   LEU  70           HA       LEU  70  -7.661  -5.011   8.516
  501   1HB   LEU  70          2HB       LEU  70  -8.233  -4.831  10.840
  502   2HB   LEU  70          1HB       LEU  70  -7.580  -6.422  11.180
  503    HG   LEU  70           HG       LEU  70  -5.313  -5.603  10.723
  504   1HD1  LEU  70          1HD1      LEU  70  -4.818  -3.369  10.192
  505   2HD1  LEU  70          2HD1      LEU  70  -6.459  -2.833  10.544
  506   3HD1  LEU  70          3HD1      LEU  70  -6.139  -3.810   9.111
  507   1HD2  LEU  70          1HD2      LEU  70  -6.847  -3.915  12.700
  508   2HD2  LEU  70          2HD2      LEU  70  -5.099  -4.149  12.685
  509   3HD2  LEU  70          3HD2      LEU  70  -6.170  -5.515  13.003
  510    H    VAL  71           H        VAL  71  -5.733  -5.210   7.557
  511    HA   VAL  71           HA       VAL  71  -4.265  -7.744   7.876
  512    HB   VAL  71           HB       VAL  71  -4.580  -6.260   5.269
  513   1HG1  VAL  71          1HG1      VAL  71  -2.923  -8.539   6.164
  514   2HG1  VAL  71          2HG1      VAL  71  -2.604  -7.316   4.934
  515   3HG1  VAL  71          3HG1      VAL  71  -3.669  -8.674   4.571
  516   1HG2  VAL  71          1HG2      VAL  71  -5.896  -8.243   4.560
  517   2HG2  VAL  71          2HG2      VAL  71  -6.677  -7.297   5.827
  518   3HG2  VAL  71          3HG2      VAL  71  -5.868  -8.812   6.229
  519    H    GLU  72           H        GLU  72  -2.009  -7.617   7.683
  520    HA   GLU  72           HA       GLU  72  -0.926  -4.887   7.877
  521   1HB   GLU  72          2HB       GLU  72  -0.745  -6.102   9.984
  522   2HB   GLU  72          1HB       GLU  72   0.067  -7.431   9.170
  523   1HG   GLU  72          2HG       GLU  72   1.935  -5.943   8.626
  524   2HG   GLU  72          1HG       GLU  72   1.123  -4.629   9.473
  525    H    ILE  73           H        ILE  73   0.715  -4.294   6.587
  526    HA   ILE  73           HA       ILE  73   2.210  -6.319   5.102
  527    HB   ILE  73           HB       ILE  73   0.780  -4.024   3.743
  528   1HG1  ILE  73          2HG1      ILE  73  -0.720  -5.890   4.356
  529   2HG1  ILE  73          1HG1      ILE  73  -0.534  -5.736   2.611
  530   1HG2  ILE  73          1HG2      ILE  73   1.979  -6.104   2.078
  531   2HG2  ILE  73          2HG2      ILE  73   3.154  -5.166   3.000
  532   3HG2  ILE  73          3HG2      ILE  73   2.030  -4.348   1.915
  533   1HD1  ILE  73          1HD1      ILE  73  -0.484  -8.080   3.614
  534   2HD1  ILE  73          2HD1      ILE  73   1.127  -7.662   4.198
  535   3HD1  ILE  73          3HD1      ILE  73   0.788  -7.657   2.468
  536    H    ASP  74           H        ASP  74   4.176  -5.809   5.926
  537    HA   ASP  74           HA       ASP  74   4.924  -3.102   6.461
  538   1HB   ASP  74          2HB       ASP  74   7.167  -4.115   6.992
  539   2HB   ASP  74          1HB       ASP  74   5.816  -4.757   7.918
  540    H    GLY  75           H        GLY  75   5.045  -1.845   4.728
  541   1HA   GLY  75          2HA       GLY  75   5.931  -2.463   2.178
  542   2HA   GLY  75          1HA       GLY  75   5.933  -0.855   2.871
  543    H    ARG  76           H        ARG  76   7.814  -2.267   5.003
  544    HA   ARG  76           HA       ARG  76  10.197  -1.271   3.854
  545   1HB   ARG  76          2HB       ARG  76   9.611  -1.297   6.309
  546   2HB   ARG  76          1HB       ARG  76   9.957  -3.017   6.292
  547   1HG   ARG  76          2HG       ARG  76  11.944  -0.878   5.557
  548   2HG   ARG  76          1HG       ARG  76  11.808  -1.612   7.154
  549   1HD   ARG  76          2HD       ARG  76  12.211  -3.834   6.069
  550   2HD   ARG  76          1HD       ARG  76  12.549  -2.971   4.569
  551    HE   ARG  76           HE       ARG  76  14.162  -1.887   6.573
  552   1HH1  ARG  76          1HH1      ARG  76  13.784  -4.882   4.822
  553   2HH1  ARG  76          2HH1      ARG  76  15.454  -5.317   4.955
  554   1HH2  ARG  76          1HH2      ARG  76  16.360  -2.456   6.750
  555   2HH2  ARG  76          2HH2      ARG  76  16.917  -3.940   6.050
  556    H    ALA  77           H        ALA  77   9.487  -4.522   5.023
  557    HA   ALA  77           HA       ALA  77  11.453  -5.570   3.160
  558   1HB   ALA  77          1HB       ALA  77  12.063  -6.422   5.175
  559   2HB   ALA  77          2HB       ALA  77  10.987  -7.706   4.628
  560   3HB   ALA  77          3HB       ALA  77  10.404  -6.492   5.767
  561    H    LEU  78           H        LEU  78   8.055  -5.624   3.775
  562    HA   LEU  78           HA       LEU  78   7.366  -8.015   2.502
  563   1HB   LEU  78          2HB       LEU  78   5.834  -6.613   3.884
  564   2HB   LEU  78          1HB       LEU  78   5.733  -5.482   2.550
  565    HG   LEU  78           HG       LEU  78   3.785  -7.036   2.756
  566   1HD1  LEU  78          1HD1      LEU  78   3.429  -6.828   0.565
  567   2HD1  LEU  78          2HD1      LEU  78   4.830  -7.814   0.151
  568   3HD1  LEU  78          3HD1      LEU  78   5.032  -6.098   0.497
  569   1HD2  LEU  78          1HD2      LEU  78   5.446  -8.978   3.335
  570   2HD2  LEU  78          2HD2      LEU  78   5.466  -9.199   1.587
  571   3HD2  LEU  78          3HD2      LEU  78   3.944  -9.304   2.471
  572    H    VAL  79           H        VAL  79   8.254  -4.934   1.198
  573    HA   VAL  79           HA       VAL  79   7.194  -5.061  -1.356
  574    HB   VAL  79           HB       VAL  79   8.373  -3.090  -0.521
  575   1HG1  VAL  79          1HG1      VAL  79  10.402  -4.914   0.113
  576   2HG1  VAL  79          2HG1      VAL  79  10.408  -3.168   0.358
  577   3HG1  VAL  79          3HG1      VAL  79  11.075  -3.851  -1.123
  578   1HG2  VAL  79          1HG2      VAL  79  10.108  -3.424  -2.775
  579   2HG2  VAL  79          2HG2      VAL  79   8.631  -2.471  -2.638
  580   3HG2  VAL  79          3HG2      VAL  79   8.544  -4.164  -3.117
  581    H    ALA  80           H        ALA  80   7.211  -6.959  -2.435
  582    HA   ALA  80           HA       ALA  80   9.808  -8.274  -2.875
  583   1HB   ALA  80          1HB       ALA  80   8.250  -9.759  -1.829
  584   2HB   ALA  80          2HB       ALA  80   8.455 -10.269  -3.504
  585   3HB   ALA  80          3HB       ALA  80   7.010  -9.380  -3.025
  586    H    ARG  81           H        ARG  81  10.402  -8.922  -4.971
  587    HA   ARG  81           HA       ARG  81   9.847  -7.140  -7.033
  588   1HB   ARG  81          2HB       ARG  81  11.108  -8.586  -8.459
  589   2HB   ARG  81          1HB       ARG  81  11.847  -8.647  -6.867
  590   1HG   ARG  81          2HG       ARG  81  10.017 -10.723  -8.058
  591   2HG   ARG  81          1HG       ARG  81  11.765 -10.847  -7.879
  592   1HD   ARG  81          2HD       ARG  81  11.485 -10.664  -5.425
  593   2HD   ARG  81          1HD       ARG  81   9.736 -10.660  -5.656
  594    HE   ARG  81           HE       ARG  81  10.782 -12.922  -6.922
  595   1HH1  ARG  81          1HH1      ARG  81  10.375 -11.645  -3.699
  596   2HH1  ARG  81          2HH1      ARG  81  10.274 -13.208  -2.959
  597   1HH2  ARG  81          1HH2      ARG  81  10.651 -14.977  -5.949
  598   2HH2  ARG  81          2HH2      ARG  81  10.431 -15.099  -4.235
  599    HA   PRO  82           HA       PRO  82   6.042  -8.162  -8.981
  600   1HB   PRO  82          2HB       PRO  82   6.999  -8.704 -11.584
  601   2HB   PRO  82          1HB       PRO  82   6.401  -7.160 -10.977
  602   1HG   PRO  82          2HG       PRO  82   9.197  -8.128 -11.266
  603   2HG   PRO  82          1HG       PRO  82   8.552  -6.484 -11.418
  604   1HD   PRO  82          2HD       PRO  82   9.945  -7.236  -9.261
  605   2HD   PRO  82          1HD       PRO  82   8.554  -6.140  -9.119
  606    H    GLU  83           H        GLU  83   4.811  -9.936  -9.565
  607    HA   GLU  83           HA       GLU  83   5.887 -12.484  -8.927
  608   1HB   GLU  83          2HB       GLU  83   3.229 -11.708 -10.137
  609   2HB   GLU  83          1HB       GLU  83   3.641 -13.339  -9.625
  610   1HG   GLU  83          2HG       GLU  83   2.383 -12.421  -7.876
  611   2HG   GLU  83          1HG       GLU  83   4.057 -12.375  -7.329
  612    H    GLU  84           H        GLU  84   5.880 -10.692 -11.806
  613    HA   GLU  84           HA       GLU  84   5.944 -13.031 -13.532
  614   1HB   GLU  84          2HB       GLU  84   6.145 -11.407 -15.370
  615   2HB   GLU  84          1HB       GLU  84   4.762 -11.065 -14.340
  616   1HG   GLU  84          2HG       GLU  84   6.041  -9.306 -13.217
  617   2HG   GLU  84          1HG       GLU  84   7.414  -9.643 -14.271
  618    H    ARG  85           H        ARG  85   8.123 -10.389 -12.566
  619    HA   ARG  85           HA       ARG  85  10.395 -12.139 -13.195
  620   1HB   ARG  85          2HB       ARG  85  10.124  -9.242 -14.009
  621   2HB   ARG  85          1HB       ARG  85  11.616 -10.164 -14.110
  622   1HG   ARG  85          2HG       ARG  85   9.105 -10.989 -15.536
  623   2HG   ARG  85          1HG       ARG  85  10.295  -9.899 -16.246
  624   1HD   ARG  85          2HD       ARG  85  10.813 -12.065 -17.046
  625   2HD   ARG  85          1HD       ARG  85  12.019 -11.685 -15.820
  626    HE   ARG  85           HE       ARG  85   9.868 -13.087 -14.654
  627   1HH1  ARG  85          1HH1      ARG  85  12.599 -13.576 -16.768
  628   2HH1  ARG  85          2HH1      ARG  85  12.778 -15.248 -16.355
  629   1HH2  ARG  85          1HH2      ARG  85  10.102 -15.286 -14.107
  630   2HH2  ARG  85          2HH2      ARG  85  11.360 -16.219 -14.845
  631    H    ILE  86           H        ILE  86  12.485 -11.088 -12.337
  632    HA   ILE  86           HA       ILE  86  11.945  -9.995  -9.647
  633    HB   ILE  86           HB       ILE  86  14.305 -11.688 -10.492
  634   1HG1  ILE  86          2HG1      ILE  86  11.851 -12.453  -8.890
  635   2HG1  ILE  86          1HG1      ILE  86  12.227 -12.995 -10.522
  636   1HG2  ILE  86          1HG2      ILE  86  13.642 -11.463  -7.654
  637   2HG2  ILE  86          2HG2      ILE  86  14.129  -9.941  -8.400
  638   3HG2  ILE  86          3HG2      ILE  86  15.200 -11.340  -8.471
  639   1HD1  ILE  86          1HD1      ILE  86  14.467 -13.738  -9.187
  640   2HD1  ILE  86          2HD1      ILE  86  13.075 -14.779  -9.487
  641   3HD1  ILE  86          3HD1      ILE  86  13.230 -13.938  -7.945
  Start of MODEL    3
    1    H    ARG   9           H        ARG   9 -11.383  -8.917  -8.988
    2    HA   ARG   9           HA       ARG   9 -13.332  -9.865  -7.129
    3   1HB   ARG   9          2HB       ARG   9 -11.281 -11.128  -7.615
    4   2HB   ARG   9          1HB       ARG   9 -10.314  -9.829  -6.934
    5   1HG   ARG   9          2HG       ARG   9 -11.291 -10.215  -4.745
    6   2HG   ARG   9          1HG       ARG   9 -12.321 -11.482  -5.415
    7   1HD   ARG   9          2HD       ARG   9 -10.325 -12.764  -6.033
    8   2HD   ARG   9          1HD       ARG   9  -9.305 -11.500  -5.348
    9    HE   ARG   9           HE       ARG   9 -11.087 -12.350  -3.371
   10   1HH1  ARG   9          1HH1      ARG   9  -8.388 -13.595  -5.201
   11   2HH1  ARG   9          2HH1      ARG   9  -7.887 -14.687  -3.955
   12   1HH2  ARG   9          1HH2      ARG   9 -10.429 -13.786  -1.730
   13   2HH2  ARG   9          2HH2      ARG   9  -9.045 -14.797  -1.985
   14    H    HIS  10           H        HIS  10 -13.208  -9.433  -4.772
   15    HA   HIS  10           HA       HIS  10 -12.466  -6.632  -4.239
   16   1HB   HIS  10          2HB       HIS  10 -14.401  -6.480  -2.727
   17   2HB   HIS  10          1HB       HIS  10 -14.894  -6.840  -4.377
   18    HD1  HIS  10           1HD      HIS  10 -15.138  -9.637  -4.738
   19    HD2  HIS  10           2HD      HIS  10 -15.693  -8.029  -0.946
   20    HE1  HIS  10           1HE      HIS  10 -16.435 -11.369  -3.457
   21    HE2  HIS  10           2HE      HIS  10 -16.824 -10.342  -1.190
   22    H    GLU  11           H        GLU  11 -10.909  -6.471  -2.789
   23    HA   GLU  11           HA       GLU  11 -11.007  -7.793  -0.278
   24   1HB   GLU  11          2HB       GLU  11 -10.186  -9.658  -1.699
   25   2HB   GLU  11          1HB       GLU  11  -8.804  -8.674  -2.153
   26   1HG   GLU  11          2HG       GLU  11  -8.139 -10.219  -0.452
   27   2HG   GLU  11          1HG       GLU  11  -8.127  -8.591   0.220
   28    H    LEU  12           H        LEU  12  -8.859  -6.232  -2.643
   29    HA   LEU  12           HA       LEU  12  -7.813  -4.563  -0.450
   30   1HB   LEU  12          2HB       LEU  12  -6.435  -5.370  -3.012
   31   2HB   LEU  12          1HB       LEU  12  -5.785  -4.240  -1.841
   32    HG   LEU  12           HG       LEU  12  -5.921  -6.153  -0.152
   33   1HD1  LEU  12          1HD1      LEU  12  -5.751  -8.412  -1.225
   34   2HD1  LEU  12          2HD1      LEU  12  -6.334  -7.673  -2.715
   35   3HD1  LEU  12          3HD1      LEU  12  -7.351  -7.676  -1.278
   36   1HD2  LEU  12          1HD2      LEU  12  -4.022  -6.589  -2.445
   37   2HD2  LEU  12          2HD2      LEU  12  -3.763  -6.935  -0.734
   38   3HD2  LEU  12          3HD2      LEU  12  -3.857  -5.265  -1.293
   39    H    ILE  13           H        ILE  13  -9.014  -4.633  -3.746
   40    HA   ILE  13           HA       ILE  13  -8.692  -1.802  -4.149
   41    HB   ILE  13           HB       ILE  13 -10.296  -3.796  -5.757
   42   1HG1  ILE  13          2HG1      ILE  13  -7.921  -4.386  -5.675
   43   2HG1  ILE  13          1HG1      ILE  13  -8.360  -3.804  -7.277
   44   1HG2  ILE  13          1HG2      ILE  13  -9.724  -1.938  -7.540
   45   2HG2  ILE  13          2HG2      ILE  13  -9.664  -0.912  -6.108
   46   3HG2  ILE  13          3HG2      ILE  13 -11.137  -1.802  -6.492
   47   1HD1  ILE  13          1HD1      ILE  13  -6.494  -2.586  -7.056
   48   2HD1  ILE  13          2HD1      ILE  13  -6.514  -2.682  -5.295
   49   3HD1  ILE  13          3HD1      ILE  13  -7.535  -1.509  -6.127
   50    H    GLY  14           H        GLY  14  -9.998  -0.293  -3.357
   51   1HA   GLY  14          2HA       GLY  14 -12.278   0.603  -3.343
   52   2HA   GLY  14          1HA       GLY  14 -12.827  -1.003  -2.885
   53    H    LEU  15           H        LEU  15 -10.498  -1.269  -1.015
   54    HA   LEU  15           HA       LEU  15 -11.771   0.077   1.227
   55   1HB   LEU  15          2HB       LEU  15 -10.257  -1.332   2.607
   56   2HB   LEU  15          1HB       LEU  15 -11.338  -2.237   1.568
   57    HG   LEU  15           HG       LEU  15  -9.475  -2.616  -0.014
   58   1HD1  LEU  15          1HD1      LEU  15  -7.945  -0.922   0.191
   59   2HD1  LEU  15          2HD1      LEU  15  -7.156  -2.191   1.126
   60   3HD1  LEU  15          3HD1      LEU  15  -8.033  -0.905   1.951
   61   1HD2  LEU  15          1HD2      LEU  15  -9.951  -4.311   1.613
   62   2HD2  LEU  15          2HD2      LEU  15  -9.012  -3.459   2.840
   63   3HD2  LEU  15          3HD2      LEU  15  -8.202  -4.165   1.443
   64    H    SER  16           H        SER  16 -10.324   0.990   2.954
   65    HA   SER  16           HA       SER  16  -8.502   2.880   1.704
   66   1HB   SER  16          2HB       SER  16  -9.512   2.701   4.555
   67   2HB   SER  16          1HB       SER  16  -8.532   4.013   3.902
   68    HG   SER  16           HG       SER  16 -10.728   4.559   3.854
   69    H    VAL  17           H        VAL  17  -6.396   3.346   2.651
   70    HA   VAL  17           HA       VAL  17  -5.179   1.058   4.031
   71    HB   VAL  17           HB       VAL  17  -4.574   0.760   1.730
   72   1HG1  VAL  17          1HG1      VAL  17  -4.255   3.689   1.787
   73   2HG1  VAL  17          2HG1      VAL  17  -4.810   2.629   0.491
   74   3HG1  VAL  17          3HG1      VAL  17  -3.083   2.802   0.813
   75   1HG2  VAL  17          1HG2      VAL  17  -2.260   2.031   3.193
   76   2HG2  VAL  17          2HG2      VAL  17  -2.145   0.908   1.838
   77   3HG2  VAL  17          3HG2      VAL  17  -2.806   0.365   3.380
   78    H    ARG  18           H        ARG  18  -4.142   1.659   5.809
   79    HA   ARG  18           HA       ARG  18  -3.381   4.483   6.097
   80   1HB   ARG  18          2HB       ARG  18  -4.983   3.665   7.757
   81   2HB   ARG  18          1HB       ARG  18  -3.873   2.380   8.213
   82   1HG   ARG  18          2HG       ARG  18  -2.271   4.028   9.015
   83   2HG   ARG  18          1HG       ARG  18  -3.357   5.330   8.529
   84   1HD   ARG  18          2HD       ARG  18  -5.049   4.493  10.094
   85   2HD   ARG  18          1HD       ARG  18  -3.950   3.204  10.585
   86    HE   ARG  18           HE       ARG  18  -2.644   5.648  10.940
   87   1HH1  ARG  18          1HH1      ARG  18  -5.352   3.887  12.261
   88   2HH1  ARG  18          2HH1      ARG  18  -5.215   4.609  13.830
   89   1HH2  ARG  18          1HH2      ARG  18  -2.463   6.597  13.001
   90   2HH2  ARG  18          2HH2      ARG  18  -3.576   6.148  14.250
   91    H    ILE  19           H        ILE  19  -1.311   5.010   6.076
   92    HA   ILE  19           HA       ILE  19   0.699   2.902   6.249
   93    HB   ILE  19           HB       ILE  19   0.932   5.784   5.374
   94   1HG1  ILE  19          2HG1      ILE  19   1.321   4.799   3.140
   95   2HG1  ILE  19          1HG1      ILE  19   1.040   3.195   3.809
   96   1HG2  ILE  19          1HG2      ILE  19   3.177   4.512   4.461
   97   2HG2  ILE  19          2HG2      ILE  19   2.965   3.803   6.062
   98   3HG2  ILE  19          3HG2      ILE  19   3.099   5.552   5.883
   99   1HD1  ILE  19          1HD1      ILE  19  -0.879   4.378   2.544
  100   2HD1  ILE  19          2HD1      ILE  19  -1.060   5.321   4.023
  101   3HD1  ILE  19          3HD1      ILE  19  -1.243   3.569   4.070
  102    H    ALA  20           H        ALA  20   1.783   2.552   8.059
  103    HA   ALA  20           HA       ALA  20   1.671   4.502  10.217
  104   1HB   ALA  20          1HB       ALA  20   3.054   2.456  11.284
  105   2HB   ALA  20          2HB       ALA  20   2.176   1.604  10.013
  106   3HB   ALA  20          3HB       ALA  20   1.291   2.520  11.233
  107    H    ARG  21           H        ARG  21   3.850   3.407   7.810
  108    HA   ARG  21           HA       ARG  21   5.815   5.327   8.596
  109   1HB   ARG  21          2HB       ARG  21   6.353   3.318  10.017
  110   2HB   ARG  21          1HB       ARG  21   6.663   2.432   8.530
  111   1HG   ARG  21          2HG       ARG  21   8.753   3.146   9.396
  112   2HG   ARG  21          1HG       ARG  21   8.402   4.126   7.969
  113   1HD   ARG  21          2HD       ARG  21   9.280   5.514   9.772
  114   2HD   ARG  21          1HD       ARG  21   7.605   5.940   9.418
  115    HE   ARG  21           HE       ARG  21   7.603   4.047  11.470
  116   1HH1  ARG  21          1HH1      ARG  21   8.626   7.340  10.937
  117   2HH1  ARG  21          2HH1      ARG  21   8.406   7.807  12.590
  118   1HH2  ARG  21          1HH2      ARG  21   7.313   4.659  13.642
  119   2HH2  ARG  21          2HH2      ARG  21   7.662   6.285  14.125
  120    H    SER  22           H        SER  22   7.332   5.746   6.945
  121    HA   SER  22           HA       SER  22   7.007   4.252   4.449
  122   1HB   SER  22          2HB       SER  22   6.750   7.259   4.664
  123   2HB   SER  22          1HB       SER  22   6.815   6.349   3.155
  124    HG   SER  22           HG       SER  22   4.841   5.564   3.516
  125    H    VAL  23           H        VAL  23   8.675   4.843   2.814
  126    HA   VAL  23           HA       VAL  23  11.247   4.614   3.871
  127    HB   VAL  23           HB       VAL  23  10.653   3.933   1.578
  128   1HG1  VAL  23          1HG1      VAL  23   9.242   5.919   1.069
  129   2HG1  VAL  23          2HG1      VAL  23  10.402   5.527  -0.200
  130   3HG1  VAL  23          3HG1      VAL  23  10.718   6.870   0.898
  131   1HG2  VAL  23          1HG2      VAL  23  12.721   4.569   0.527
  132   2HG2  VAL  23          2HG2      VAL  23  13.013   4.345   2.252
  133   3HG2  VAL  23          3HG2      VAL  23  12.877   5.971   1.585
  134    H    HIS  24           H        HIS  24   9.566   7.466   2.581
  135    HA   HIS  24           HA       HIS  24  11.735   9.152   3.636
  136   1HB   HIS  24          2HB       HIS  24   9.647   9.740   1.528
  137   2HB   HIS  24          1HB       HIS  24  10.795  10.922   2.142
  138    HD1  HIS  24           1HD      HIS  24  11.090  10.639  -0.712
  139    HD2  HIS  24           2HD      HIS  24  12.879   7.909   1.858
  140    HE1  HIS  24           1HE      HIS  24  12.942   9.580  -2.041
  141    HE2  HIS  24           2HE      HIS  24  13.957   7.872  -0.493
  142    H    ARG  25           H        ARG  25  11.338  10.668   5.160
  143    HA   ARG  25           HA       ARG  25   9.106  10.412   6.824
  144   1HB   ARG  25          2HB       ARG  25  11.038  12.724   6.593
  145   2HB   ARG  25          1HB       ARG  25   9.926  12.461   7.931
  146   1HG   ARG  25          2HG       ARG  25  11.063  10.364   8.466
  147   2HG   ARG  25          1HG       ARG  25  12.180  10.632   7.125
  148   1HD   ARG  25          2HD       ARG  25  11.842  12.420   9.532
  149   2HD   ARG  25          1HD       ARG  25  13.172  11.293   9.262
  150    HE   ARG  25           HE       ARG  25  13.030  13.034   7.076
  151   1HH1  ARG  25          1HH1      ARG  25  13.793  13.113  10.481
  152   2HH1  ARG  25          2HH1      ARG  25  14.891  14.443  10.331
  153   1HH2  ARG  25          1HH2      ARG  25  14.473  14.785   6.878
  154   2HH2  ARG  25          2HH2      ARG  25  15.277  15.393   8.287
  155    H    ASP  26           H        ASP  26   9.523  12.217   3.938
  156    HA   ASP  26           HA       ASP  26   7.486  14.149   4.461
  157   1HB   ASP  26          2HB       ASP  26   8.808  13.344   1.865
  158   2HB   ASP  26          1HB       ASP  26   7.748  14.735   2.073
  159    H    ILE  27           H        ILE  27   7.313  10.892   3.833
  160    HA   ILE  27           HA       ILE  27   4.588  11.168   2.838
  161    HB   ILE  27           HB       ILE  27   4.896   9.139   1.446
  162   1HG1  ILE  27          2HG1      ILE  27   7.814   9.569   2.120
  163   2HG1  ILE  27          1HG1      ILE  27   6.827   8.198   2.609
  164   1HG2  ILE  27          1HG2      ILE  27   6.458  11.634   0.884
  165   2HG2  ILE  27          2HG2      ILE  27   4.911  11.114   0.218
  166   3HG2  ILE  27          3HG2      ILE  27   6.400  10.313  -0.284
  167   1HD1  ILE  27          1HD1      ILE  27   7.090   7.161   0.645
  168   2HD1  ILE  27          2HD1      ILE  27   8.458   8.254   0.436
  169   3HD1  ILE  27          3HD1      ILE  27   6.895   8.649  -0.280
  170    H    GLN  28           H        GLN  28   6.304  10.247   5.391
  171    HA   GLN  28           HA       GLN  28   5.106   7.663   5.838
  172   1HB   GLN  28          2HB       GLN  28   6.363   7.626   7.910
  173   2HB   GLN  28          1HB       GLN  28   7.413   8.120   6.589
  174   1HG   GLN  28          2HG       GLN  28   7.177  10.452   7.271
  175   2HG   GLN  28          1HG       GLN  28   6.124   9.959   8.593
  176   1HE2  GLN  28          1HE2      GLN  28   8.442   7.605   8.224
  177   2HE2  GLN  28          2HE2      GLN  28   9.578   8.158   9.398
  178    H    GLY  29           H        GLY  29   3.612   7.163   7.451
  179   1HA   GLY  29          2HA       GLY  29   1.914   7.528   8.967
  180   2HA   GLY  29          1HA       GLY  29   2.513   9.164   9.178
  181    H    ILE  30           H        ILE  30   2.053   8.676   5.923
  182    HA   ILE  30           HA       ILE  30  -0.364  10.247   5.969
  183    HB   ILE  30           HB       ILE  30   1.235   9.295   3.591
  184   1HG1  ILE  30          2HG1      ILE  30   2.581  10.720   5.059
  185   2HG1  ILE  30          1HG1      ILE  30   2.180  11.569   3.567
  186   1HG2  ILE  30          1HG2      ILE  30  -1.130   9.916   3.142
  187   2HG2  ILE  30          2HG2      ILE  30   0.044  10.945   2.322
  188   3HG2  ILE  30          3HG2      ILE  30  -0.783  11.527   3.768
  189   1HD1  ILE  30          1HD1      ILE  30   1.980  13.037   5.498
  190   2HD1  ILE  30          2HD1      ILE  30   0.812  11.934   6.231
  191   3HD1  ILE  30          3HD1      ILE  30   0.408  12.783   4.738
  192    H    SER  31           H        SER  31  -2.333   9.389   5.845
  193    HA   SER  31           HA       SER  31  -2.631   6.600   5.036
  194   1HB   SER  31          2HB       SER  31  -4.646   8.521   6.234
  195   2HB   SER  31          1HB       SER  31  -4.913   6.803   5.944
  196    HG   SER  31           HG       SER  31  -4.201   7.541   8.140
  197    H    GLY  32           H        GLY  32  -4.406   5.993   3.549
  198   1HA   GLY  32          2HA       GLY  32  -5.639   7.965   1.910
  199   2HA   GLY  32          1HA       GLY  32  -4.229   7.292   1.109
  200    H    ARG  33           H        ARG  33  -5.947   6.702  -0.444
  201    HA   ARG  33           HA       ARG  33  -7.324   4.247   0.347
  202   1HB   ARG  33          2HB       ARG  33  -8.007   6.280  -1.735
  203   2HB   ARG  33          1HB       ARG  33  -8.682   4.665  -1.766
  204   1HG   ARG  33          2HG       ARG  33 -10.098   6.421  -0.663
  205   2HG   ARG  33          1HG       ARG  33  -9.798   4.955   0.267
  206   1HD   ARG  33          2HD       ARG  33  -8.177   6.060   1.621
  207   2HD   ARG  33          1HD       ARG  33  -8.195   7.488   0.589
  208    HE   ARG  33           HE       ARG  33 -10.781   7.057   1.573
  209   1HH1  ARG  33          1HH1      ARG  33  -7.620   7.973   2.730
  210   2HH1  ARG  33          2HH1      ARG  33  -8.235   8.919   4.042
  211   1HH2  ARG  33          1HH2      ARG  33 -11.594   8.303   3.300
  212   2HH2  ARG  33          2HH2      ARG  33 -10.491   9.107   4.365
  213    H    VAL  34           H        VAL  34  -7.703   2.752  -1.626
  214    HA   VAL  34           HA       VAL  34  -5.000   2.154  -2.617
  215    HB   VAL  34           HB       VAL  34  -7.356   0.287  -2.391
  216   1HG1  VAL  34          1HG1      VAL  34  -4.441  -0.249  -2.958
  217   2HG1  VAL  34          2HG1      VAL  34  -5.776  -0.412  -4.101
  218   3HG1  VAL  34          3HG1      VAL  34  -5.679  -1.480  -2.701
  219   1HG2  VAL  34          1HG2      VAL  34  -6.776   0.857  -0.186
  220   2HG2  VAL  34          2HG2      VAL  34  -5.051   0.860  -0.551
  221   3HG2  VAL  34          3HG2      VAL  34  -5.939  -0.662  -0.498
  222    H    VAL  35           H        VAL  35  -4.544   1.527  -4.736
  223    HA   VAL  35           HA       VAL  35  -6.740   1.577  -6.647
  224    HB   VAL  35           HB       VAL  35  -5.717   3.864  -6.712
  225   1HG1  VAL  35          1HG1      VAL  35  -3.616   4.309  -7.387
  226   2HG1  VAL  35          2HG1      VAL  35  -3.437   2.760  -8.213
  227   3HG1  VAL  35          3HG1      VAL  35  -3.369   2.840  -6.459
  228   1HG2  VAL  35          1HG2      VAL  35  -6.008   4.066  -9.001
  229   2HG2  VAL  35          2HG2      VAL  35  -6.899   2.594  -8.618
  230   3HG2  VAL  35          3HG2      VAL  35  -5.287   2.490  -9.326
  231    H    ASP  36           H        ASP  36  -3.237   1.038  -6.220
  232    HA   ASP  36           HA       ASP  36  -3.453  -1.562  -7.394
  233   1HB   ASP  36          2HB       ASP  36  -1.859   0.578  -8.818
  234   2HB   ASP  36          1HB       ASP  36  -1.768  -1.143  -9.177
  235    H    GLU  37           H        GLU  37  -1.259  -2.646  -7.467
  236    HA   GLU  37           HA       GLU  37   0.551  -1.549  -5.421
  237   1HB   GLU  37          2HB       GLU  37  -0.329  -4.433  -5.675
  238   2HB   GLU  37          1HB       GLU  37   0.888  -3.837  -4.554
  239   1HG   GLU  37          2HG       GLU  37  -0.803  -2.465  -3.447
  240   2HG   GLU  37          1HG       GLU  37  -2.022  -3.066  -4.570
  241    H    THR  38           H        THR  38   2.698  -1.633  -5.937
  242    HA   THR  38           HA       THR  38   3.423  -3.194  -8.329
  243    HB   THR  38           HB       THR  38   4.467  -0.484  -7.507
  244    HG1  THR  38           1HG      THR  38   2.876  -1.247  -9.723
  245   1HG2  THR  38          1HG2      THR  38   5.349  -2.395  -9.583
  246   2HG2  THR  38          2HG2      THR  38   6.276  -1.220  -8.651
  247   3HG2  THR  38          3HG2      THR  38   5.290  -0.685 -10.012
  248    H    ARG  39           H        ARG  39   5.558  -4.005  -8.422
  249    HA   ARG  39           HA       ARG  39   6.501  -5.303  -6.218
  250   1HB   ARG  39          2HB       ARG  39   8.621  -5.584  -7.422
  251   2HB   ARG  39          1HB       ARG  39   7.238  -5.826  -8.480
  252   1HG   ARG  39          2HG       ARG  39   7.523  -3.592  -9.394
  253   2HG   ARG  39          1HG       ARG  39   8.883  -3.310  -8.307
  254   1HD   ARG  39          2HD       ARG  39  10.121  -5.120  -9.359
  255   2HD   ARG  39          1HD       ARG  39   8.755  -5.458 -10.422
  256    HE   ARG  39           HE       ARG  39  10.747  -3.489 -10.810
  257   1HH1  ARG  39          1HH1      ARG  39   7.329  -4.057 -11.242
  258   2HH1  ARG  39          2HH1      ARG  39   7.169  -2.891 -12.511
  259   1HH2  ARG  39          1HH2      ARG  39  10.536  -1.959 -12.484
  260   2HH2  ARG  39          2HH2      ARG  39   8.989  -1.701 -13.217
  261    H    ASN  40           H        ASN  40   7.481  -2.086  -7.343
  262    HA   ASN  40           HA       ASN  40   8.772  -1.700  -4.730
  263   1HB   ASN  40          2HB       ASN  40  10.494  -0.314  -5.794
  264   2HB   ASN  40          1HB       ASN  40  10.517  -1.964  -6.391
  265   1HD2  ASN  40          1HD2      ASN  40   7.884  -0.433  -7.776
  266   2HD2  ASN  40          2HD2      ASN  40   8.623   0.060  -9.248
  267    H    THR  41           H        THR  41   6.061  -0.911  -5.869
  268    HA   THR  41           HA       THR  41   6.113   1.732  -4.742
  269    HB   THR  41           HB       THR  41   4.893   2.707  -6.778
  270    HG1  THR  41           1HG      THR  41   6.329   0.705  -8.156
  271   1HG2  THR  41          1HG2      THR  41   7.203   3.318  -6.081
  272   2HG2  THR  41          2HG2      THR  41   6.876   3.480  -7.808
  273   3HG2  THR  41          3HG2      THR  41   7.799   2.101  -7.209
  274    H    LEU  42           H        LEU  42   4.012   2.619  -4.381
  275    HA   LEU  42           HA       LEU  42   1.879   0.586  -4.456
  276   1HB   LEU  42          2HB       LEU  42   2.854   0.905  -2.211
  277   2HB   LEU  42          1HB       LEU  42   2.430   2.598  -2.271
  278    HG   LEU  42           HG       LEU  42   0.899   1.270  -0.873
  279   1HD1  LEU  42          1HD1      LEU  42  -0.649   2.166  -3.279
  280   2HD1  LEU  42          2HD1      LEU  42   0.217   3.328  -2.275
  281   3HD1  LEU  42          3HD1      LEU  42  -1.052   2.329  -1.571
  282   1HD2  LEU  42          1HD2      LEU  42   0.862  -0.853  -1.891
  283   2HD2  LEU  42          2HD2      LEU  42   0.422  -0.188  -3.463
  284   3HD2  LEU  42          3HD2      LEU  42  -0.754  -0.195  -2.150
  285    H    ARG  43           H        ARG  43   0.126   1.215  -5.531
  286    HA   ARG  43           HA       ARG  43  -0.150   4.056  -6.154
  287   1HB   ARG  43          2HB       ARG  43  -0.194   1.927  -7.792
  288   2HB   ARG  43          1HB       ARG  43  -1.904   2.024  -7.423
  289   1HG   ARG  43          2HG       ARG  43  -1.922   4.360  -8.200
  290   2HG   ARG  43          1HG       ARG  43  -0.207   4.229  -8.574
  291   1HD   ARG  43          2HD       ARG  43  -0.695   2.438 -10.177
  292   2HD   ARG  43          1HD       ARG  43  -2.413   2.582  -9.813
  293    HE   ARG  43           HE       ARG  43  -2.494   4.324 -11.269
  294   1HH1  ARG  43          1HH1      ARG  43   0.805   3.989 -10.177
  295   2HH1  ARG  43          2HH1      ARG  43   1.394   5.282 -11.167
  296   1HH2  ARG  43          1HH2      ARG  43  -1.719   6.020 -12.574
  297   2HH2  ARG  43          2HH2      ARG  43  -0.038   6.434 -12.530
  298    H    ILE  44           H        ILE  44  -1.915   5.234  -5.544
  299    HA   ILE  44           HA       ILE  44  -3.825   3.921  -3.716
  300    HB   ILE  44           HB       ILE  44  -2.576   6.661  -3.625
  301   1HG1  ILE  44          2HG1      ILE  44  -2.603   4.366  -1.658
  302   2HG1  ILE  44          1HG1      ILE  44  -1.250   4.837  -2.681
  303   1HG2  ILE  44          1HG2      ILE  44  -4.194   6.244  -1.332
  304   2HG2  ILE  44          2HG2      ILE  44  -5.196   6.021  -2.764
  305   3HG2  ILE  44          3HG2      ILE  44  -4.300   7.518  -2.543
  306   1HD1  ILE  44          1HD1      ILE  44  -1.760   7.161  -1.383
  307   2HD1  ILE  44          2HD1      ILE  44  -0.576   5.958  -0.869
  308   3HD1  ILE  44          3HD1      ILE  44  -2.187   5.972  -0.153
  309    H    GLU  45           H        GLU  45  -5.962   4.074  -4.138
  310    HA   GLU  45           HA       GLU  45  -6.891   6.350  -5.719
  311   1HB   GLU  45          2HB       GLU  45  -7.049   4.708  -7.381
  312   2HB   GLU  45          1HB       GLU  45  -7.571   3.463  -6.256
  313   1HG   GLU  45          2HG       GLU  45  -9.724   4.602  -6.026
  314   2HG   GLU  45          1HG       GLU  45  -9.182   5.844  -7.152
  315    H    MET  46           H        MET  46  -8.580   7.305  -4.986
  316    HA   MET  46           HA       MET  46  -9.852   6.335  -2.533
  317   1HB   MET  46          2HB       MET  46  -9.564   9.085  -3.744
  318   2HB   MET  46          1HB       MET  46 -10.601   8.758  -2.366
  319   1HG   MET  46          2HG       MET  46  -8.504   9.685  -1.639
  320   2HG   MET  46          1HG       MET  46  -8.654   8.025  -1.085
  321   1HE   MET  46          1HE       MET  46  -6.629   9.441  -4.734
  322   2HE   MET  46          2HE       MET  46  -5.708  10.180  -3.430
  323   3HE   MET  46          3HE       MET  46  -7.450  10.432  -3.533
  324    H    ASP  47           H        ASP  47 -11.914   5.721  -2.550
  325    HA   ASP  47           HA       ASP  47 -13.418   5.184  -4.736
  326   1HB   ASP  47          2HB       ASP  47 -15.394   5.156  -3.263
  327   2HB   ASP  47          1HB       ASP  47 -14.002   4.383  -2.512
  328    H    ASP  48           H        ASP  48 -13.068   8.282  -3.225
  329    HA   ASP  48           HA       ASP  48 -15.306   9.578  -4.327
  330   1HB   ASP  48          2HB       ASP  48 -12.615  10.731  -3.560
  331   2HB   ASP  48          1HB       ASP  48 -14.071  11.671  -3.870
  332    H    GLY  49           H        GLY  49 -12.530   8.360  -5.835
  333   1HA   GLY  49          2HA       GLY  49 -12.380   8.261  -8.209
  334   2HA   GLY  49          1HA       GLY  49 -13.218   9.803  -8.296
  335    H    ARG  50           H        ARG  50 -10.714   9.412  -5.961
  336    HA   ARG  50           HA       ARG  50  -9.013  11.219  -7.548
  337   1HB   ARG  50          2HB       ARG  50  -9.025  10.700  -4.571
  338   2HB   ARG  50          1HB       ARG  50  -7.959  11.826  -5.400
  339   1HG   ARG  50          2HG       ARG  50 -10.961  12.007  -5.239
  340   2HG   ARG  50          1HG       ARG  50  -9.803  12.994  -4.346
  341   1HD   ARG  50          2HD       ARG  50  -8.952  13.902  -6.449
  342   2HD   ARG  50          1HD       ARG  50 -10.094  12.905  -7.348
  343    HE   ARG  50           HE       ARG  50 -11.525  14.462  -5.515
  344   1HH1  ARG  50          1HH1      ARG  50  -9.629  14.854  -8.418
  345   2HH1  ARG  50          2HH1      ARG  50 -10.474  16.274  -8.929
  346   1HH2  ARG  50          1HH2      ARG  50 -12.639  16.331  -6.186
  347   2HH2  ARG  50          2HH2      ARG  50 -12.185  17.113  -7.661
  348    H    GLU  51           H        GLU  51  -6.836  10.765  -7.894
  349    HA   GLU  51           HA       GLU  51  -5.941   8.096  -7.047
  350   1HB   GLU  51          2HB       GLU  51  -4.945   7.749  -9.211
  351   2HB   GLU  51          1HB       GLU  51  -6.635   8.184  -9.425
  352   1HG   GLU  51          2HG       GLU  51  -5.994  10.464  -9.981
  353   2HG   GLU  51          1HG       GLU  51  -4.295  10.044  -9.760
  354    H    ILE  52           H        ILE  52  -3.866   7.887  -6.373
  355    HA   ILE  52           HA       ILE  52  -1.869   9.913  -6.841
  356    HB   ILE  52           HB       ILE  52  -3.079  10.910  -4.957
  357   1HG1  ILE  52          2HG1      ILE  52  -0.380   9.786  -4.170
  358   2HG1  ILE  52          1HG1      ILE  52  -0.648  11.238  -5.136
  359   1HG2  ILE  52          1HG2      ILE  52  -3.533   9.861  -2.966
  360   2HG2  ILE  52          2HG2      ILE  52  -2.239   8.679  -3.170
  361   3HG2  ILE  52          3HG2      ILE  52  -3.726   8.531  -4.108
  362   1HD1  ILE  52          1HD1      ILE  52  -1.757  12.301  -3.224
  363   2HD1  ILE  52          2HD1      ILE  52  -0.110  11.806  -2.824
  364   3HD1  ILE  52          3HD1      ILE  52  -1.481  10.851  -2.260
  365    H    THR  53           H        THR  53   0.271   9.220  -6.147
  366    HA   THR  53           HA       THR  53   0.387   6.315  -5.645
  367    HB   THR  53           HB       THR  53   2.330   8.044  -7.181
  368    HG1  THR  53           1HG      THR  53   0.484   6.066  -8.025
  369   1HG2  THR  53          1HG2      THR  53   3.479   6.186  -6.085
  370   2HG2  THR  53          2HG2      THR  53   3.433   5.997  -7.837
  371   3HG2  THR  53          3HG2      THR  53   2.339   5.058  -6.820
  372    H    VAL  54           H        VAL  54   2.142   5.477  -4.402
  373    HA   VAL  54           HA       VAL  54   3.782   7.317  -2.879
  374    HB   VAL  54           HB       VAL  54   1.869   5.466  -1.449
  375   1HG1  VAL  54          1HG1      VAL  54   3.990   5.670  -0.281
  376   2HG1  VAL  54          2HG1      VAL  54   2.732   6.545   0.594
  377   3HG1  VAL  54          3HG1      VAL  54   3.903   7.428  -0.385
  378   1HG2  VAL  54          1HG2      VAL  54   0.864   7.562  -0.582
  379   2HG2  VAL  54          2HG2      VAL  54   0.669   7.370  -2.324
  380   3HG2  VAL  54          3HG2      VAL  54   1.888   8.474  -1.689
  381    HA   PRO  55           HA       PRO  55   6.481   3.793  -3.281
  382   1HB   PRO  55          2HB       PRO  55   8.249   4.943  -1.285
  383   2HB   PRO  55          1HB       PRO  55   8.475   4.830  -3.031
  384   1HG   PRO  55          2HG       PRO  55   8.073   7.184  -1.725
  385   2HG   PRO  55          1HG       PRO  55   7.593   6.907  -3.410
  386   1HD   PRO  55          2HD       PRO  55   5.917   6.855  -0.925
  387   2HD   PRO  55          1HD       PRO  55   5.547   7.538  -2.524
  388    H    LYS  56           H        LYS  56   6.007   1.872  -2.398
  389    HA   LYS  56           HA       LYS  56   5.683   1.669   0.511
  390   1HB   LYS  56          2HB       LYS  56   4.677  -0.541   0.058
  391   2HB   LYS  56          1HB       LYS  56   3.819   0.780  -0.712
  392   1HG   LYS  56          2HG       LYS  56   4.799   0.234  -2.845
  393   2HG   LYS  56          1HG       LYS  56   5.812  -1.001  -2.098
  394   1HD   LYS  56          2HD       LYS  56   2.796  -1.032  -2.178
  395   2HD   LYS  56          1HD       LYS  56   3.853  -1.962  -3.238
  396   1HE   LYS  56          2HE       LYS  56   4.783  -3.116  -1.283
  397   2HE   LYS  56          1HE       LYS  56   3.709  -2.194  -0.233
  398   1HZ   LYS  56          1HZ       LYS  56   1.850  -3.303  -1.028
  399   2HZ   LYS  56          2HZ       LYS  56   3.005  -4.532  -0.926
  400   3HZ   LYS  56          3HZ       LYS  56   2.632  -3.848  -2.427
  401    H    GLY  57           H        GLY  57   8.127   1.258  -1.684
  402   1HA   GLY  57          2HA       GLY  57   9.254  -1.209  -1.244
  403   2HA   GLY  57          1HA       GLY  57  10.197   0.259  -1.464
  404    H    ILE  58           H        ILE  58   8.971   1.407   1.009
  405    HA   ILE  58           HA       ILE  58   9.940  -0.284   3.123
  406    HB   ILE  58           HB       ILE  58  11.119   2.476   2.792
  407   1HG1  ILE  58          2HG1      ILE  58  13.300   1.116   2.522
  408   2HG1  ILE  58          1HG1      ILE  58  12.247  -0.240   2.130
  409   1HG2  ILE  58          1HG2      ILE  58  12.329   2.095   4.740
  410   2HG2  ILE  58          2HG2      ILE  58  12.068   0.351   4.681
  411   3HG2  ILE  58          3HG2      ILE  58  10.740   1.429   5.107
  412   1HD1  ILE  58          1HD1      ILE  58  11.381   1.911   0.552
  413   2HD1  ILE  58          2HD1      ILE  58  12.225   0.452   0.036
  414   3HD1  ILE  58          3HD1      ILE  58  13.142   1.896   0.465
  415    H    ALA  59           H        ALA  59   7.424   0.114   2.978
  416    HA   ALA  59           HA       ALA  59   6.865   2.168   4.971
  417   1HB   ALA  59          1HB       ALA  59   5.271   3.311   3.780
  418   2HB   ALA  59          2HB       ALA  59   4.962   1.959   2.690
  419   3HB   ALA  59          3HB       ALA  59   6.434   2.917   2.516
  420    H    VAL  60           H        VAL  60   6.013   1.104   6.638
  421    HA   VAL  60           HA       VAL  60   4.473  -1.305   6.320
  422    HB   VAL  60           HB       VAL  60   5.892  -0.976   8.304
  423   1HG1  VAL  60          1HG1      VAL  60   4.877   1.574   8.340
  424   2HG1  VAL  60          2HG1      VAL  60   5.822   0.824   9.626
  425   3HG1  VAL  60          3HG1      VAL  60   4.060   0.808   9.702
  426   1HG2  VAL  60          1HG2      VAL  60   2.936  -1.325   8.706
  427   2HG2  VAL  60          2HG2      VAL  60   4.081  -1.497  10.035
  428   3HG2  VAL  60          3HG2      VAL  60   4.194  -2.559   8.631
  429    H    PHE  61           H        PHE  61   2.305  -1.461   6.067
  430    HA   PHE  61           HA       PHE  61   0.575   0.626   7.074
  431   1HB   PHE  61          2HB       PHE  61  -0.506   0.997   4.850
  432   2HB   PHE  61          1HB       PHE  61   1.137   1.614   4.968
  433    HD1  PHE  61           1HD      PHE  61  -0.567  -1.567   3.978
  434    HD2  PHE  61           2HD      PHE  61   2.480   1.289   3.161
  435    HE1  PHE  61           1HE      PHE  61   0.066  -2.824   1.962
  436    HE2  PHE  61           2HE      PHE  61   3.114   0.039   1.141
  437    HZ   PHE  61           HZ       PHE  61   1.907  -2.020   0.539
  438    H    HIS  62           H        HIS  62  -1.613   0.073   7.151
  439    HA   HIS  62           HA       HIS  62  -2.173  -2.782   6.687
  440   1HB   HIS  62          2HB       HIS  62  -3.175  -0.963   8.886
  441   2HB   HIS  62          1HB       HIS  62  -3.784  -2.587   8.598
  442    HD1  HIS  62           1HD      HIS  62  -2.778  -2.454  11.265
  443    HD2  HIS  62           2HD      HIS  62  -0.135  -2.940   8.098
  444    HE1  HIS  62           1HE      HIS  62  -0.690  -3.422  12.276
  445    HE2  HIS  62           2HE      HIS  62   0.934  -3.600  10.357
  446    H    PHE  63           H        PHE  63  -4.045  -3.324   5.657
  447    HA   PHE  63           HA       PHE  63  -5.506  -1.134   4.399
  448   1HB   PHE  63          2HB       PHE  63  -5.308  -4.088   3.860
  449   2HB   PHE  63          1HB       PHE  63  -6.570  -3.113   3.119
  450    HD1  PHE  63           1HD      PHE  63  -3.259  -1.675   3.719
  451    HD2  PHE  63           2HD      PHE  63  -5.766  -3.650   0.902
  452    HE1  PHE  63           1HE      PHE  63  -1.715  -1.051   1.909
  453    HE2  PHE  63           2HE      PHE  63  -4.225  -3.029  -0.910
  454    HZ   PHE  63           HZ       PHE  63  -2.195  -1.729  -0.407
  455    H    ARG  64           H        ARG  64  -7.397  -0.460   5.127
  456    HA   ARG  64           HA       ARG  64  -8.907  -2.191   6.964
  457   1HB   ARG  64          2HB       ARG  64  -8.218  -0.058   7.928
  458   2HB   ARG  64          1HB       ARG  64  -8.968   0.812   6.598
  459   1HG   ARG  64          2HG       ARG  64 -10.355   0.921   8.573
  460   2HG   ARG  64          1HG       ARG  64 -11.164  -0.006   7.308
  461   1HD   ARG  64          2HD       ARG  64 -10.464  -2.085   8.388
  462   2HD   ARG  64          1HD       ARG  64  -9.650  -1.160   9.648
  463    HE   ARG  64           HE       ARG  64 -12.324  -0.348   9.546
  464   1HH1  ARG  64          1HH1      ARG  64 -10.444  -3.163  10.394
  465   2HH1  ARG  64          2HH1      ARG  64 -11.592  -3.736  11.556
  466   1HH2  ARG  64          1HH2      ARG  64 -13.834  -1.098  11.077
  467   2HH2  ARG  64          2HH2      ARG  64 -13.518  -2.562  11.943
  468    H    THR  65           H        THR  65 -10.536  -3.234   6.021
  469    HA   THR  65           HA       THR  65 -11.786  -2.154   3.631
  470    HB   THR  65           HB       THR  65 -12.284  -4.762   5.069
  471    HG1  THR  65           1HG      THR  65 -10.179  -4.632   4.225
  472   1HG2  THR  65          1HG2      THR  65 -13.796  -5.315   3.549
  473   2HG2  THR  65          2HG2      THR  65 -12.809  -4.694   2.225
  474   3HG2  THR  65          3HG2      THR  65 -13.852  -3.603   3.135
  475    HA   PRO  66           HA       PRO  66 -15.134  -0.117   5.742
  476   1HB   PRO  66          2HB       PRO  66 -16.626  -1.011   3.317
  477   2HB   PRO  66          1HB       PRO  66 -16.545   0.591   4.060
  478   1HG   PRO  66          2HG       PRO  66 -15.174   0.063   1.846
  479   2HG   PRO  66          1HG       PRO  66 -14.469   1.061   3.132
  480   1HD   PRO  66          2HD       PRO  66 -13.894  -1.771   2.398
  481   2HD   PRO  66          1HD       PRO  66 -12.800  -0.520   3.023
  482    H    GLN  67           H        GLN  67 -15.488  -3.326   4.322
  483    HA   GLN  67           HA       GLN  67 -17.940  -4.000   5.532
  484   1HB   GLN  67          2HB       GLN  67 -15.664  -5.681   4.503
  485   2HB   GLN  67          1HB       GLN  67 -17.121  -6.391   5.180
  486   1HG   GLN  67          2HG       GLN  67 -17.226  -6.314   2.758
  487   2HG   GLN  67          1HG       GLN  67 -18.467  -5.293   3.479
  488   1HE2  GLN  67          1HE2      GLN  67 -18.720  -3.417   2.527
  489   2HE2  GLN  67          2HE2      GLN  67 -17.506  -2.522   1.685
  490    H    GLY  68           H        GLY  68 -14.880  -3.522   6.913
  491   1HA   GLY  68          2HA       GLY  68 -14.674  -3.434   9.296
  492   2HA   GLY  68          1HA       GLY  68 -15.838  -4.742   9.408
  493    H    GLU  69           H        GLU  69 -12.901  -4.454   7.425
  494    HA   GLU  69           HA       GLU  69 -11.828  -6.790   8.877
  495   1HB   GLU  69          2HB       GLU  69 -11.500  -6.206   5.930
  496   2HB   GLU  69          1HB       GLU  69 -10.827  -7.578   6.794
  497   1HG   GLU  69          2HG       GLU  69 -13.075  -8.392   7.268
  498   2HG   GLU  69          1HG       GLU  69 -13.757  -7.011   6.411
  499    H    LEU  70           H        LEU  70  -9.636  -6.819   9.309
  500    HA   LEU  70           HA       LEU  70  -8.188  -4.325   8.702
  501   1HB   LEU  70          2HB       LEU  70  -8.823  -4.414  11.054
  502   2HB   LEU  70          1HB       LEU  70  -8.069  -5.989  11.216
  503    HG   LEU  70           HG       LEU  70  -5.868  -4.977  10.764
  504   1HD1  LEU  70          1HD1      LEU  70  -7.395  -2.373  10.777
  505   2HD1  LEU  70          2HD1      LEU  70  -6.602  -3.104   9.383
  506   3HD1  LEU  70          3HD1      LEU  70  -5.638  -2.540  10.748
  507   1HD2  LEU  70          1HD2      LEU  70  -7.389  -3.613  12.988
  508   2HD2  LEU  70          2HD2      LEU  70  -5.640  -3.818  12.891
  509   3HD2  LEU  70          3HD2      LEU  70  -6.685  -5.228  13.070
  510    H    VAL  71           H        VAL  71  -6.690  -4.779   7.232
  511    HA   VAL  71           HA       VAL  71  -5.172  -7.293   7.502
  512    HB   VAL  71           HB       VAL  71  -5.543  -5.612   5.019
  513   1HG1  VAL  71          1HG1      VAL  71  -4.313  -8.347   5.318
  514   2HG1  VAL  71          2HG1      VAL  71  -3.402  -6.848   5.141
  515   3HG1  VAL  71          3HG1      VAL  71  -4.449  -7.401   3.835
  516   1HG2  VAL  71          1HG2      VAL  71  -7.065  -7.871   6.152
  517   2HG2  VAL  71          2HG2      VAL  71  -6.705  -7.964   4.428
  518   3HG2  VAL  71          3HG2      VAL  71  -7.585  -6.578   5.073
  519    H    GLU  72           H        GLU  72  -2.907  -7.229   7.313
  520    HA   GLU  72           HA       GLU  72  -1.729  -4.536   7.513
  521   1HB   GLU  72          2HB       GLU  72  -0.063  -5.467   9.064
  522   2HB   GLU  72          1HB       GLU  72  -1.698  -5.620   9.688
  523   1HG   GLU  72          2HG       GLU  72  -1.745  -7.962   9.006
  524   2HG   GLU  72          1HG       GLU  72  -0.106  -7.810   8.375
  525    H    ILE  73           H        ILE  73   0.270  -4.177   6.573
  526    HA   ILE  73           HA       ILE  73   1.580  -6.331   5.120
  527    HB   ILE  73           HB       ILE  73   0.584  -3.852   3.703
  528   1HG1  ILE  73          2HG1      ILE  73  -0.221  -6.755   3.407
  529   2HG1  ILE  73          1HG1      ILE  73  -1.208  -5.476   4.109
  530   1HG2  ILE  73          1HG2      ILE  73   2.072  -6.217   2.575
  531   2HG2  ILE  73          2HG2      ILE  73   2.809  -4.662   2.959
  532   3HG2  ILE  73          3HG2      ILE  73   1.571  -4.766   1.708
  533   1HD1  ILE  73          1HD1      ILE  73  -1.261  -4.336   1.946
  534   2HD1  ILE  73          2HD1      ILE  73  -1.905  -5.974   1.838
  535   3HD1  ILE  73          3HD1      ILE  73  -0.281  -5.624   1.247
  536    H    ASP  74           H        ASP  74   3.719  -6.107   5.376
  537    HA   ASP  74           HA       ASP  74   4.724  -3.592   6.440
  538   1HB   ASP  74          2HB       ASP  74   5.321  -5.714   7.547
  539   2HB   ASP  74          1HB       ASP  74   6.134  -6.241   6.077
  540    H    GLY  75           H        GLY  75   4.998  -2.152   4.830
  541   1HA   GLY  75          2HA       GLY  75   5.942  -2.711   2.238
  542   2HA   GLY  75          1HA       GLY  75   5.910  -1.130   2.994
  543    H    ARG  76           H        ARG  76   7.626  -2.635   5.184
  544    HA   ARG  76           HA       ARG  76  10.120  -1.789   4.032
  545   1HB   ARG  76          2HB       ARG  76   9.558  -1.079   6.294
  546   2HB   ARG  76          1HB       ARG  76   9.465  -2.758   6.802
  547   1HG   ARG  76          2HG       ARG  76  11.845  -3.037   6.337
  548   2HG   ARG  76          1HG       ARG  76  11.939  -1.352   5.820
  549   1HD   ARG  76          2HD       ARG  76  11.251  -0.632   8.058
  550   2HD   ARG  76          1HD       ARG  76  11.164  -2.316   8.571
  551    HE   ARG  76           HE       ARG  76  13.727  -1.836   7.562
  552   1HH1  ARG  76          1HH1      ARG  76  11.727  -0.896  10.263
  553   2HH1  ARG  76          2HH1      ARG  76  13.068  -0.636  11.327
  554   1HH2  ARG  76          1HH2      ARG  76  15.493  -1.496   8.961
  555   2HH2  ARG  76          2HH2      ARG  76  15.208  -0.977  10.588
  556    H    ALA  77           H        ALA  77   9.272  -4.612   5.955
  557    HA   ALA  77           HA       ALA  77  11.426  -6.112   4.786
  558   1HB   ALA  77          1HB       ALA  77   9.578  -7.481   6.616
  559   2HB   ALA  77          2HB       ALA  77  10.422  -6.076   7.270
  560   3HB   ALA  77          3HB       ALA  77  11.341  -7.427   6.605
  561    H    LEU  78           H        LEU  78   8.127  -5.725   4.038
  562    HA   LEU  78           HA       LEU  78   8.063  -8.364   2.735
  563   1HB   LEU  78          2HB       LEU  78   6.224  -7.752   4.352
  564   2HB   LEU  78          1HB       LEU  78   5.719  -6.530   3.202
  565    HG   LEU  78           HG       LEU  78   5.263  -8.260   1.530
  566   1HD1  LEU  78          1HD1      LEU  78   5.322 -10.625   2.166
  567   2HD1  LEU  78          2HD1      LEU  78   6.062 -10.188   3.705
  568   3HD1  LEU  78          3HD1      LEU  78   6.927  -9.897   2.196
  569   1HD2  LEU  78          1HD2      LEU  78   3.331  -9.288   2.633
  570   2HD2  LEU  78          2HD2      LEU  78   3.463  -7.570   3.011
  571   3HD2  LEU  78          3HD2      LEU  78   3.958  -8.775   4.199
  572    H    VAL  79           H        VAL  79   9.537  -6.153   1.648
  573    HA   VAL  79           HA       VAL  79   8.148  -4.801  -0.386
  574    HB   VAL  79           HB       VAL  79  10.390  -4.126   0.343
  575   1HG1  VAL  79          1HG1      VAL  79  12.364  -5.383  -0.473
  576   2HG1  VAL  79          2HG1      VAL  79  11.283  -6.671  -1.004
  577   3HG1  VAL  79          3HG1      VAL  79  11.408  -6.276   0.711
  578   1HG2  VAL  79          1HG2      VAL  79   9.512  -3.517  -1.914
  579   2HG2  VAL  79          2HG2      VAL  79  10.423  -4.873  -2.577
  580   3HG2  VAL  79          3HG2      VAL  79  11.272  -3.535  -1.803
  581    H    ALA  80           H        ALA  80   7.656  -5.308  -2.474
  582    HA   ALA  80           HA       ALA  80   7.734  -8.120  -3.179
  583   1HB   ALA  80          1HB       ALA  80   5.667  -7.279  -3.708
  584   2HB   ALA  80          2HB       ALA  80   6.486  -7.127  -5.263
  585   3HB   ALA  80          3HB       ALA  80   6.309  -5.718  -4.216
  586    H    ARG  81           H        ARG  81   8.893  -9.036  -4.801
  587    HA   ARG  81           HA       ARG  81  10.788  -7.293  -6.233
  588   1HB   ARG  81          2HB       ARG  81  11.137 -10.144  -5.294
  589   2HB   ARG  81          1HB       ARG  81  12.291  -9.279  -6.299
  590   1HG   ARG  81          2HG       ARG  81  12.805  -7.755  -4.566
  591   2HG   ARG  81          1HG       ARG  81  11.433  -8.298  -3.594
  592   1HD   ARG  81          2HD       ARG  81  13.798 -10.020  -4.340
  593   2HD   ARG  81          1HD       ARG  81  13.622  -9.175  -2.802
  594    HE   ARG  81           HE       ARG  81  12.436 -11.640  -3.512
  595   1HH1  ARG  81          1HH1      ARG  81  11.796  -8.692  -1.753
  596   2HH1  ARG  81          2HH1      ARG  81  10.594  -9.411  -0.737
  597   1HH2  ARG  81          1HH2      ARG  81  10.847 -12.585  -2.176
  598   2HH2  ARG  81          2HH2      ARG  81  10.059 -11.620  -0.973
  599    HA   PRO  82           HA       PRO  82   9.222  -8.553 -10.150
  600   1HB   PRO  82          2HB       PRO  82  12.014  -9.191 -10.939
  601   2HB   PRO  82          1HB       PRO  82  10.849  -8.105 -11.703
  602   1HG   PRO  82          2HG       PRO  82  12.900  -7.143 -10.296
  603   2HG   PRO  82          1HG       PRO  82  11.305  -6.369 -10.244
  604   1HD   PRO  82          2HD       PRO  82  12.629  -8.129  -8.226
  605   2HD   PRO  82          1HD       PRO  82  11.582  -6.716  -7.978
  606    H    GLU  83           H        GLU  83   9.227 -10.384 -11.719
  607    HA   GLU  83           HA       GLU  83   9.116 -12.870 -10.312
  608   1HB   GLU  83          2HB       GLU  83   8.788 -12.278 -13.258
  609   2HB   GLU  83          1HB       GLU  83   8.407 -13.809 -12.484
  610   1HG   GLU  83          2HG       GLU  83   6.703 -12.703 -11.131
  611   2HG   GLU  83          1HG       GLU  83   7.084 -11.168 -11.910
  612    H    GLU  84           H        GLU  84  11.510 -11.249 -12.145
  613    HA   GLU  84           HA       GLU  84  12.966 -13.442 -13.143
  614   1HB   GLU  84          2HB       GLU  84  13.979 -10.715 -12.320
  615   2HB   GLU  84          1HB       GLU  84  14.841 -11.865 -13.332
  616   1HG   GLU  84          2HG       GLU  84  12.227 -10.540 -14.013
  617   2HG   GLU  84          1HG       GLU  84  13.809 -10.091 -14.644
  618    H    ARG  85           H        ARG  85  13.275 -11.600 -10.119
  619    HA   ARG  85           HA       ARG  85  14.762 -13.876  -8.997
  620   1HB   ARG  85          2HB       ARG  85  15.377 -10.950  -8.545
  621   2HB   ARG  85          1HB       ARG  85  16.161 -12.292  -7.722
  622   1HG   ARG  85          2HG       ARG  85  16.255 -11.740 -10.680
  623   2HG   ARG  85          1HG       ARG  85  17.545 -11.418  -9.522
  624   1HD   ARG  85          2HD       ARG  85  17.671 -13.813  -9.012
  625   2HD   ARG  85          1HD       ARG  85  16.390 -14.127 -10.181
  626    HE   ARG  85           HE       ARG  85  17.976 -14.086 -11.808
  627   1HH1  ARG  85          1HH1      ARG  85  19.191 -12.272  -9.083
  628   2HH1  ARG  85          2HH1      ARG  85  20.713 -11.925  -9.834
  629   1HH2  ARG  85          1HH2      ARG  85  19.979 -13.636 -12.791
  630   2HH2  ARG  85          2HH2      ARG  85  21.160 -12.701 -11.937
  631    H    ILE  86           H        ILE  86  13.235 -14.735  -7.708
  632    HA   ILE  86           HA       ILE  86  11.875 -12.943  -5.798
  633    HB   ILE  86           HB       ILE  86  10.970 -15.666  -6.759
  634   1HG1  ILE  86          2HG1      ILE  86   9.879 -12.913  -7.390
  635   2HG1  ILE  86          1HG1      ILE  86  10.806 -13.919  -8.500
  636   1HG2  ILE  86          1HG2      ILE  86  10.244 -15.252  -4.496
  637   2HG2  ILE  86          2HG2      ILE  86   8.867 -15.089  -5.585
  638   3HG2  ILE  86          3HG2      ILE  86   9.655 -13.650  -4.941
  639   1HD1  ILE  86          1HD1      ILE  86   8.758 -14.492  -9.220
  640   2HD1  ILE  86          2HD1      ILE  86   7.984 -14.089  -7.688
  641   3HD1  ILE  86          3HD1      ILE  86   8.833 -15.624  -7.872
  Start of MODEL    4
    1    H    ARG   9           H        ARG   9 -13.634   0.987  -9.888
    2    HA   ARG   9           HA       ARG   9 -13.614   0.208  -7.048
    3   1HB   ARG   9          2HB       ARG   9 -11.595  -1.129  -7.511
    4   2HB   ARG   9          1HB       ARG   9 -12.990  -1.704  -8.412
    5   1HG   ARG   9          2HG       ARG   9 -12.169  -0.548 -10.410
    6   2HG   ARG   9          1HG       ARG   9 -10.756  -0.004  -9.502
    7   1HD   ARG   9          2HD       ARG   9 -10.103  -2.329  -9.124
    8   2HD   ARG   9          1HD       ARG   9 -11.518  -2.877 -10.021
    9    HE   ARG   9           HE       ARG   9 -10.044  -1.155 -11.662
   10   1HH1  ARG   9          1HH1      ARG   9  -9.757  -4.310 -10.199
   11   2HH1  ARG   9          2HH1      ARG   9  -8.729  -4.932 -11.445
   12   1HH2  ARG   9          1HH2      ARG   9  -8.691  -1.972 -13.303
   13   2HH2  ARG   9          2HH2      ARG   9  -8.123  -3.606 -13.206
   14    H    HIS  10           H        HIS  10 -12.674   1.660  -5.793
   15    HA   HIS  10           HA       HIS  10 -10.481   3.281  -6.901
   16   1HB   HIS  10          2HB       HIS  10 -12.693   4.239  -5.073
   17   2HB   HIS  10          1HB       HIS  10 -11.299   5.195  -5.568
   18    HD1  HIS  10           1HD      HIS  10 -13.968   3.204  -7.433
   19    HD2  HIS  10           2HD      HIS  10 -11.994   6.858  -7.565
   20    HE1  HIS  10           1HE      HIS  10 -14.930   4.415  -9.415
   21    HE2  HIS  10           2HE      HIS  10 -13.671   6.597  -9.517
   22    H    GLU  11           H        GLU  11 -12.036   2.927  -3.708
   23    HA   GLU  11           HA       GLU  11  -9.802   3.238  -2.142
   24   1HB   GLU  11          2HB       GLU  11 -12.051   1.299  -1.570
   25   2HB   GLU  11          1HB       GLU  11 -10.982   2.038  -0.387
   26   1HG   GLU  11          2HG       GLU  11 -11.900   4.244  -0.975
   27   2HG   GLU  11          1HG       GLU  11 -13.008   3.459  -2.097
   28    H    LEU  12           H        LEU  12  -7.911   2.173  -2.111
   29    HA   LEU  12           HA       LEU  12  -6.377   0.553  -2.819
   30   1HB   LEU  12          2HB       LEU  12  -7.345   0.135  -0.341
   31   2HB   LEU  12          1HB       LEU  12  -7.829  -1.374  -1.083
   32    HG   LEU  12           HG       LEU  12  -5.017  -0.329  -0.727
   33   1HD1  LEU  12          1HD1      LEU  12  -6.403  -1.417   1.169
   34   2HD1  LEU  12          2HD1      LEU  12  -4.734  -1.918   0.900
   35   3HD1  LEU  12          3HD1      LEU  12  -6.063  -2.918   0.309
   36   1HD2  LEU  12          1HD2      LEU  12  -5.599  -3.046  -1.808
   37   2HD2  LEU  12          2HD2      LEU  12  -4.141  -2.065  -1.948
   38   3HD2  LEU  12          3HD2      LEU  12  -5.565  -1.665  -2.902
   39    H    ILE  13           H        ILE  13  -7.249  -2.449  -2.629
   40    HA   ILE  13           HA       ILE  13  -8.488  -2.281  -5.260
   41    HB   ILE  13           HB       ILE  13  -6.580  -3.935  -4.865
   42   1HG1  ILE  13          2HG1      ILE  13  -7.740  -5.824  -6.033
   43   2HG1  ILE  13          1HG1      ILE  13  -9.266  -4.990  -5.755
   44   1HG2  ILE  13          1HG2      ILE  13  -7.541  -4.549  -2.553
   45   2HG2  ILE  13          2HG2      ILE  13  -6.802  -5.815  -3.535
   46   3HG2  ILE  13          3HG2      ILE  13  -8.558  -5.677  -3.453
   47   1HD1  ILE  13          1HD1      ILE  13  -8.733  -3.272  -7.225
   48   2HD1  ILE  13          2HD1      ILE  13  -8.106  -4.711  -8.028
   49   3HD1  ILE  13          3HD1      ILE  13  -7.007  -3.628  -7.173
   50    H    GLY  14           H        GLY  14 -10.512  -1.554  -4.638
   51   1HA   GLY  14          2HA       GLY  14 -12.617  -1.610  -3.701
   52   2HA   GLY  14          1HA       GLY  14 -12.355  -3.323  -3.401
   53    H    LEU  15           H        LEU  15  -9.758  -1.851  -1.933
   54    HA   LEU  15           HA       LEU  15 -11.120  -1.697   0.684
   55   1HB   LEU  15          2HB       LEU  15  -8.214  -2.075   0.721
   56   2HB   LEU  15          1HB       LEU  15  -9.464  -2.871   1.652
   57    HG   LEU  15           HG       LEU  15  -8.699  -3.573  -1.177
   58   1HD1  LEU  15          1HD1      LEU  15  -8.235  -5.617   0.789
   59   2HD1  LEU  15          2HD1      LEU  15  -7.355  -4.146   1.201
   60   3HD1  LEU  15          3HD1      LEU  15  -7.120  -4.901  -0.375
   61   1HD2  LEU  15          1HD2      LEU  15 -10.218  -5.345  -1.058
   62   2HD2  LEU  15          2HD2      LEU  15 -11.098  -3.985  -0.361
   63   3HD2  LEU  15          3HD2      LEU  15 -10.383  -5.205   0.694
   64    H    SER  16           H        SER  16  -9.806  -0.364   2.336
   65    HA   SER  16           HA       SER  16  -8.687   2.035   0.986
   66   1HB   SER  16          2HB       SER  16 -10.175   1.917   3.653
   67   2HB   SER  16          1HB       SER  16  -9.453   3.364   2.948
   68    HG   SER  16           HG       SER  16 -11.557   1.822   1.826
   69    H    VAL  17           H        VAL  17  -6.865   3.093   2.308
   70    HA   VAL  17           HA       VAL  17  -5.564   1.020   3.958
   71    HB   VAL  17           HB       VAL  17  -4.184   2.853   2.001
   72   1HG1  VAL  17          1HG1      VAL  17  -2.690   2.383   3.786
   73   2HG1  VAL  17          2HG1      VAL  17  -2.242   1.320   2.453
   74   3HG1  VAL  17          3HG1      VAL  17  -3.159   0.683   3.818
   75   1HG2  VAL  17          1HG2      VAL  17  -4.497  -0.129   1.789
   76   2HG2  VAL  17          2HG2      VAL  17  -3.923   1.002   0.563
   77   3HG2  VAL  17          3HG2      VAL  17  -5.622   1.003   1.038
   78    H    ARG  18           H        ARG  18  -3.978   1.677   5.428
   79    HA   ARG  18           HA       ARG  18  -3.900   4.474   6.241
   80   1HB   ARG  18          2HB       ARG  18  -5.726   3.538   7.571
   81   2HB   ARG  18          1HB       ARG  18  -4.702   2.202   8.077
   82   1HG   ARG  18          2HG       ARG  18  -3.249   3.755   9.269
   83   2HG   ARG  18          1HG       ARG  18  -4.262   5.103   8.751
   84   1HD   ARG  18          2HD       ARG  18  -4.799   4.431  11.031
   85   2HD   ARG  18          1HD       ARG  18  -6.160   4.145   9.950
   86    HE   ARG  18           HE       ARG  18  -4.646   1.799  10.107
   87   1HH1  ARG  18          1HH1      ARG  18  -6.690   3.777  12.129
   88   2HH1  ARG  18          2HH1      ARG  18  -7.203   2.454  13.121
   89   1HH2  ARG  18          1HH2      ARG  18  -5.320   0.056  11.411
   90   2HH2  ARG  18          2HH2      ARG  18  -6.424   0.341  12.713
   91    H    ILE  19           H        ILE  19  -1.770   4.861   6.155
   92    HA   ILE  19           HA       ILE  19   0.132   2.735   6.684
   93    HB   ILE  19           HB       ILE  19   0.659   5.602   5.900
   94   1HG1  ILE  19          2HG1      ILE  19   0.496   3.100   4.203
   95   2HG1  ILE  19          1HG1      ILE  19  -0.684   4.410   4.219
   96   1HG2  ILE  19          1HG2      ILE  19   2.735   5.018   6.538
   97   2HG2  ILE  19          2HG2      ILE  19   2.766   4.156   5.000
   98   3HG2  ILE  19          3HG2      ILE  19   2.376   3.293   6.487
   99   1HD1  ILE  19          1HD1      ILE  19   0.751   4.611   2.281
  100   2HD1  ILE  19          2HD1      ILE  19   2.186   4.600   3.308
  101   3HD1  ILE  19          3HD1      ILE  19   1.056   5.952   3.389
  102    H    ALA  20           H        ALA  20   1.605   2.655   8.320
  103    HA   ALA  20           HA       ALA  20   1.217   4.582  10.510
  104   1HB   ALA  20          1HB       ALA  20   1.214   2.921  12.031
  105   2HB   ALA  20          2HB       ALA  20   2.416   1.973  11.153
  106   3HB   ALA  20          3HB       ALA  20   0.726   1.941  10.649
  107    H    ARG  21           H        ARG  21   3.509   3.073   8.414
  108    HA   ARG  21           HA       ARG  21   5.555   4.890   9.261
  109   1HB   ARG  21          2HB       ARG  21   5.976   1.920   9.598
  110   2HB   ARG  21          1HB       ARG  21   7.242   3.133   9.716
  111   1HG   ARG  21          2HG       ARG  21   6.041   4.152  11.617
  112   2HG   ARG  21          1HG       ARG  21   4.854   2.849  11.527
  113   1HD   ARG  21          2HD       ARG  21   6.623   1.207  11.933
  114   2HD   ARG  21          1HD       ARG  21   7.812   2.507  12.020
  115    HE   ARG  21           HE       ARG  21   6.115   1.633  14.106
  116   1HH1  ARG  21          1HH1      ARG  21   7.534   4.519  12.751
  117   2HH1  ARG  21          2HH1      ARG  21   7.445   5.410  14.233
  118   1HH2  ARG  21          1HH2      ARG  21   6.002   2.800  16.056
  119   2HH2  ARG  21          2HH2      ARG  21   6.578   4.432  16.110
  120    H    SER  22           H        SER  22   6.840   5.437   7.596
  121    HA   SER  22           HA       SER  22   7.082   3.613   5.317
  122   1HB   SER  22          2HB       SER  22   6.272   6.521   5.079
  123   2HB   SER  22          1HB       SER  22   6.627   5.442   3.730
  124    HG   SER  22           HG       SER  22   4.634   4.865   5.649
  125    H    VAL  23           H        VAL  23   8.795   4.332   3.778
  126    HA   VAL  23           HA       VAL  23  11.194   4.875   5.159
  127    HB   VAL  23           HB       VAL  23  11.190   3.567   3.106
  128   1HG1  VAL  23          1HG1      VAL  23   9.388   4.832   1.962
  129   2HG1  VAL  23          2HG1      VAL  23  10.793   4.532   0.937
  130   3HG1  VAL  23          3HG1      VAL  23  10.545   6.126   1.649
  131   1HG2  VAL  23          1HG2      VAL  23  13.243   4.752   3.765
  132   2HG2  VAL  23          2HG2      VAL  23  12.761   6.120   2.764
  133   3HG2  VAL  23          3HG2      VAL  23  13.120   4.565   2.015
  134    H    HIS  24           H        HIS  24   9.226   6.872   2.974
  135    HA   HIS  24           HA       HIS  24  10.885   9.194   3.571
  136   1HB   HIS  24          2HB       HIS  24   8.578   8.818   1.655
  137   2HB   HIS  24          1HB       HIS  24   9.450  10.329   1.873
  138    HD1  HIS  24           1HD      HIS  24   9.609   9.473  -0.876
  139    HD2  HIS  24           2HD      HIS  24  12.175   7.870   1.973
  140    HE1  HIS  24           1HE      HIS  24  11.573   8.577  -2.167
  141    HE2  HIS  24           2HE      HIS  24  13.064   7.526  -0.430
  142    H    ARG  25           H        ARG  25  10.248  10.904   4.779
  143    HA   ARG  25           HA       ARG  25   8.188  10.511   6.670
  144   1HB   ARG  25          2HB       ARG  25   9.896  12.900   6.018
  145   2HB   ARG  25          1HB       ARG  25   8.711  12.909   7.314
  146   1HG   ARG  25          2HG       ARG  25  10.926  12.473   8.182
  147   2HG   ARG  25          1HG       ARG  25   9.888  11.065   8.404
  148   1HD   ARG  25          2HD       ARG  25  10.900   9.984   6.481
  149   2HD   ARG  25          1HD       ARG  25  11.884  11.414   6.168
  150    HE   ARG  25           HE       ARG  25  13.362  10.630   7.708
  151   1HH1  ARG  25          1HH1      ARG  25  10.252   9.191   8.379
  152   2HH1  ARG  25          2HH1      ARG  25  10.838   8.247   9.706
  153   1HH2  ARG  25          1HH2      ARG  25  14.134   9.380   9.448
  154   2HH2  ARG  25          2HH2      ARG  25  13.041   8.351  10.311
  155    H    ASP  26           H        ASP  26   8.244  12.111   3.599
  156    HA   ASP  26           HA       ASP  26   5.930  13.703   4.061
  157   1HB   ASP  26          2HB       ASP  26   5.954  14.108   1.627
  158   2HB   ASP  26          1HB       ASP  26   7.530  14.378   2.364
  159    H    ILE  27           H        ILE  27   6.270  10.409   3.683
  160    HA   ILE  27           HA       ILE  27   3.493  10.174   2.808
  161    HB   ILE  27           HB       ILE  27   3.979   8.088   1.677
  162   1HG1  ILE  27          2HG1      ILE  27   6.860   8.620   2.445
  163   2HG1  ILE  27          1HG1      ILE  27   5.847   7.318   3.054
  164   1HG2  ILE  27          1HG2      ILE  27   5.563   9.025  -0.114
  165   2HG2  ILE  27          2HG2      ILE  27   5.582  10.489   0.870
  166   3HG2  ILE  27          3HG2      ILE  27   4.061   9.894   0.207
  167   1HD1  ILE  27          1HD1      ILE  27   7.372   6.490   1.386
  168   2HD1  ILE  27          2HD1      ILE  27   6.779   7.671   0.219
  169   3HD1  ILE  27          3HD1      ILE  27   5.714   6.388   0.792
  170    H    GLN  28           H        GLN  28   5.491   9.816   5.363
  171    HA   GLN  28           HA       GLN  28   4.549   7.274   6.314
  172   1HB   GLN  28          2HB       GLN  28   6.814   7.959   6.850
  173   2HB   GLN  28          1HB       GLN  28   6.218   9.408   7.643
  174   1HG   GLN  28          2HG       GLN  28   5.183   8.098   9.373
  175   2HG   GLN  28          1HG       GLN  28   5.617   6.604   8.544
  176   1HE2  GLN  28          1HE2      GLN  28   6.399   8.455  11.070
  177   2HE2  GLN  28          2HE2      GLN  28   8.081   8.094  11.219
  178    H    GLY  29           H        GLY  29   3.209   6.911   8.082
  179   1HA   GLY  29          2HA       GLY  29   1.433   7.281   9.482
  180   2HA   GLY  29          1HA       GLY  29   2.077   8.900   9.708
  181    H    ILE  30           H        ILE  30   1.346   8.071   6.466
  182    HA   ILE  30           HA       ILE  30  -1.008   9.782   6.598
  183    HB   ILE  30           HB       ILE  30   0.593   9.024   4.159
  184   1HG1  ILE  30          2HG1      ILE  30   0.656  11.525   5.862
  185   2HG1  ILE  30          1HG1      ILE  30   1.960  10.360   5.651
  186   1HG2  ILE  30          1HG2      ILE  30  -1.026  11.451   4.081
  187   2HG2  ILE  30          2HG2      ILE  30  -1.976   9.980   4.296
  188   3HG2  ILE  30          3HG2      ILE  30  -0.894  10.137   2.912
  189   1HD1  ILE  30          1HD1      ILE  30   2.616  12.051   4.239
  190   2HD1  ILE  30          2HD1      ILE  30   0.962  12.443   3.767
  191   3HD1  ILE  30          3HD1      ILE  30   1.741  10.994   3.130
  192    H    SER  31           H        SER  31  -2.983   9.038   6.112
  193    HA   SER  31           HA       SER  31  -3.251   6.222   5.378
  194   1HB   SER  31          2HB       SER  31  -5.348   8.239   6.238
  195   2HB   SER  31          1HB       SER  31  -5.628   6.517   5.975
  196    HG   SER  31           HG       SER  31  -3.790   7.574   7.862
  197    H    GLY  32           H        GLY  32  -4.984   5.668   3.712
  198   1HA   GLY  32          2HA       GLY  32  -6.040   7.467   1.912
  199   2HA   GLY  32          1HA       GLY  32  -4.410   7.144   1.335
  200    H    ARG  33           H        ARG  33  -5.993   6.425  -0.465
  201    HA   ARG  33           HA       ARG  33  -6.610   3.595  -0.018
  202   1HB   ARG  33          2HB       ARG  33  -7.949   5.647  -1.726
  203   2HB   ARG  33          1HB       ARG  33  -8.156   3.937  -2.038
  204   1HG   ARG  33          2HG       ARG  33  -9.998   4.592  -0.740
  205   2HG   ARG  33          1HG       ARG  33  -8.924   3.712   0.342
  206   1HD   ARG  33          2HD       ARG  33  -8.047   5.867   1.169
  207   2HD   ARG  33          1HD       ARG  33  -9.192   6.706   0.127
  208    HE   ARG  33           HE       ARG  33 -10.620   4.925   1.735
  209   1HH1  ARG  33          1HH1      ARG  33  -8.727   7.840   2.054
  210   2HH1  ARG  33          2HH1      ARG  33  -9.583   8.393   3.453
  211   1HH2  ARG  33          1HH2      ARG  33 -11.748   5.652   3.577
  212   2HH2  ARG  33          2HH2      ARG  33 -11.298   7.150   4.319
  213    H    VAL  34           H        VAL  34  -6.547   2.284  -1.990
  214    HA   VAL  34           HA       VAL  34  -4.011   2.793  -3.415
  215    HB   VAL  34           HB       VAL  34  -5.184   0.318  -2.370
  216   1HG1  VAL  34          1HG1      VAL  34  -3.958  -1.121  -3.963
  217   2HG1  VAL  34          2HG1      VAL  34  -3.710   0.288  -4.987
  218   3HG1  VAL  34          3HG1      VAL  34  -5.351  -0.302  -4.677
  219   1HG2  VAL  34          1HG2      VAL  34  -3.077  -0.060  -1.597
  220   2HG2  VAL  34          2HG2      VAL  34  -3.039   1.698  -1.734
  221   3HG2  VAL  34          3HG2      VAL  34  -2.316   0.698  -2.994
  222    H    VAL  35           H        VAL  35  -3.711   2.064  -5.629
  223    HA   VAL  35           HA       VAL  35  -6.231   1.977  -7.150
  224    HB   VAL  35           HB       VAL  35  -4.905   4.176  -7.436
  225   1HG1  VAL  35          1HG1      VAL  35  -3.126   4.127  -9.084
  226   2HG1  VAL  35          2HG1      VAL  35  -3.169   2.370  -9.085
  227   3HG1  VAL  35          3HG1      VAL  35  -2.701   3.241  -7.631
  228   1HG2  VAL  35          1HG2      VAL  35  -5.136   3.282 -10.151
  229   2HG2  VAL  35          2HG2      VAL  35  -6.180   4.377  -9.248
  230   3HG2  VAL  35          3HG2      VAL  35  -6.464   2.638  -9.187
  231    H    ASP  36           H        ASP  36  -2.746   1.274  -7.173
  232    HA   ASP  36           HA       ASP  36  -3.194  -1.413  -8.003
  233   1HB   ASP  36          2HB       ASP  36  -3.357  -0.400 -10.188
  234   2HB   ASP  36          1HB       ASP  36  -1.864   0.501  -9.929
  235    H    GLU  37           H        GLU  37  -1.073  -2.621  -8.175
  236    HA   GLU  37           HA       GLU  37   0.824  -1.476  -6.237
  237   1HB   GLU  37          2HB       GLU  37   0.462  -4.348  -7.120
  238   2HB   GLU  37          1HB       GLU  37   1.569  -3.787  -5.874
  239   1HG   GLU  37          2HG       GLU  37  -1.436  -3.616  -5.782
  240   2HG   GLU  37          1HG       GLU  37  -0.429  -4.769  -4.906
  241    H    THR  38           H        THR  38   3.026  -1.414  -6.640
  242    HA   THR  38           HA       THR  38   3.846  -1.990  -9.411
  243    HB   THR  38           HB       THR  38   4.739   0.321  -7.678
  244    HG1  THR  38           1HG      THR  38   3.626   1.565  -9.186
  245   1HG2  THR  38          1HG2      THR  38   5.717   1.119  -9.889
  246   2HG2  THR  38          2HG2      THR  38   5.602  -0.565 -10.402
  247   3HG2  THR  38          3HG2      THR  38   6.595  -0.133  -9.009
  248    H    ARG  39           H        ARG  39   6.068  -2.541  -9.721
  249    HA   ARG  39           HA       ARG  39   7.082  -4.554  -8.246
  250   1HB   ARG  39          2HB       ARG  39   7.999  -3.911 -10.406
  251   2HB   ARG  39          1HB       ARG  39   8.687  -2.452  -9.706
  252   1HG   ARG  39          2HG       ARG  39  10.143  -3.827  -8.294
  253   2HG   ARG  39          1HG       ARG  39   9.466  -5.282  -9.028
  254   1HD   ARG  39          2HD       ARG  39  10.942  -3.096 -10.494
  255   2HD   ARG  39          1HD       ARG  39  11.621  -4.656 -10.029
  256    HE   ARG  39           HE       ARG  39   9.318  -5.116 -11.545
  257   1HH1  ARG  39          1HH1      ARG  39  12.532  -3.814 -11.949
  258   2HH1  ARG  39          2HH1      ARG  39  12.642  -4.271 -13.616
  259   1HH2  ARG  39          1HH2      ARG  39   9.463  -5.718 -13.736
  260   2HH2  ARG  39          2HH2      ARG  39  10.901  -5.351 -14.631
  261    H    ASN  40           H        ASN  40   7.900  -1.125  -7.721
  262    HA   ASN  40           HA       ASN  40   8.773  -1.882  -5.020
  263   1HB   ASN  40          2HB       ASN  40  10.637  -0.289  -5.146
  264   2HB   ASN  40          1HB       ASN  40  10.788  -1.577  -6.330
  265   1HD2  ASN  40          1HD2      ASN  40   8.420   0.534  -7.418
  266   2HD2  ASN  40          2HD2      ASN  40   9.404   1.512  -8.433
  267    H    THR  41           H        THR  41   6.298  -0.602  -6.159
  268    HA   THR  41           HA       THR  41   6.092   1.439  -4.138
  269    HB   THR  41           HB       THR  41   5.270   3.174  -5.784
  270    HG1  THR  41           1HG      THR  41   5.952   2.948  -7.910
  271   1HG2  THR  41          1HG2      THR  41   7.513   3.277  -4.723
  272   2HG2  THR  41          2HG2      THR  41   7.405   4.064  -6.298
  273   3HG2  THR  41          3HG2      THR  41   8.166   2.479  -6.153
  274    H    LEU  42           H        LEU  42   3.868   2.499  -4.238
  275    HA   LEU  42           HA       LEU  42   1.856   0.635  -5.300
  276   1HB   LEU  42          2HB       LEU  42   1.722   1.857  -2.545
  277   2HB   LEU  42          1HB       LEU  42   0.566   0.749  -3.259
  278    HG   LEU  42           HG       LEU  42   3.372   0.145  -2.367
  279   1HD1  LEU  42          1HD1      LEU  42   0.637  -0.624  -1.403
  280   2HD1  LEU  42          2HD1      LEU  42   1.966   0.105  -0.501
  281   3HD1  LEU  42          3HD1      LEU  42   2.064  -1.582  -1.005
  282   1HD2  LEU  42          1HD2      LEU  42   3.444  -1.467  -3.918
  283   2HD2  LEU  42          2HD2      LEU  42   1.781  -1.146  -4.408
  284   3HD2  LEU  42          3HD2      LEU  42   2.108  -2.245  -3.070
  285    H    ARG  43           H        ARG  43   0.609   1.771  -6.655
  286    HA   ARG  43           HA       ARG  43   0.427   4.633  -6.380
  287   1HB   ARG  43          2HB       ARG  43   0.545   3.359  -8.578
  288   2HB   ARG  43          1HB       ARG  43  -1.119   2.894  -8.303
  289   1HG   ARG  43          2HG       ARG  43  -1.810   5.218  -8.352
  290   2HG   ARG  43          1HG       ARG  43  -0.130   5.733  -8.491
  291   1HD   ARG  43          2HD       ARG  43  -0.043   4.313 -10.610
  292   2HD   ARG  43          1HD       ARG  43  -1.801   4.262 -10.512
  293    HE   ARG  43           HE       ARG  43  -0.216   6.415 -11.451
  294   1HH1  ARG  43          1HH1      ARG  43  -3.153   5.743  -9.695
  295   2HH1  ARG  43          2HH1      ARG  43  -3.897   7.242 -10.121
  296   1HH2  ARG  43          1HH2      ARG  43  -1.190   8.391 -12.003
  297   2HH2  ARG  43          2HH2      ARG  43  -2.782   8.750 -11.425
  298    H    ILE  44           H        ILE  44  -0.972   5.608  -5.158
  299    HA   ILE  44           HA       ILE  44  -3.101   4.116  -3.886
  300    HB   ILE  44           HB       ILE  44  -1.516   6.530  -3.263
  301   1HG1  ILE  44          2HG1      ILE  44  -2.527   4.201  -1.635
  302   2HG1  ILE  44          1HG1      ILE  44  -0.924   4.365  -2.342
  303   1HG2  ILE  44          1HG2      ILE  44  -3.581   6.464  -1.321
  304   2HG2  ILE  44          2HG2      ILE  44  -4.318   6.672  -2.907
  305   3HG2  ILE  44          3HG2      ILE  44  -3.076   7.794  -2.360
  306   1HD1  ILE  44          1HD1      ILE  44  -1.929   5.330   0.169
  307   2HD1  ILE  44          2HD1      ILE  44  -1.258   6.649  -0.791
  308   3HD1  ILE  44          3HD1      ILE  44  -0.269   5.236  -0.419
  309    H    GLU  45           H        GLU  45  -5.152   4.165  -4.655
  310    HA   GLU  45           HA       GLU  45  -6.062   6.740  -5.749
  311   1HB   GLU  45          2HB       GLU  45  -6.236   5.154  -7.539
  312   2HB   GLU  45          1HB       GLU  45  -6.964   3.941  -6.493
  313   1HG   GLU  45          2HG       GLU  45  -8.928   5.447  -6.239
  314   2HG   GLU  45          1HG       GLU  45  -8.193   6.532  -7.416
  315    H    MET  46           H        MET  46  -7.808   7.618  -4.887
  316    HA   MET  46           HA       MET  46  -9.145   6.255  -2.648
  317   1HB   MET  46          2HB       MET  46  -8.413   9.163  -2.997
  318   2HB   MET  46          1HB       MET  46  -9.454   8.566  -1.711
  319   1HG   MET  46          2HG       MET  46  -7.696   7.335  -0.730
  320   2HG   MET  46          1HG       MET  46  -6.663   7.549  -2.137
  321   1HE   MET  46          1HE       MET  46  -5.650   9.374  -2.897
  322   2HE   MET  46          2HE       MET  46  -4.740  10.387  -1.774
  323   3HE   MET  46          3HE       MET  46  -6.208  11.006  -2.526
  324    H    ASP  47           H        ASP  47 -11.279   6.084  -2.693
  325    HA   ASP  47           HA       ASP  47 -12.841   6.410  -4.901
  326   1HB   ASP  47          2HB       ASP  47 -13.535   5.106  -2.959
  327   2HB   ASP  47          1HB       ASP  47 -13.737   6.583  -2.023
  328    H    ASP  48           H        ASP  48 -11.958   8.865  -2.630
  329    HA   ASP  48           HA       ASP  48 -13.968  10.746  -3.148
  330   1HB   ASP  48          2HB       ASP  48 -12.373  10.977  -1.297
  331   2HB   ASP  48          1HB       ASP  48 -11.064  11.232  -2.446
  332    H    GLY  49           H        GLY  49 -11.596   9.518  -5.222
  333   1HA   GLY  49          2HA       GLY  49 -11.607  10.016  -7.547
  334   2HA   GLY  49          1HA       GLY  49 -12.170  11.640  -7.166
  335    H    ARG  50           H        ARG  50  -9.675  10.314  -5.231
  336    HA   ARG  50           HA       ARG  50  -7.757  12.165  -6.469
  337   1HB   ARG  50          2HB       ARG  50  -7.793  10.934  -3.709
  338   2HB   ARG  50          1HB       ARG  50  -6.549  12.022  -4.310
  339   1HG   ARG  50          2HG       ARG  50  -8.161  13.809  -4.520
  340   2HG   ARG  50          1HG       ARG  50  -9.465  12.724  -4.034
  341   1HD   ARG  50          2HD       ARG  50  -7.092  13.471  -2.328
  342   2HD   ARG  50          1HD       ARG  50  -8.702  14.176  -2.193
  343    HE   ARG  50           HE       ARG  50  -8.919  11.389  -1.974
  344   1HH1  ARG  50          1HH1      ARG  50  -7.647  14.112  -0.197
  345   2HH1  ARG  50          2HH1      ARG  50  -7.866  13.364   1.350
  346   1HH2  ARG  50          1HH2      ARG  50  -9.210  10.405   0.059
  347   2HH2  ARG  50          2HH2      ARG  50  -8.753  11.258   1.495
  348    H    GLU  51           H        GLU  51  -5.491  11.497  -6.541
  349    HA   GLU  51           HA       GLU  51  -4.935   8.658  -6.438
  350   1HB   GLU  51          2HB       GLU  51  -4.795  10.207  -9.029
  351   2HB   GLU  51          1HB       GLU  51  -4.117   8.603  -8.787
  352   1HG   GLU  51          2HG       GLU  51  -6.357   7.735  -8.316
  353   2HG   GLU  51          1HG       GLU  51  -7.028   9.343  -8.580
  354    H    ILE  52           H        ILE  52  -2.925   8.355  -5.727
  355    HA   ILE  52           HA       ILE  52  -0.767  10.139  -6.487
  356    HB   ILE  52           HB       ILE  52  -1.735  11.347  -4.586
  357   1HG1  ILE  52          2HG1      ILE  52   0.902  10.011  -3.931
  358   2HG1  ILE  52          1HG1      ILE  52   0.693  11.434  -4.952
  359   1HG2  ILE  52          1HG2      ILE  52  -1.547  10.295  -2.309
  360   2HG2  ILE  52          2HG2      ILE  52  -1.289   8.755  -3.127
  361   3HG2  ILE  52          3HG2      ILE  52  -2.803   9.630  -3.351
  362   1HD1  ILE  52          1HD1      ILE  52   0.050  11.264  -2.007
  363   2HD1  ILE  52          2HD1      ILE  52  -0.159  12.688  -3.025
  364   3HD1  ILE  52          3HD1      ILE  52   1.460  12.054  -2.719
  365    H    THR  53           H        THR  53   1.337   9.284  -5.950
  366    HA   THR  53           HA       THR  53   1.273   6.384  -5.600
  367    HB   THR  53           HB       THR  53   3.529   8.219  -6.429
  368    HG1  THR  53           1HG      THR  53   2.948   7.795  -8.429
  369   1HG2  THR  53          1HG2      THR  53   4.565   6.121  -7.291
  370   2HG2  THR  53          2HG2      THR  53   3.374   5.220  -6.352
  371   3HG2  THR  53          3HG2      THR  53   4.535   6.267  -5.535
  372    H    VAL  54           H        VAL  54   2.714   5.276  -4.165
  373    HA   VAL  54           HA       VAL  54   4.039   6.805  -2.083
  374    HB   VAL  54           HB       VAL  54   1.871   4.836  -1.341
  375   1HG1  VAL  54          1HG1      VAL  54   2.276   5.617   0.947
  376   2HG1  VAL  54          2HG1      VAL  54   3.573   6.660   0.363
  377   3HG1  VAL  54          3HG1      VAL  54   3.731   4.906   0.244
  378   1HG2  VAL  54          1HG2      VAL  54   0.725   6.743  -2.117
  379   2HG2  VAL  54          2HG2      VAL  54   1.898   7.844  -1.395
  380   3HG2  VAL  54          3HG2      VAL  54   0.794   6.936  -0.365
  381    HA   PRO  55           HA       PRO  55   6.674   3.222  -2.958
  382   1HB   PRO  55          2HB       PRO  55   8.626   4.042  -1.149
  383   2HB   PRO  55          1HB       PRO  55   8.577   4.450  -2.864
  384   1HG   PRO  55          2HG       PRO  55   7.823   6.059  -0.507
  385   2HG   PRO  55          1HG       PRO  55   8.459   6.584  -2.069
  386   1HD   PRO  55          2HD       PRO  55   5.849   6.864  -1.331
  387   2HD   PRO  55          1HD       PRO  55   6.381   6.700  -3.016
  388    H    LYS  56           H        LYS  56   6.104   1.338  -2.068
  389    HA   LYS  56           HA       LYS  56   5.720   1.193   0.831
  390   1HB   LYS  56          2HB       LYS  56   4.301  -0.610   0.542
  391   2HB   LYS  56          1HB       LYS  56   3.950   0.394  -0.849
  392   1HG   LYS  56          2HG       LYS  56   5.664  -2.084  -0.809
  393   2HG   LYS  56          1HG       LYS  56   4.043  -1.937  -1.486
  394   1HD   LYS  56          2HD       LYS  56   4.868  -0.369  -3.159
  395   2HD   LYS  56          1HD       LYS  56   6.486  -0.455  -2.458
  396   1HE   LYS  56          2HE       LYS  56   4.963  -2.746  -3.694
  397   2HE   LYS  56          1HE       LYS  56   6.296  -1.866  -4.444
  398   1HZ   LYS  56          1HZ       LYS  56   6.444  -3.522  -1.983
  399   2HZ   LYS  56          2HZ       LYS  56   7.724  -2.611  -2.608
  400   3HZ   LYS  56          3HZ       LYS  56   7.098  -3.908  -3.496
  401    H    GLY  57           H        GLY  57   8.198   0.631  -1.273
  402   1HA   GLY  57          2HA       GLY  57   9.190  -1.881  -0.782
  403   2HA   GLY  57          1HA       GLY  57  10.211  -0.463  -0.965
  404    H    ILE  58           H        ILE  58   8.924   0.745   1.451
  405    HA   ILE  58           HA       ILE  58   9.710  -0.981   3.610
  406    HB   ILE  58           HB       ILE  58  11.033   1.718   3.327
  407   1HG1  ILE  58          2HG1      ILE  58  13.159   0.254   3.212
  408   2HG1  ILE  58          1HG1      ILE  58  12.068  -1.057   2.772
  409   1HG2  ILE  58          1HG2      ILE  58  10.466   0.738   5.631
  410   2HG2  ILE  58          2HG2      ILE  58  12.110   1.310   5.351
  411   3HG2  ILE  58          3HG2      ILE  58  11.757  -0.417   5.301
  412   1HD1  ILE  58          1HD1      ILE  58  13.156   1.028   1.146
  413   2HD1  ILE  58          2HD1      ILE  58  11.394   1.093   1.113
  414   3HD1  ILE  58          3HD1      ILE  58  12.231  -0.397   0.672
  415    H    ALA  59           H        ALA  59   7.246  -0.497   3.337
  416    HA   ALA  59           HA       ALA  59   6.619   1.592   5.275
  417   1HB   ALA  59          1HB       ALA  59   4.903   2.595   3.930
  418   2HB   ALA  59          2HB       ALA  59   5.159   1.405   2.652
  419   3HB   ALA  59          3HB       ALA  59   6.415   2.588   3.022
  420    H    VAL  60           H        VAL  60   5.427   0.712   6.870
  421    HA   VAL  60           HA       VAL  60   4.001  -1.723   6.553
  422    HB   VAL  60           HB       VAL  60   3.316  -1.401   8.835
  423   1HG1  VAL  60          1HG1      VAL  60   5.710  -2.025   8.189
  424   2HG1  VAL  60          2HG1      VAL  60   5.395  -1.557   9.860
  425   3HG1  VAL  60          3HG1      VAL  60   6.128  -0.405   8.746
  426   1HG2  VAL  60          1HG2      VAL  60   2.725   0.912   8.884
  427   2HG2  VAL  60          2HG2      VAL  60   4.383   1.388   8.508
  428   3HG2  VAL  60          3HG2      VAL  60   4.007   0.662  10.071
  429    H    PHE  61           H        PHE  61   2.015  -1.989   5.760
  430    HA   PHE  61           HA       PHE  61   0.253   0.367   5.611
  431   1HB   PHE  61          2HB       PHE  61   0.683  -1.959   3.785
  432   2HB   PHE  61          1HB       PHE  61  -0.887  -1.168   3.803
  433    HD1  PHE  61           1HD      PHE  61   2.470   0.389   4.164
  434    HD2  PHE  61           2HD      PHE  61  -0.977  -0.153   1.735
  435    HE1  PHE  61           1HE      PHE  61   3.309   2.090   2.601
  436    HE2  PHE  61           2HE      PHE  61  -0.147   1.543   0.167
  437    HZ   PHE  61           HZ       PHE  61   2.001   2.671   0.596
  438    H    HIS  62           H        HIS  62  -1.914   0.198   6.086
  439    HA   HIS  62           HA       HIS  62  -2.896  -2.311   7.239
  440   1HB   HIS  62          2HB       HIS  62  -3.063   0.394   8.592
  441   2HB   HIS  62          1HB       HIS  62  -3.910  -1.051   9.130
  442    HD1  HIS  62           1HD      HIS  62  -0.284  -0.137   8.379
  443    HD2  HIS  62           2HD      HIS  62  -2.563  -2.276  11.116
  444    HE1  HIS  62           1HE      HIS  62   1.355  -1.050  10.052
  445    HE2  HIS  62           2HE      HIS  62  -0.039  -2.396  11.661
  446    H    PHE  63           H        PHE  63  -4.460  -2.738   5.749
  447    HA   PHE  63           HA       PHE  63  -6.200  -0.509   4.952
  448   1HB   PHE  63          2HB       PHE  63  -6.762  -1.746   2.978
  449   2HB   PHE  63          1HB       PHE  63  -5.013  -1.734   3.141
  450    HD1  PHE  63           1HD      PHE  63  -3.863  -3.705   2.891
  451    HD2  PHE  63           2HD      PHE  63  -7.980  -3.841   3.956
  452    HE1  PHE  63           1HE      PHE  63  -3.842  -6.154   2.643
  453    HE2  PHE  63           2HE      PHE  63  -7.966  -6.289   3.719
  454    HZ   PHE  63           HZ       PHE  63  -5.895  -7.450   3.060
  455    H    ARG  64           H        ARG  64  -8.353  -0.545   5.160
  456    HA   ARG  64           HA       ARG  64  -9.478  -2.740   6.763
  457   1HB   ARG  64          2HB       ARG  64 -10.325   0.152   6.532
  458   2HB   ARG  64          1HB       ARG  64 -11.235  -1.070   7.405
  459   1HG   ARG  64          2HG       ARG  64  -9.971   0.187   8.981
  460   2HG   ARG  64          1HG       ARG  64  -9.254  -1.419   8.864
  461   1HD   ARG  64          2HD       ARG  64  -7.580   0.405   8.931
  462   2HD   ARG  64          1HD       ARG  64  -7.475  -0.582   7.478
  463    HE   ARG  64           HE       ARG  64  -7.888   1.298   6.265
  464   1HH1  ARG  64          1HH1      ARG  64  -9.108   1.814   9.496
  465   2HH1  ARG  64          2HH1      ARG  64  -9.620   3.436   9.176
  466   1HH2  ARG  64          1HH2      ARG  64  -8.556   3.432   5.847
  467   2HH2  ARG  64          2HH2      ARG  64  -9.305   4.356   7.107
  468    H    THR  65           H        THR  65 -11.544  -3.550   6.244
  469    HA   THR  65           HA       THR  65 -12.303  -3.115   3.438
  470    HB   THR  65           HB       THR  65 -12.897  -5.460   5.254
  471    HG1  THR  65           1HG      THR  65 -11.393  -6.530   3.945
  472   1HG2  THR  65          1HG2      THR  65 -14.473  -4.865   3.240
  473   2HG2  THR  65          2HG2      THR  65 -13.987  -6.528   3.568
  474   3HG2  THR  65          3HG2      THR  65 -13.175  -5.602   2.305
  475    HA   PRO  66           HA       PRO  66 -15.993  -0.911   4.494
  476   1HB   PRO  66          2HB       PRO  66 -17.197  -2.774   2.483
  477   2HB   PRO  66          1HB       PRO  66 -17.369  -1.021   2.634
  478   1HG   PRO  66          2HG       PRO  66 -15.747  -2.072   0.802
  479   2HG   PRO  66          1HG       PRO  66 -15.297  -0.601   1.686
  480   1HD   PRO  66          2HD       PRO  66 -14.262  -3.370   1.968
  481   2HD   PRO  66          1HD       PRO  66 -13.448  -1.823   2.264
  482    H    GLN  67           H        GLN  67 -16.130  -4.440   4.197
  483    HA   GLN  67           HA       GLN  67 -18.554  -4.837   5.552
  484   1HB   GLN  67          2HB       GLN  67 -16.150  -6.662   5.382
  485   2HB   GLN  67          1HB       GLN  67 -17.758  -7.149   5.900
  486   1HG   GLN  67          2HG       GLN  67 -18.642  -6.587   3.694
  487   2HG   GLN  67          1HG       GLN  67 -17.030  -6.099   3.175
  488   1HE2  GLN  67          1HE2      GLN  67 -19.202  -8.508   3.000
  489   2HE2  GLN  67          2HE2      GLN  67 -18.148  -9.854   2.746
  490    H    GLY  68           H        GLY  68 -15.522  -3.809   6.723
  491   1HA   GLY  68          2HA       GLY  68 -15.349  -2.909   8.936
  492   2HA   GLY  68          1HA       GLY  68 -16.498  -4.126   9.479
  493    H    GLU  69           H        GLU  69 -13.523  -4.418   7.550
  494    HA   GLU  69           HA       GLU  69 -12.430  -6.135   9.684
  495   1HB   GLU  69          2HB       GLU  69 -12.186  -6.584   6.705
  496   2HB   GLU  69          1HB       GLU  69 -11.424  -7.563   7.951
  497   1HG   GLU  69          2HG       GLU  69 -13.619  -8.225   8.782
  498   2HG   GLU  69          1HG       GLU  69 -14.389  -7.235   7.543
  499    H    LEU  70           H        LEU  70 -10.113  -6.263   9.789
  500    HA   LEU  70           HA       LEU  70  -8.730  -3.996   8.514
  501   1HB   LEU  70          2HB       LEU  70  -9.182  -3.454  10.848
  502   2HB   LEU  70          1HB       LEU  70  -8.436  -4.955  11.363
  503    HG   LEU  70           HG       LEU  70  -6.265  -4.164  10.506
  504   1HD1  LEU  70          1HD1      LEU  70  -5.960  -1.917   9.736
  505   2HD1  LEU  70          2HD1      LEU  70  -7.651  -1.528  10.044
  506   3HD1  LEU  70          3HD1      LEU  70  -7.229  -2.661   8.763
  507   1HD2  LEU  70          1HD2      LEU  70  -6.833  -3.797  12.843
  508   2HD2  LEU  70          2HD2      LEU  70  -7.632  -2.280  12.427
  509   3HD2  LEU  70          3HD2      LEU  70  -5.888  -2.444  12.221
  510    H    VAL  71           H        VAL  71  -6.675  -4.379   7.768
  511    HA   VAL  71           HA       VAL  71  -5.502  -7.019   8.300
  512    HB   VAL  71           HB       VAL  71  -5.699  -5.787   5.552
  513   1HG1  VAL  71          1HG1      VAL  71  -4.192  -8.060   6.676
  514   2HG1  VAL  71          2HG1      VAL  71  -3.831  -7.029   5.292
  515   3HG1  VAL  71          3HG1      VAL  71  -4.991  -8.346   5.132
  516   1HG2  VAL  71          1HG2      VAL  71  -7.166  -8.128   6.760
  517   2HG2  VAL  71          2HG2      VAL  71  -7.174  -7.715   5.046
  518   3HG2  VAL  71          3HG2      VAL  71  -7.865  -6.600   6.226
  519    H    GLU  72           H        GLU  72  -3.357  -7.013   8.610
  520    HA   GLU  72           HA       GLU  72  -1.990  -4.440   8.517
  521   1HB   GLU  72          2HB       GLU  72  -1.177  -7.086   9.732
  522   2HB   GLU  72          1HB       GLU  72  -0.222  -5.613   9.816
  523   1HG   GLU  72          2HG       GLU  72  -1.417  -5.935  11.877
  524   2HG   GLU  72          1HG       GLU  72  -2.045  -4.518  11.040
  525    H    ILE  73           H        ILE  73   0.012  -4.132   7.528
  526    HA   ILE  73           HA       ILE  73   0.984  -6.173   5.677
  527    HB   ILE  73           HB       ILE  73   0.246  -3.368   4.833
  528   1HG1  ILE  73          2HG1      ILE  73  -0.824  -6.049   3.936
  529   2HG1  ILE  73          1HG1      ILE  73  -1.680  -4.872   4.930
  530   1HG2  ILE  73          1HG2      ILE  73   2.341  -4.057   3.807
  531   2HG2  ILE  73          2HG2      ILE  73   1.050  -3.995   2.609
  532   3HG2  ILE  73          3HG2      ILE  73   1.588  -5.550   3.245
  533   1HD1  ILE  73          1HD1      ILE  73  -0.719  -4.301   2.136
  534   2HD1  ILE  73          2HD1      ILE  73  -1.809  -3.326   3.122
  535   3HD1  ILE  73          3HD1      ILE  73  -2.334  -4.898   2.517
  536    H    ASP  74           H        ASP  74   3.184  -6.171   5.556
  537    HA   ASP  74           HA       ASP  74   4.558  -3.949   6.908
  538   1HB   ASP  74          2HB       ASP  74   5.563  -6.764   6.448
  539   2HB   ASP  74          1HB       ASP  74   6.379  -5.497   7.362
  540    H    GLY  75           H        GLY  75   4.999  -2.539   5.339
  541   1HA   GLY  75          2HA       GLY  75   5.785  -3.222   2.709
  542   2HA   GLY  75          1HA       GLY  75   5.861  -1.631   3.429
  543    H    ARG  76           H        ARG  76   7.561  -3.220   5.608
  544    HA   ARG  76           HA       ARG  76  10.048  -2.347   4.566
  545   1HB   ARG  76          2HB       ARG  76   9.501  -4.104   6.955
  546   2HB   ARG  76          1HB       ARG  76  11.036  -3.331   6.591
  547   1HG   ARG  76          2HG       ARG  76   9.833  -1.126   6.740
  548   2HG   ARG  76          1HG       ARG  76   8.453  -2.020   7.381
  549   1HD   ARG  76          2HD       ARG  76  11.222  -1.862   8.562
  550   2HD   ARG  76          1HD       ARG  76   9.752  -1.139   9.212
  551    HE   ARG  76           HE       ARG  76  10.648  -3.793   9.610
  552   1HH1  ARG  76          1HH1      ARG  76   7.747  -1.914   9.159
  553   2HH1  ARG  76          2HH1      ARG  76   6.727  -3.064   9.954
  554   1HH2  ARG  76          1HH2      ARG  76   9.311  -5.305  10.667
  555   2HH2  ARG  76          2HH2      ARG  76   7.615  -4.988  10.814
  556    H    ALA  77           H        ALA  77   8.565  -5.481   5.006
  557    HA   ALA  77           HA       ALA  77  10.787  -6.762   3.636
  558   1HB   ALA  77          1HB       ALA  77   9.300  -8.848   4.370
  559   2HB   ALA  77          2HB       ALA  77   8.758  -7.677   5.573
  560   3HB   ALA  77          3HB       ALA  77  10.470  -8.081   5.445
  561    H    LEU  78           H        LEU  78   7.955  -5.368   2.774
  562    HA   LEU  78           HA       LEU  78   6.880  -7.371   1.030
  563   1HB   LEU  78          2HB       LEU  78   5.826  -5.182   2.129
  564   2HB   LEU  78          1HB       LEU  78   6.312  -4.482   0.600
  565    HG   LEU  78           HG       LEU  78   3.980  -5.168   0.534
  566   1HD1  LEU  78          1HD1      LEU  78   5.488  -5.382  -1.488
  567   2HD1  LEU  78          2HD1      LEU  78   3.990  -6.311  -1.520
  568   3HD1  LEU  78          3HD1      LEU  78   5.517  -7.114  -1.157
  569   1HD2  LEU  78          1HD2      LEU  78   5.059  -7.590   1.751
  570   2HD2  LEU  78          2HD2      LEU  78   3.931  -7.904   0.433
  571   3HD2  LEU  78          3HD2      LEU  78   3.430  -6.918   1.806
  572    H    VAL  79           H        VAL  79   9.690  -5.648   0.829
  573    HA   VAL  79           HA       VAL  79   9.869  -4.554  -1.678
  574    HB   VAL  79           HB       VAL  79  12.003  -6.239  -0.357
  575   1HG1  VAL  79          1HG1      VAL  79  13.344  -4.311  -1.654
  576   2HG1  VAL  79          2HG1      VAL  79  11.959  -4.484  -2.731
  577   3HG1  VAL  79          3HG1      VAL  79  12.972  -5.880  -2.368
  578   1HG2  VAL  79          1HG2      VAL  79  12.444  -4.572   1.075
  579   2HG2  VAL  79          2HG2      VAL  79  10.802  -4.036   0.718
  580   3HG2  VAL  79          3HG2      VAL  79  12.168  -3.325  -0.141
  581    H    ALA  80           H        ALA  80   8.890  -5.502  -3.386
  582    HA   ALA  80           HA       ALA  80   9.514  -8.308  -4.000
  583   1HB   ALA  80          1HB       ALA  80   7.348  -6.483  -5.031
  584   2HB   ALA  80          2HB       ALA  80   7.158  -7.850  -3.932
  585   3HB   ALA  80          3HB       ALA  80   7.627  -8.125  -5.609
  586    H    ARG  81           H        ARG  81  11.414  -8.339  -5.103
  587    HA   ARG  81           HA       ARG  81  11.591  -6.580  -7.466
  588   1HB   ARG  81          2HB       ARG  81  13.270  -6.187  -5.576
  589   2HB   ARG  81          1HB       ARG  81  13.971  -7.729  -6.039
  590   1HG   ARG  81          2HG       ARG  81  14.441  -6.894  -8.257
  591   2HG   ARG  81          1HG       ARG  81  13.669  -5.358  -7.862
  592   1HD   ARG  81          2HD       ARG  81  15.348  -5.038  -6.060
  593   2HD   ARG  81          1HD       ARG  81  16.155  -6.512  -6.596
  594    HE   ARG  81           HE       ARG  81  16.424  -3.941  -7.730
  595   1HH1  ARG  81          1HH1      ARG  81  16.227  -7.308  -8.627
  596   2HH1  ARG  81          2HH1      ARG  81  17.078  -7.089 -10.117
  597   1HH2  ARG  81          1HH2      ARG  81  17.549  -3.654  -9.687
  598   2HH2  ARG  81          2HH2      ARG  81  17.832  -5.016 -10.718
  599    HA   PRO  82           HA       PRO  82  11.542 -10.130 -10.060
  600   1HB   PRO  82          2HB       PRO  82  13.680  -8.748 -11.589
  601   2HB   PRO  82          1HB       PRO  82  12.140  -9.409 -12.153
  602   1HG   PRO  82          2HG       PRO  82  12.466  -6.783 -11.867
  603   2HG   PRO  82          1HG       PRO  82  10.935  -7.563 -11.429
  604   1HD   PRO  82          2HD       PRO  82  13.127  -6.565  -9.667
  605   2HD   PRO  82          1HD       PRO  82  11.372  -6.533  -9.413
  606    H    GLU  83           H        GLU  83  14.639  -8.885  -8.982
  607    HA   GLU  83           HA       GLU  83  15.773 -11.581  -9.290
  608   1HB   GLU  83          2HB       GLU  83  17.235  -8.954  -9.043
  609   2HB   GLU  83          1HB       GLU  83  17.978 -10.528  -9.289
  610   1HG   GLU  83          2HG       GLU  83  16.115  -9.146 -11.209
  611   2HG   GLU  83          1HG       GLU  83  17.869  -9.240 -11.358
  612    H    GLU  84           H        GLU  84  14.907  -9.248  -6.908
  613    HA   GLU  84           HA       GLU  84  16.701 -10.349  -4.919
  614   1HB   GLU  84          2HB       GLU  84  16.122  -7.933  -4.937
  615   2HB   GLU  84          1HB       GLU  84  14.466  -8.360  -4.530
  616   1HG   GLU  84          2HG       GLU  84  15.648  -7.648  -2.556
  617   2HG   GLU  84          1HG       GLU  84  15.236  -9.358  -2.435
  618    H    ARG  85           H        ARG  85  13.152 -10.230  -5.357
  619    HA   ARG  85           HA       ARG  85  13.017 -12.732  -3.845
  620   1HB   ARG  85          2HB       ARG  85  12.566 -10.923  -2.245
  621   2HB   ARG  85          1HB       ARG  85  11.257 -10.345  -3.268
  622   1HG   ARG  85          2HG       ARG  85   9.977 -12.316  -2.871
  623   2HG   ARG  85          1HG       ARG  85  11.333 -13.097  -2.053
  624   1HD   ARG  85          2HD       ARG  85   9.721 -12.282  -0.430
  625   2HD   ARG  85          1HD       ARG  85  11.238 -11.397  -0.289
  626    HE   ARG  85           HE       ARG  85  10.090  -9.494  -0.767
  627   1HH1  ARG  85          1HH1      ARG  85   8.243 -12.202  -1.969
  628   2HH1  ARG  85          2HH1      ARG  85   6.922 -11.221  -2.507
  629   1HH2  ARG  85          1HH2      ARG  85   8.354  -8.206  -1.472
  630   2HH2  ARG  85          2HH2      ARG  85   6.983  -8.952  -2.220
  631    H    ILE  86           H        ILE  86  10.422 -10.565  -4.994
  632    HA   ILE  86           HA       ILE  86   9.040 -12.745  -6.145
  633    HB   ILE  86           HB       ILE  86   8.581  -9.789  -6.507
  634   1HG1  ILE  86          2HG1      ILE  86   7.323 -11.890  -4.732
  635   2HG1  ILE  86          1HG1      ILE  86   8.236 -10.474  -4.225
  636   1HG2  ILE  86          1HG2      ILE  86   6.230 -11.307  -7.001
  637   2HG2  ILE  86          2HG2      ILE  86   7.519 -11.964  -8.005
  638   3HG2  ILE  86          3HG2      ILE  86   7.108 -10.252  -8.108
  639   1HD1  ILE  86          1HD1      ILE  86   5.418 -10.747  -4.899
  640   2HD1  ILE  86          2HD1      ILE  86   6.197  -9.363  -5.664
  641   3HD1  ILE  86          3HD1      ILE  86   6.240  -9.542  -3.912
  Start of MODEL    5
    1    H    ARG   9           H        ARG   9  -9.204 -13.927  -5.766
    2    HA   ARG   9           HA       ARG   9  -8.355 -13.355  -8.494
    3   1HB   ARG   9          2HB       ARG   9  -9.717 -11.376  -8.715
    4   2HB   ARG   9          1HB       ARG   9 -10.759 -12.755  -8.408
    5   1HG   ARG   9          2HG       ARG   9  -9.875 -10.887  -6.230
    6   2HG   ARG   9          1HG       ARG   9 -11.317 -10.602  -7.204
    7   1HD   ARG   9          2HD       ARG   9 -10.776 -13.015  -5.476
    8   2HD   ARG   9          1HD       ARG   9 -11.888 -11.700  -5.111
    9    HE   ARG   9           HE       ARG   9 -12.574 -12.829  -7.590
   10   1HH1  ARG   9          1HH1      ARG   9 -12.629 -13.581  -4.183
   11   2HH1  ARG   9          2HH1      ARG   9 -13.980 -14.656  -4.314
   12   1HH2  ARG   9          1HH2      ARG   9 -14.353 -14.240  -7.764
   13   2HH2  ARG   9          2HH2      ARG   9 -14.960 -15.031  -6.348
   14    H    HIS  10           H        HIS  10  -7.217 -11.277  -8.673
   15    HA   HIS  10           HA       HIS  10  -5.878 -10.610  -6.137
   16   1HB   HIS  10          2HB       HIS  10  -4.407 -11.637  -7.821
   17   2HB   HIS  10          1HB       HIS  10  -4.830 -10.370  -8.966
   18    HD1  HIS  10           1HD      HIS  10  -4.284  -7.823  -7.811
   19    HD2  HIS  10           2HD      HIS  10  -2.049 -11.122  -6.637
   20    HE1  HIS  10           1HE      HIS  10  -2.174  -6.886  -6.822
   21    HE2  HIS  10           2HE      HIS  10  -0.794  -8.902  -6.207
   22    H    GLU  11           H        GLU  11  -7.513  -9.054  -5.625
   23    HA   GLU  11           HA       GLU  11  -7.138  -6.523  -7.073
   24   1HB   GLU  11          2HB       GLU  11  -9.769  -7.592  -6.035
   25   2HB   GLU  11          1HB       GLU  11  -9.524  -5.995  -6.730
   26   1HG   GLU  11          2HG       GLU  11  -8.904  -7.013  -8.859
   27   2HG   GLU  11          1HG       GLU  11  -9.145  -8.615  -8.163
   28    H    LEU  12           H        LEU  12  -7.063  -4.682  -5.819
   29    HA   LEU  12           HA       LEU  12  -7.405  -5.009  -2.921
   30   1HB   LEU  12          2HB       LEU  12  -5.014  -5.268  -3.509
   31   2HB   LEU  12          1HB       LEU  12  -5.039  -3.675  -4.239
   32    HG   LEU  12           HG       LEU  12  -5.487  -2.662  -2.055
   33   1HD1  LEU  12          1HD1      LEU  12  -5.317  -5.489  -1.024
   34   2HD1  LEU  12          2HD1      LEU  12  -6.749  -4.459  -1.031
   35   3HD1  LEU  12          3HD1      LEU  12  -5.365  -4.036  -0.024
   36   1HD2  LEU  12          1HD2      LEU  12  -3.120  -3.587  -2.956
   37   2HD2  LEU  12          2HD2      LEU  12  -3.210  -4.406  -1.396
   38   3HD2  LEU  12          3HD2      LEU  12  -3.309  -2.647  -1.476
   39    H    ILE  13           H        ILE  13  -8.610  -3.508  -5.438
   40    HA   ILE  13           HA       ILE  13  -8.541  -0.775  -4.431
   41    HB   ILE  13           HB       ILE  13  -9.936  -1.923  -6.858
   42   1HG1  ILE  13          2HG1      ILE  13  -8.162  -0.670  -8.102
   43   2HG1  ILE  13          1HG1      ILE  13  -7.377  -0.334  -6.563
   44   1HG2  ILE  13          1HG2      ILE  13 -10.132   0.483  -7.530
   45   2HG2  ILE  13          2HG2      ILE  13  -9.641   0.914  -5.891
   46   3HG2  ILE  13          3HG2      ILE  13 -11.135   0.014  -6.156
   47   1HD1  ILE  13          1HD1      ILE  13  -7.951  -3.151  -7.353
   48   2HD1  ILE  13          2HD1      ILE  13  -6.698  -2.516  -6.287
   49   3HD1  ILE  13          3HD1      ILE  13  -6.562  -2.302  -8.032
   50    H    GLY  14           H        GLY  14 -10.521   0.420  -4.041
   51   1HA   GLY  14          2HA       GLY  14 -12.858   0.516  -3.586
   52   2HA   GLY  14          1HA       GLY  14 -12.859  -1.229  -3.378
   53    H    LEU  15           H        LEU  15 -10.385  -1.025  -1.695
   54    HA   LEU  15           HA       LEU  15 -11.755  -0.269   0.786
   55   1HB   LEU  15          2HB       LEU  15  -9.893  -1.649   1.844
   56   2HB   LEU  15          1HB       LEU  15 -11.117  -2.508   0.930
   57    HG   LEU  15           HG       LEU  15  -9.599  -2.726  -0.962
   58   1HD1  LEU  15          1HD1      LEU  15  -7.825  -1.008   0.729
   59   2HD1  LEU  15          2HD1      LEU  15  -8.264  -0.826  -0.969
   60   3HD1  LEU  15          3HD1      LEU  15  -7.149  -2.100  -0.479
   61   1HD2  LEU  15          1HD2      LEU  15  -9.468  -4.104   1.381
   62   2HD2  LEU  15          2HD2      LEU  15  -7.789  -3.608   1.166
   63   3HD2  LEU  15          3HD2      LEU  15  -8.603  -4.536  -0.094
   64    H    SER  16           H        SER  16 -10.309   0.556   2.558
   65    HA   SER  16           HA       SER  16  -8.658   2.707   1.466
   66   1HB   SER  16          2HB       SER  16 -10.420   3.347   3.041
   67   2HB   SER  16          1HB       SER  16  -9.738   2.276   4.263
   68    HG   SER  16           HG       SER  16  -7.917   3.577   4.347
   69    H    VAL  17           H        VAL  17  -6.623   3.266   2.516
   70    HA   VAL  17           HA       VAL  17  -5.265   0.971   3.752
   71    HB   VAL  17           HB       VAL  17  -4.587   1.023   1.422
   72   1HG1  VAL  17          1HG1      VAL  17  -4.903   3.113   0.555
   73   2HG1  VAL  17          2HG1      VAL  17  -3.159   3.157   0.811
   74   3HG1  VAL  17          3HG1      VAL  17  -4.238   3.924   1.974
   75   1HG2  VAL  17          1HG2      VAL  17  -2.298   0.869   1.748
   76   2HG2  VAL  17          2HG2      VAL  17  -2.925   0.669   3.384
   77   3HG2  VAL  17          3HG2      VAL  17  -2.263   2.224   2.875
   78    H    ARG  18           H        ARG  18  -3.490   1.491   5.111
   79    HA   ARG  18           HA       ARG  18  -3.153   4.313   5.813
   80   1HB   ARG  18          2HB       ARG  18  -4.847   3.450   7.355
   81   2HB   ARG  18          1HB       ARG  18  -3.779   2.128   7.810
   82   1HG   ARG  18          2HG       ARG  18  -2.202   3.708   8.772
   83   2HG   ARG  18          1HG       ARG  18  -3.230   5.054   8.275
   84   1HD   ARG  18          2HD       ARG  18  -3.994   2.865  10.203
   85   2HD   ARG  18          1HD       ARG  18  -3.537   4.510  10.640
   86    HE   ARG  18           HE       ARG  18  -5.672   4.634   8.837
   87   1HH1  ARG  18          1HH1      ARG  18  -5.019   3.599  12.106
   88   2HH1  ARG  18          2HH1      ARG  18  -6.632   3.904  12.658
   89   1HH2  ARG  18          1HH2      ARG  18  -7.795   5.036   9.563
   90   2HH2  ARG  18          2HH2      ARG  18  -8.208   4.720  11.215
   91    H    ILE  19           H        ILE  19  -1.092   4.844   6.164
   92    HA   ILE  19           HA       ILE  19   0.885   2.675   6.262
   93    HB   ILE  19           HB       ILE  19   1.302   5.592   5.590
   94   1HG1  ILE  19          2HG1      ILE  19  -0.067   4.457   3.902
   95   2HG1  ILE  19          1HG1      ILE  19   1.538   4.824   3.268
   96   1HG2  ILE  19          1HG2      ILE  19   3.116   3.322   6.004
   97   2HG2  ILE  19          2HG2      ILE  19   3.423   5.056   6.102
   98   3HG2  ILE  19          3HG2      ILE  19   3.409   4.251   4.534
   99   1HD1  ILE  19          1HD1      ILE  19   0.610   2.136   4.284
  100   2HD1  ILE  19          2HD1      ILE  19   2.217   2.502   3.652
  101   3HD1  ILE  19          3HD1      ILE  19   0.810   2.597   2.590
  102    H    ALA  20           H        ALA  20   1.484   2.182   8.288
  103    HA   ALA  20           HA       ALA  20   1.420   4.134  10.405
  104   1HB   ALA  20          1HB       ALA  20   0.910   2.133  11.338
  105   2HB   ALA  20          2HB       ALA  20   2.658   2.070  11.567
  106   3HB   ALA  20          3HB       ALA  20   1.915   1.225  10.210
  107    H    ARG  21           H        ARG  21   3.711   3.052   8.112
  108    HA   ARG  21           HA       ARG  21   5.670   4.891   9.089
  109   1HB   ARG  21          2HB       ARG  21   6.170   2.882  10.439
  110   2HB   ARG  21          1HB       ARG  21   6.385   1.965   8.956
  111   1HG   ARG  21          2HG       ARG  21   8.529   2.587   9.866
  112   2HG   ARG  21          1HG       ARG  21   8.255   3.424   8.336
  113   1HD   ARG  21          2HD       ARG  21   7.592   5.437   9.547
  114   2HD   ARG  21          1HD       ARG  21   7.831   4.602  11.082
  115    HE   ARG  21           HE       ARG  21  10.210   4.466   9.610
  116   1HH1  ARG  21          1HH1      ARG  21   8.230   6.827  11.247
  117   2HH1  ARG  21          2HH1      ARG  21   9.561   7.870  11.621
  118   1HH2  ARG  21          1HH2      ARG  21  11.964   5.837  10.100
  119   2HH2  ARG  21          2HH2      ARG  21  11.680   7.309  10.969
  120    H    SER  22           H        SER  22   7.153   5.473   7.536
  121    HA   SER  22           HA       SER  22   7.036   4.106   4.950
  122   1HB   SER  22          2HB       SER  22   6.601   7.079   5.311
  123   2HB   SER  22          1HB       SER  22   6.793   6.261   3.761
  124    HG   SER  22           HG       SER  22   4.815   5.525   3.894
  125    H    VAL  23           H        VAL  23   8.737   4.878   3.439
  126    HA   VAL  23           HA       VAL  23  11.270   4.748   4.604
  127    HB   VAL  23           HB       VAL  23  10.847   4.137   2.266
  128   1HG1  VAL  23          1HG1      VAL  23  10.576   5.834   0.544
  129   2HG1  VAL  23          2HG1      VAL  23  10.587   7.102   1.770
  130   3HG1  VAL  23          3HG1      VAL  23   9.267   5.931   1.722
  131   1HG2  VAL  23          1HG2      VAL  23  13.117   4.440   2.648
  132   2HG2  VAL  23          2HG2      VAL  23  12.948   6.179   2.883
  133   3HG2  VAL  23          3HG2      VAL  23  12.816   5.493   1.265
  134    H    HIS  24           H        HIS  24   9.397   7.531   3.476
  135    HA   HIS  24           HA       HIS  24  11.391   9.303   4.728
  136   1HB   HIS  24          2HB       HIS  24   9.492   9.868   2.441
  137   2HB   HIS  24          1HB       HIS  24  10.523  11.075   3.205
  138    HD1  HIS  24           1HD      HIS  24  11.121  10.945   0.400
  139    HD2  HIS  24           2HD      HIS  24  12.736   8.136   2.999
  140    HE1  HIS  24           1HE      HIS  24  13.130  10.010  -0.786
  141    HE2  HIS  24           2HE      HIS  24  14.147   8.381   0.846
  142    H    ARG  25           H        ARG  25  10.744  10.732   6.252
  143    HA   ARG  25           HA       ARG  25   8.345  10.292   7.635
  144   1HB   ARG  25          2HB       ARG  25  10.163  12.701   7.750
  145   2HB   ARG  25          1HB       ARG  25   8.947  12.277   8.947
  146   1HG   ARG  25          2HG       ARG  25  10.161  10.224   9.461
  147   2HG   ARG  25          1HG       ARG  25  11.382  10.645   8.258
  148   1HD   ARG  25          2HD       ARG  25  11.885  12.696   9.525
  149   2HD   ARG  25          1HD       ARG  25  10.698  12.223  10.738
  150    HE   ARG  25           HE       ARG  25  12.290  10.884  11.655
  151   1HH1  ARG  25          1HH1      ARG  25  13.132  11.412   8.308
  152   2HH1  ARG  25          2HH1      ARG  25  14.591  10.485   8.400
  153   1HH2  ARG  25          1HH2      ARG  25  14.214   9.670  11.777
  154   2HH2  ARG  25          2HH2      ARG  25  15.207   9.499  10.368
  155    H    ASP  26           H        ASP  26   9.092  12.332   4.963
  156    HA   ASP  26           HA       ASP  26   6.997  14.202   5.265
  157   1HB   ASP  26          2HB       ASP  26   8.458  13.333   2.766
  158   2HB   ASP  26          1HB       ASP  26   7.420  14.750   2.894
  159    H    ILE  27           H        ILE  27   7.096  10.970   4.122
  160    HA   ILE  27           HA       ILE  27   4.376  11.215   3.087
  161    HB   ILE  27           HB       ILE  27   4.778   9.121   1.853
  162   1HG1  ILE  27          2HG1      ILE  27   7.611   9.443   2.873
  163   2HG1  ILE  27          1HG1      ILE  27   6.491   8.157   3.310
  164   1HG2  ILE  27          1HG2      ILE  27   5.061  11.003   0.527
  165   2HG2  ILE  27          2HG2      ILE  27   6.574  10.126   0.291
  166   3HG2  ILE  27          3HG2      ILE  27   6.517  11.512   1.381
  167   1HD1  ILE  27          1HD1      ILE  27   6.668   7.126   1.247
  168   2HD1  ILE  27          2HD1      ILE  27   8.312   7.692   1.547
  169   3HD1  ILE  27          3HD1      ILE  27   7.256   8.587   0.454
  170    H    GLN  28           H        GLN  28   6.291   9.867   5.564
  171    HA   GLN  28           HA       GLN  28   4.906   7.536   6.204
  172   1HB   GLN  28          2HB       GLN  28   7.052   8.166   7.220
  173   2HB   GLN  28          1HB       GLN  28   6.268   9.490   8.069
  174   1HG   GLN  28          2HG       GLN  28   5.265   6.722   8.491
  175   2HG   GLN  28          1HG       GLN  28   6.772   7.212   9.258
  176   1HE2  GLN  28          1HE2      GLN  28   6.563   7.965  11.226
  177   2HE2  GLN  28          2HE2      GLN  28   5.173   8.753  11.881
  178    H    GLY  29           H        GLY  29   3.090   7.077   7.351
  179   1HA   GLY  29          2HA       GLY  29   1.175   7.453   8.608
  180   2HA   GLY  29          1HA       GLY  29   1.686   9.118   8.830
  181    H    ILE  30           H        ILE  30   1.640   7.981   5.593
  182    HA   ILE  30           HA       ILE  30  -0.401   9.859   4.908
  183    HB   ILE  30           HB       ILE  30   1.502   9.530   3.421
  184   1HG1  ILE  30          2HG1      ILE  30   0.266   9.270   1.298
  185   2HG1  ILE  30          1HG1      ILE  30  -1.112   8.625   2.186
  186   1HG2  ILE  30          1HG2      ILE  30   1.267   6.884   3.978
  187   2HG2  ILE  30          2HG2      ILE  30   2.218   7.549   2.650
  188   3HG2  ILE  30          3HG2      ILE  30   0.585   6.958   2.352
  189   1HD1  ILE  30          1HD1      ILE  30  -1.361  10.759   3.351
  190   2HD1  ILE  30          2HD1      ILE  30  -1.449  10.966   1.601
  191   3HD1  ILE  30          3HD1      ILE  30   0.024  11.404   2.469
  192    H    SER  31           H        SER  31  -2.431   9.338   5.466
  193    HA   SER  31           HA       SER  31  -3.393   6.609   5.043
  194   1HB   SER  31          2HB       SER  31  -3.907   7.649   7.207
  195   2HB   SER  31          1HB       SER  31  -4.720   8.980   6.385
  196    HG   SER  31           HG       SER  31  -6.315   7.586   6.929
  197    H    GLY  32           H        GLY  32  -4.916   6.074   3.520
  198   1HA   GLY  32          2HA       GLY  32  -6.637   7.887   2.240
  199   2HA   GLY  32          1HA       GLY  32  -5.188   7.721   1.260
  200    H    ARG  33           H        ARG  33  -6.676   6.872  -0.343
  201    HA   ARG  33           HA       ARG  33  -7.517   4.138   0.218
  202   1HB   ARG  33          2HB       ARG  33  -8.506   6.063  -1.847
  203   2HB   ARG  33          1HB       ARG  33  -8.922   4.358  -1.850
  204   1HG   ARG  33          2HG       ARG  33  -9.884   4.543   0.346
  205   2HG   ARG  33          1HG       ARG  33  -9.436   6.245   0.431
  206   1HD   ARG  33          2HD       ARG  33 -10.913   6.732  -1.452
  207   2HD   ARG  33          1HD       ARG  33 -11.335   5.023  -1.570
  208    HE   ARG  33           HE       ARG  33 -12.859   5.370   0.078
  209   1HH1  ARG  33          1HH1      ARG  33 -10.434   7.871   0.314
  210   2HH1  ARG  33          2HH1      ARG  33 -11.207   8.667   1.643
  211   1HH2  ARG  33          1HH2      ARG  33 -13.878   6.421   1.823
  212   2HH2  ARG  33          2HH2      ARG  33 -13.161   7.845   2.498
  213    H    VAL  34           H        VAL  34  -7.555   2.736  -1.786
  214    HA   VAL  34           HA       VAL  34  -4.775   2.616  -2.722
  215    HB   VAL  34           HB       VAL  34  -6.790   0.382  -2.554
  216   1HG1  VAL  34          1HG1      VAL  34  -4.601  -0.976  -2.693
  217   2HG1  VAL  34          2HG1      VAL  34  -3.909   0.498  -3.372
  218   3HG1  VAL  34          3HG1      VAL  34  -5.266  -0.292  -4.176
  219   1HG2  VAL  34          1HG2      VAL  34  -5.953  -0.195  -0.500
  220   2HG2  VAL  34          2HG2      VAL  34  -5.830   1.562  -0.410
  221   3HG2  VAL  34          3HG2      VAL  34  -4.402   0.594  -0.785
  222    H    VAL  35           H        VAL  35  -4.212   1.833  -4.827
  223    HA   VAL  35           HA       VAL  35  -6.373   1.768  -6.787
  224    HB   VAL  35           HB       VAL  35  -5.223   4.082  -6.809
  225   1HG1  VAL  35          1HG1      VAL  35  -3.253   4.269  -8.172
  226   2HG1  VAL  35          2HG1      VAL  35  -3.147   2.515  -8.292
  227   3HG1  VAL  35          3HG1      VAL  35  -2.934   3.307  -6.736
  228   1HG2  VAL  35          1HG2      VAL  35  -5.660   4.307  -9.119
  229   2HG2  VAL  35          2HG2      VAL  35  -6.753   3.051  -8.537
  230   3HG2  VAL  35          3HG2      VAL  35  -5.293   2.608  -9.424
  231    H    ASP  36           H        ASP  36  -2.859   1.378  -6.289
  232    HA   ASP  36           HA       ASP  36  -2.955  -1.298  -7.295
  233   1HB   ASP  36          2HB       ASP  36  -1.434   0.802  -8.854
  234   2HB   ASP  36          1HB       ASP  36  -1.300  -0.935  -9.107
  235    H    GLU  37           H        GLU  37  -0.938  -2.433  -6.940
  236    HA   GLU  37           HA       GLU  37   1.005  -0.941  -5.319
  237   1HB   GLU  37          2HB       GLU  37   1.187  -2.705  -3.710
  238   2HB   GLU  37          1HB       GLU  37  -0.511  -2.275  -3.846
  239   1HG   GLU  37          2HG       GLU  37   0.809  -4.633  -5.154
  240   2HG   GLU  37          1HG       GLU  37  -0.171  -4.681  -3.692
  241    H    THR  38           H        THR  38   3.003  -1.121  -6.115
  242    HA   THR  38           HA       THR  38   3.564  -3.403  -7.892
  243    HB   THR  38           HB       THR  38   4.941  -0.714  -7.851
  244    HG1  THR  38           1HG      THR  38   3.659  -0.172  -9.544
  245   1HG2  THR  38          1HG2      THR  38   5.851  -1.306  -9.982
  246   2HG2  THR  38          2HG2      THR  38   4.980  -2.840  -9.974
  247   3HG2  THR  38          3HG2      THR  38   6.277  -2.557  -8.816
  248    H    ARG  39           H        ARG  39   5.700  -4.290  -7.887
  249    HA   ARG  39           HA       ARG  39   6.653  -4.969  -5.362
  250   1HB   ARG  39          2HB       ARG  39   7.975  -5.131  -8.069
  251   2HB   ARG  39          1HB       ARG  39   8.647  -5.854  -6.613
  252   1HG   ARG  39          2HG       ARG  39   6.767  -7.319  -6.396
  253   2HG   ARG  39          1HG       ARG  39   5.926  -6.505  -7.714
  254   1HD   ARG  39          2HD       ARG  39   8.547  -7.971  -7.993
  255   2HD   ARG  39          1HD       ARG  39   6.969  -8.658  -8.379
  256    HE   ARG  39           HE       ARG  39   8.509  -6.954 -10.025
  257   1HH1  ARG  39          1HH1      ARG  39   5.209  -7.617  -9.098
  258   2HH1  ARG  39          2HH1      ARG  39   4.539  -6.975 -10.559
  259   1HH2  ARG  39          1HH2      ARG  39   7.627  -6.113 -11.949
  260   2HH2  ARG  39          2HH2      ARG  39   5.910  -6.124 -12.178
  261    H    ASN  40           H        ASN  40   7.303  -2.152  -7.229
  262    HA   ASN  40           HA       ASN  40   9.473  -1.475  -5.364
  263   1HB   ASN  40          2HB       ASN  40  10.505  -0.098  -7.114
  264   2HB   ASN  40          1HB       ASN  40  10.410  -1.790  -7.572
  265   1HD2  ASN  40          1HD2      ASN  40   7.328  -0.555  -7.881
  266   2HD2  ASN  40          2HD2      ASN  40   7.385  -0.124  -9.543
  267    H    THR  41           H        THR  41   6.352  -0.747  -6.084
  268    HA   THR  41           HA       THR  41   6.511   1.729  -4.629
  269    HB   THR  41           HB       THR  41   6.967   2.528  -6.901
  270    HG1  THR  41           1HG      THR  41   5.766   4.191  -6.505
  271   1HG2  THR  41          1HG2      THR  41   4.377   1.181  -7.574
  272   2HG2  THR  41          2HG2      THR  41   5.950   0.989  -8.349
  273   3HG2  THR  41          3HG2      THR  41   5.051   2.494  -8.539
  274    H    LEU  42           H        LEU  42   4.205   2.764  -4.593
  275    HA   LEU  42           HA       LEU  42   2.098   0.725  -4.622
  276   1HB   LEU  42          2HB       LEU  42   3.129   0.707  -2.380
  277   2HB   LEU  42          1HB       LEU  42   2.809   2.417  -2.215
  278    HG   LEU  42           HG       LEU  42   1.226   1.044  -0.945
  279   1HD1  LEU  42          1HD1      LEU  42   0.631   3.267  -2.167
  280   2HD1  LEU  42          2HD1      LEU  42  -0.654   2.295  -1.449
  281   3HD1  LEU  42          3HD1      LEU  42  -0.362   2.226  -3.186
  282   1HD2  LEU  42          1HD2      LEU  42   0.414  -0.020  -3.652
  283   2HD2  LEU  42          2HD2      LEU  42  -0.444  -0.315  -2.139
  284   3HD2  LEU  42          3HD2      LEU  42   1.195  -0.933  -2.360
  285    H    ARG  43           H        ARG  43   0.556   1.646  -5.854
  286    HA   ARG  43           HA       ARG  43   0.316   4.545  -5.904
  287   1HB   ARG  43          2HB       ARG  43   0.381   2.936  -7.948
  288   2HB   ARG  43          1HB       ARG  43  -1.309   2.656  -7.574
  289   1HG   ARG  43          2HG       ARG  43  -1.175   4.344  -9.257
  290   2HG   ARG  43          1HG       ARG  43  -1.685   5.110  -7.752
  291   1HD   ARG  43          2HD       ARG  43   0.492   5.994  -7.368
  292   2HD   ARG  43          1HD       ARG  43   1.180   5.031  -8.674
  293    HE   ARG  43           HE       ARG  43   0.617   6.715 -10.088
  294   1HH1  ARG  43          1HH1      ARG  43  -1.509   6.907  -7.325
  295   2HH1  ARG  43          2HH1      ARG  43  -2.359   8.290  -7.923
  296   1HH2  ARG  43          1HH2      ARG  43  -0.495   8.540 -10.864
  297   2HH2  ARG  43          2HH2      ARG  43  -1.782   9.221  -9.926
  298    H    ILE  44           H        ILE  44  -1.580   5.641  -5.387
  299    HA   ILE  44           HA       ILE  44  -3.523   4.115  -3.774
  300    HB   ILE  44           HB       ILE  44  -2.170   6.738  -3.319
  301   1HG1  ILE  44          2HG1      ILE  44  -2.822   4.408  -1.515
  302   2HG1  ILE  44          1HG1      ILE  44  -1.270   4.712  -2.289
  303   1HG2  ILE  44          1HG2      ILE  44  -4.110   6.583  -1.326
  304   2HG2  ILE  44          2HG2      ILE  44  -4.968   6.346  -2.845
  305   3HG2  ILE  44          3HG2      ILE  44  -3.976   7.780  -2.611
  306   1HD1  ILE  44          1HD1      ILE  44  -0.782   6.490  -0.899
  307   2HD1  ILE  44          2HD1      ILE  44  -1.603   5.364   0.181
  308   3HD1  ILE  44          3HD1      ILE  44  -2.473   6.752  -0.471
  309    H    GLU  45           H        GLU  45  -5.649   4.269  -4.265
  310    HA   GLU  45           HA       GLU  45  -6.539   6.651  -5.703
  311   1HB   GLU  45          2HB       GLU  45  -6.512   5.102  -7.475
  312   2HB   GLU  45          1HB       GLU  45  -7.168   3.807  -6.481
  313   1HG   GLU  45          2HG       GLU  45  -9.307   4.992  -6.382
  314   2HG   GLU  45          1HG       GLU  45  -8.633   6.278  -7.384
  315    H    MET  46           H        MET  46  -8.485   7.380  -5.230
  316    HA   MET  46           HA       MET  46  -9.910   6.191  -2.955
  317   1HB   MET  46          2HB       MET  46  -9.517   9.084  -3.735
  318   2HB   MET  46          1HB       MET  46 -10.655   8.566  -2.507
  319   1HG   MET  46          2HG       MET  46  -8.591   9.418  -1.546
  320   2HG   MET  46          1HG       MET  46  -8.847   7.727  -1.136
  321   1HE   MET  46          1HE       MET  46  -6.342   9.363  -4.420
  322   2HE   MET  46          2HE       MET  46  -5.675   9.991  -2.917
  323   3HE   MET  46          3HE       MET  46  -7.375  10.251  -3.304
  324    H    ASP  47           H        ASP  47 -11.920   5.547  -3.361
  325    HA   ASP  47           HA       ASP  47 -13.155   5.458  -5.776
  326   1HB   ASP  47          2HB       ASP  47 -15.265   5.070  -4.594
  327   2HB   ASP  47          1HB       ASP  47 -13.936   4.212  -3.818
  328    H    ASP  48           H        ASP  48 -13.019   8.188  -3.655
  329    HA   ASP  48           HA       ASP  48 -15.183   9.653  -4.700
  330   1HB   ASP  48          2HB       ASP  48 -13.981  11.641  -3.730
  331   2HB   ASP  48          1HB       ASP  48 -14.275  10.323  -2.599
  332    H    GLY  49           H        GLY  49 -12.330   8.736  -6.204
  333   1HA   GLY  49          2HA       GLY  49 -11.998   9.188  -8.517
  334   2HA   GLY  49          1HA       GLY  49 -12.768  10.748  -8.294
  335    H    ARG  50           H        ARG  50 -10.474   9.810  -5.923
  336    HA   ARG  50           HA       ARG  50  -8.566  11.742  -7.065
  337   1HB   ARG  50          2HB       ARG  50  -8.980  10.821  -4.222
  338   2HB   ARG  50          1HB       ARG  50  -7.617  11.808  -4.728
  339   1HG   ARG  50          2HG       ARG  50  -9.153  13.562  -5.453
  340   2HG   ARG  50          1HG       ARG  50 -10.523  12.572  -4.949
  341   1HD   ARG  50          2HD       ARG  50  -8.340  13.660  -3.175
  342   2HD   ARG  50          1HD       ARG  50 -10.010  14.222  -3.246
  343    HE   ARG  50           HE       ARG  50 -10.012  11.487  -2.649
  344   1HH1  ARG  50          1HH1      ARG  50  -9.099  14.524  -1.192
  345   2HH1  ARG  50          2HH1      ARG  50  -9.359  13.969   0.426
  346   1HH2  ARG  50          1HH2      ARG  50 -10.357  10.756  -0.520
  347   2HH2  ARG  50          2HH2      ARG  50 -10.073  11.830   0.809
  348    H    GLU  51           H        GLU  51  -6.278  11.269  -6.956
  349    HA   GLU  51           HA       GLU  51  -5.520   8.517  -6.421
  350   1HB   GLU  51          2HB       GLU  51  -5.236   9.738  -9.168
  351   2HB   GLU  51          1HB       GLU  51  -4.525   8.211  -8.665
  352   1HG   GLU  51          2HG       GLU  51  -6.759   7.300  -8.276
  353   2HG   GLU  51          1HG       GLU  51  -7.468   8.831  -8.786
  354    H    ILE  52           H        ILE  52  -3.502   8.340  -5.705
  355    HA   ILE  52           HA       ILE  52  -1.461  10.290  -6.393
  356    HB   ILE  52           HB       ILE  52  -2.517  11.344  -4.456
  357   1HG1  ILE  52          2HG1      ILE  52   0.170  10.115  -3.799
  358   2HG1  ILE  52          1HG1      ILE  52  -0.091  11.579  -4.745
  359   1HG2  ILE  52          1HG2      ILE  52  -2.282  10.163  -2.222
  360   2HG2  ILE  52          2HG2      ILE  52  -2.016   8.688  -3.152
  361   3HG2  ILE  52          3HG2      ILE  52  -3.537   9.567  -3.309
  362   1HD1  ILE  52          1HD1      ILE  52  -0.799  11.210  -1.832
  363   2HD1  ILE  52          2HD1      ILE  52  -1.054  12.676  -2.779
  364   3HD1  ILE  52          3HD1      ILE  52   0.586  12.109  -2.459
  365    H    THR  53           H        THR  53   0.691   9.547  -5.891
  366    HA   THR  53           HA       THR  53   0.794   6.636  -5.516
  367    HB   THR  53           HB       THR  53   1.711   7.526  -7.612
  368    HG1  THR  53           1HG      THR  53   2.748   5.712  -7.064
  369   1HG2  THR  53          1HG2      THR  53   2.662   9.624  -6.215
  370   2HG2  THR  53          2HG2      THR  53   3.239   9.142  -7.809
  371   3HG2  THR  53          3HG2      THR  53   4.115   8.637  -6.364
  372    H    VAL  54           H        VAL  54   2.458   5.673  -4.235
  373    HA   VAL  54           HA       VAL  54   3.984   7.361  -2.437
  374    HB   VAL  54           HB       VAL  54   1.981   5.393  -1.319
  375   1HG1  VAL  54          1HG1      VAL  54   3.921   7.251   0.060
  376   2HG1  VAL  54          2HG1      VAL  54   4.019   5.491   0.004
  377   3HG1  VAL  54          3HG1      VAL  54   2.694   6.275   0.867
  378   1HG2  VAL  54          1HG2      VAL  54   0.833   7.365  -2.098
  379   2HG2  VAL  54          2HG2      VAL  54   2.008   8.411  -1.299
  380   3HG2  VAL  54          3HG2      VAL  54   0.918   7.412  -0.336
  381    HA   PRO  55           HA       PRO  55   6.693   3.862  -3.083
  382   1HB   PRO  55          2HB       PRO  55   8.432   4.949  -1.013
  383   2HB   PRO  55          1HB       PRO  55   8.702   4.852  -2.754
  384   1HG   PRO  55          2HG       PRO  55   8.299   7.197  -1.454
  385   2HG   PRO  55          1HG       PRO  55   7.816   6.932  -3.140
  386   1HD   PRO  55          2HD       PRO  55   6.143   6.874  -0.655
  387   2HD   PRO  55          1HD       PRO  55   5.777   7.575  -2.246
  388    H    LYS  56           H        LYS  56   6.256   1.900  -2.278
  389    HA   LYS  56           HA       LYS  56   5.839   1.604   0.613
  390   1HB   LYS  56          2HB       LYS  56   4.831  -0.560   0.087
  391   2HB   LYS  56          1HB       LYS  56   4.055   0.741  -0.800
  392   1HG   LYS  56          2HG       LYS  56   5.194   0.130  -2.815
  393   2HG   LYS  56          1HG       LYS  56   6.180  -1.050  -1.954
  394   1HD   LYS  56          2HD       LYS  56   3.176  -1.188  -2.217
  395   2HD   LYS  56          1HD       LYS  56   4.315  -2.069  -3.236
  396   1HE   LYS  56          2HE       LYS  56   5.195  -3.211  -1.261
  397   2HE   LYS  56          1HE       LYS  56   4.064  -2.326  -0.241
  398   1HZ   LYS  56          1HZ       LYS  56   2.825  -4.162  -0.554
  399   2HZ   LYS  56          2HZ       LYS  56   3.595  -4.590  -1.998
  400   3HZ   LYS  56          3HZ       LYS  56   2.392  -3.401  -2.002
  401    H    GLY  57           H        GLY  57   8.361   1.293  -1.511
  402   1HA   GLY  57          2HA       GLY  57   9.509  -1.166  -1.103
  403   2HA   GLY  57          1HA       GLY  57  10.434   0.318  -1.265
  404    H    ILE  58           H        ILE  58   9.055   1.299   1.269
  405    HA   ILE  58           HA       ILE  58  10.174  -0.440   3.276
  406    HB   ILE  58           HB       ILE  58  11.037   2.448   3.142
  407   1HG1  ILE  58          2HG1      ILE  58  13.353   1.368   2.798
  408   2HG1  ILE  58          1HG1      ILE  58  12.466  -0.078   2.324
  409   1HG2  ILE  58          1HG2      ILE  58  10.773   1.103   5.368
  410   2HG2  ILE  58          2HG2      ILE  58  12.180   2.131   5.104
  411   3HG2  ILE  58          3HG2      ILE  58  12.306   0.386   4.878
  412   1HD1  ILE  58          1HD1      ILE  58  13.109   2.231   0.785
  413   2HD1  ILE  58          2HD1      ILE  58  11.356   2.056   0.873
  414   3HD1  ILE  58          3HD1      ILE  58  12.347   0.726   0.274
  415    H    ALA  59           H        ALA  59   7.586  -0.266   3.111
  416    HA   ALA  59           HA       ALA  59   6.855   1.521   5.293
  417   1HB   ALA  59          1HB       ALA  59   5.157   2.651   4.205
  418   2HB   ALA  59          2HB       ALA  59   5.058   1.459   2.910
  419   3HB   ALA  59          3HB       ALA  59   6.425   2.573   2.980
  420    H    VAL  60           H        VAL  60   5.341   0.762   6.671
  421    HA   VAL  60           HA       VAL  60   4.463  -1.969   6.330
  422    HB   VAL  60           HB       VAL  60   5.164  -1.216   8.544
  423   1HG1  VAL  60          1HG1      VAL  60   2.834   0.685   8.343
  424   2HG1  VAL  60          2HG1      VAL  60   4.544   1.106   8.442
  425   3HG1  VAL  60          3HG1      VAL  60   3.739   0.357   9.820
  426   1HG2  VAL  60          1HG2      VAL  60   3.326  -2.102   9.834
  427   2HG2  VAL  60          2HG2      VAL  60   3.471  -3.006   8.326
  428   3HG2  VAL  60          3HG2      VAL  60   2.204  -1.793   8.509
  429    H    PHE  61           H        PHE  61   2.412  -2.665   5.874
  430    HA   PHE  61           HA       PHE  61   0.542  -0.597   4.975
  431   1HB   PHE  61          2HB       PHE  61   0.963  -3.467   4.223
  432   2HB   PHE  61          1HB       PHE  61  -0.565  -2.671   3.865
  433    HD1  PHE  61           1HD      PHE  61   2.784  -1.088   3.748
  434    HD2  PHE  61           2HD      PHE  61  -0.479  -2.676   1.525
  435    HE1  PHE  61           1HE      PHE  61   3.742  -0.158   1.682
  436    HE2  PHE  61           2HE      PHE  61   0.472  -1.749  -0.543
  437    HZ   PHE  61           HZ       PHE  61   2.583  -0.489  -0.465
  438    H    HIS  62           H        HIS  62  -1.440  -0.350   5.748
  439    HA   HIS  62           HA       HIS  62  -2.632  -2.358   7.502
  440   1HB   HIS  62          2HB       HIS  62  -2.271   0.543   8.302
  441   2HB   HIS  62          1HB       HIS  62  -3.220  -0.643   9.190
  442    HD1  HIS  62           1HD      HIS  62  -1.561  -2.930   9.713
  443    HD2  HIS  62           2HD      HIS  62   0.134   0.855   9.462
  444    HE1  HIS  62           1HE      HIS  62   0.632  -3.093  10.933
  445    HE2  HIS  62           2HE      HIS  62   1.673  -0.808  10.709
  446    H    PHE  63           H        PHE  63  -4.270  -2.760   6.066
  447    HA   PHE  63           HA       PHE  63  -5.760  -0.498   4.979
  448   1HB   PHE  63          2HB       PHE  63  -5.776  -3.436   4.307
  449   2HB   PHE  63          1HB       PHE  63  -6.872  -2.269   3.579
  450    HD1  PHE  63           1HD      PHE  63  -3.240  -1.966   4.366
  451    HD2  PHE  63           2HD      PHE  63  -6.251  -2.136   1.367
  452    HE1  PHE  63           1HE      PHE  63  -1.561  -1.441   2.660
  453    HE2  PHE  63           2HE      PHE  63  -4.571  -1.613  -0.351
  454    HZ   PHE  63           HZ       PHE  63  -2.220  -1.266   0.293
  455    H    ARG  64           H        ARG  64  -8.085  -0.569   4.897
  456    HA   ARG  64           HA       ARG  64  -9.382  -2.084   7.041
  457   1HB   ARG  64          2HB       ARG  64  -9.534   0.916   6.677
  458   2HB   ARG  64          1HB       ARG  64 -10.615  -0.004   7.712
  459   1HG   ARG  64          2HG       ARG  64  -7.626   0.025   8.046
  460   2HG   ARG  64          1HG       ARG  64  -8.719   1.133   8.880
  461   1HD   ARG  64          2HD       ARG  64  -8.779  -1.879   9.055
  462   2HD   ARG  64          1HD       ARG  64  -8.138  -0.787  10.282
  463    HE   ARG  64           HE       ARG  64 -10.800  -0.083   9.720
  464   1HH1  ARG  64          1HH1      ARG  64  -8.963  -2.621  11.253
  465   2HH1  ARG  64          2HH1      ARG  64 -10.236  -3.059  12.341
  466   1HH2  ARG  64          1HH2      ARG  64 -12.476  -0.654  11.150
  467   2HH2  ARG  64          2HH2      ARG  64 -12.233  -1.941  12.283
  468    H    THR  65           H        THR  65 -11.389  -2.792   6.502
  469    HA   THR  65           HA       THR  65 -12.482  -1.855   3.933
  470    HB   THR  65           HB       THR  65 -12.829  -4.540   5.275
  471    HG1  THR  65           1HG      THR  65 -11.349  -3.759   2.987
  472   1HG2  THR  65          1HG2      THR  65 -13.597  -5.056   2.816
  473   2HG2  THR  65          2HG2      THR  65 -14.059  -3.354   2.852
  474   3HG2  THR  65          3HG2      THR  65 -14.733  -4.476   4.035
  475    HA   PRO  66           HA       PRO  66 -15.840   0.020   6.192
  476   1HB   PRO  66          2HB       PRO  66 -17.298  -0.748   3.698
  477   2HB   PRO  66          1HB       PRO  66 -17.275   0.797   4.557
  478   1HG   PRO  66          2HG       PRO  66 -15.866   0.472   2.325
  479   2HG   PRO  66          1HG       PRO  66 -15.211   1.402   3.687
  480   1HD   PRO  66          2HD       PRO  66 -14.510  -1.335   2.750
  481   2HD   PRO  66          1HD       PRO  66 -13.485  -0.104   3.512
  482    H    GLN  67           H        GLN  67 -16.073  -3.106   4.601
  483    HA   GLN  67           HA       GLN  67 -18.524  -3.938   5.704
  484   1HB   GLN  67          2HB       GLN  67 -16.151  -5.608   4.856
  485   2HB   GLN  67          1HB       GLN  67 -17.771  -6.221   5.154
  486   1HG   GLN  67          2HG       GLN  67 -16.999  -4.246   3.018
  487   2HG   GLN  67          1HG       GLN  67 -17.326  -5.960   2.775
  488   1HE2  GLN  67          1HE2      GLN  67 -19.257  -6.368   2.006
  489   2HE2  GLN  67          2HE2      GLN  67 -20.689  -5.440   2.278
  490    H    GLY  68           H        GLY  68 -15.490  -3.441   7.162
  491   1HA   GLY  68          2HA       GLY  68 -15.309  -3.443   9.550
  492   2HA   GLY  68          1HA       GLY  68 -16.457  -4.774   9.597
  493    H    GLU  69           H        GLU  69 -13.590  -4.437   7.548
  494    HA   GLU  69           HA       GLU  69 -12.398  -6.719   8.986
  495   1HB   GLU  69          2HB       GLU  69 -12.356  -6.256   5.998
  496   2HB   GLU  69          1HB       GLU  69 -11.544  -7.565   6.843
  497   1HG   GLU  69          2HG       GLU  69 -14.517  -7.116   6.724
  498   2HG   GLU  69          1HG       GLU  69 -13.608  -8.320   5.811
  499    H    LEU  70           H        LEU  70 -10.110  -6.829   9.001
  500    HA   LEU  70           HA       LEU  70  -8.752  -4.314   8.285
  501   1HB   LEU  70          2HB       LEU  70  -9.208  -4.532  10.739
  502   2HB   LEU  70          1HB       LEU  70  -8.216  -5.976  10.750
  503    HG   LEU  70           HG       LEU  70  -7.224  -3.212  10.030
  504   1HD1  LEU  70          1HD1      LEU  70  -6.438  -2.958  12.176
  505   2HD1  LEU  70          2HD1      LEU  70  -6.428  -4.692  12.496
  506   3HD1  LEU  70          3HD1      LEU  70  -7.954  -3.807  12.477
  507   1HD2  LEU  70          1HD2      LEU  70  -5.014  -4.565  10.620
  508   2HD2  LEU  70          2HD2      LEU  70  -5.687  -4.544   8.990
  509   3HD2  LEU  70          3HD2      LEU  70  -5.994  -5.918  10.053
  510    H    VAL  71           H        VAL  71  -7.031  -4.585   7.009
  511    HA   VAL  71           HA       VAL  71  -5.800  -7.267   6.904
  512    HB   VAL  71           HB       VAL  71  -5.985  -5.262   4.650
  513   1HG1  VAL  71          1HG1      VAL  71  -5.342  -7.561   3.451
  514   2HG1  VAL  71          2HG1      VAL  71  -4.552  -7.826   5.005
  515   3HG1  VAL  71          3HG1      VAL  71  -4.135  -6.415   4.031
  516   1HG2  VAL  71          1HG2      VAL  71  -7.658  -7.605   5.411
  517   2HG2  VAL  71          2HG2      VAL  71  -7.386  -7.274   3.699
  518   3HG2  VAL  71          3HG2      VAL  71  -8.136  -6.051   4.726
  519    H    GLU  72           H        GLU  72  -3.653  -7.403   7.242
  520    HA   GLU  72           HA       GLU  72  -2.127  -4.885   7.312
  521   1HB   GLU  72          2HB       GLU  72  -0.866  -5.771   9.225
  522   2HB   GLU  72          1HB       GLU  72  -2.578  -5.618   9.587
  523   1HG   GLU  72          2HG       GLU  72  -2.874  -8.012   9.221
  524   2HG   GLU  72          1HG       GLU  72  -1.156  -8.166   8.852
  525    H    ILE  73           H        ILE  73  -0.148  -4.870   6.416
  526    HA   ILE  73           HA       ILE  73   1.149  -7.368   5.660
  527    HB   ILE  73           HB       ILE  73   0.509  -5.223   3.623
  528   1HG1  ILE  73          2HG1      ILE  73  -0.465  -8.080   3.860
  529   2HG1  ILE  73          1HG1      ILE  73  -1.430  -6.634   4.152
  530   1HG2  ILE  73          1HG2      ILE  73   2.095  -7.776   3.410
  531   2HG2  ILE  73          2HG2      ILE  73   2.676  -6.128   3.171
  532   3HG2  ILE  73          3HG2      ILE  73   1.541  -6.838   2.023
  533   1HD1  ILE  73          1HD1      ILE  73  -0.209  -7.436   1.517
  534   2HD1  ILE  73          2HD1      ILE  73  -1.177  -5.990   1.809
  535   3HD1  ILE  73          3HD1      ILE  73  -1.908  -7.588   1.968
  536    H    ASP  74           H        ASP  74   3.415  -7.030   5.045
  537    HA   ASP  74           HA       ASP  74   4.458  -4.578   6.288
  538   1HB   ASP  74          2HB       ASP  74   5.824  -7.242   5.862
  539   2HB   ASP  74          1HB       ASP  74   6.536  -5.843   6.660
  540    H    GLY  75           H        GLY  75   4.655  -3.133   4.664
  541   1HA   GLY  75          2HA       GLY  75   5.782  -3.891   2.100
  542   2HA   GLY  75          1HA       GLY  75   5.219  -2.293   2.560
  543    H    ARG  76           H        ARG  76   6.994  -2.936   5.104
  544    HA   ARG  76           HA       ARG  76   9.146  -1.331   4.287
  545   1HB   ARG  76          2HB       ARG  76   8.372  -1.285   6.571
  546   2HB   ARG  76          1HB       ARG  76   8.751  -2.989   6.768
  547   1HG   ARG  76          2HG       ARG  76  10.904  -1.023   6.097
  548   2HG   ARG  76          1HG       ARG  76  10.340  -1.214   7.757
  549   1HD   ARG  76          2HD       ARG  76  10.808  -3.669   7.537
  550   2HD   ARG  76          1HD       ARG  76  11.562  -3.325   5.983
  551    HE   ARG  76           HE       ARG  76  12.722  -2.964   8.538
  552   1HH1  ARG  76          1HH1      ARG  76  12.608  -1.570   5.340
  553   2HH1  ARG  76          2HH1      ARG  76  14.148  -0.794   5.487
  554   1HH2  ARG  76          1HH2      ARG  76  14.751  -1.950   8.729
  555   2HH2  ARG  76          2HH2      ARG  76  15.366  -1.011   7.410
  556    H    ALA  77           H        ALA  77   9.164  -4.705   5.338
  557    HA   ALA  77           HA       ALA  77  11.749  -5.036   4.062
  558   1HB   ALA  77          1HB       ALA  77  12.297  -6.553   5.628
  559   2HB   ALA  77          2HB       ALA  77  10.672  -7.232   5.688
  560   3HB   ALA  77          3HB       ALA  77  11.028  -5.724   6.530
  561    H    LEU  78           H        LEU  78   8.501  -6.294   3.876
  562    HA   LEU  78           HA       LEU  78   9.033  -8.611   2.396
  563   1HB   LEU  78          2HB       LEU  78   6.854  -8.025   3.476
  564   2HB   LEU  78          1HB       LEU  78   6.567  -6.909   2.154
  565    HG   LEU  78           HG       LEU  78   6.632  -8.785   0.557
  566   1HD1  LEU  78          1HD1      LEU  78   6.265 -10.905   2.479
  567   2HD1  LEU  78          2HD1      LEU  78   7.852 -10.159   2.650
  568   3HD1  LEU  78          3HD1      LEU  78   7.350 -10.817   1.093
  569   1HD2  LEU  78          1HD2      LEU  78   4.503  -9.880   1.356
  570   2HD2  LEU  78          2HD2      LEU  78   4.477  -8.117   1.275
  571   3HD2  LEU  78          3HD2      LEU  78   4.666  -8.925   2.831
  572    H    VAL  79           H        VAL  79   9.363  -5.368   1.414
  573    HA   VAL  79           HA       VAL  79   8.592  -5.326  -1.218
  574    HB   VAL  79           HB       VAL  79   9.559  -3.382  -0.077
  575   1HG1  VAL  79          1HG1      VAL  79  11.776  -3.159   0.520
  576   2HG1  VAL  79          2HG1      VAL  79  12.313  -4.413  -0.597
  577   3HG1  VAL  79          3HG1      VAL  79  11.472  -4.858   0.887
  578   1HG2  VAL  79          1HG2      VAL  79   9.577  -2.787  -2.248
  579   2HG2  VAL  79          2HG2      VAL  79  10.380  -4.273  -2.756
  580   3HG2  VAL  79          3HG2      VAL  79  11.326  -2.942  -2.087
  581    H    ALA  80           H        ALA  80   8.836  -7.086  -2.479
  582    HA   ALA  80           HA       ALA  80  11.547  -8.187  -2.808
  583   1HB   ALA  80          1HB       ALA  80  10.661 -10.258  -3.198
  584   2HB   ALA  80          2HB       ALA  80   9.155  -9.613  -3.855
  585   3HB   ALA  80          3HB       ALA  80   9.434  -9.603  -2.114
  586    H    ARG  81           H        ARG  81  12.578  -7.884  -4.676
  587    HA   ARG  81           HA       ARG  81  11.046  -6.789  -6.932
  588   1HB   ARG  81          2HB       ARG  81  13.995  -6.589  -6.292
  589   2HB   ARG  81          1HB       ARG  81  13.243  -5.946  -7.747
  590   1HG   ARG  81          2HG       ARG  81  11.832  -4.493  -6.336
  591   2HG   ARG  81          1HG       ARG  81  12.687  -5.093  -4.913
  592   1HD   ARG  81          2HD       ARG  81  14.791  -4.232  -5.814
  593   2HD   ARG  81          1HD       ARG  81  13.944  -3.644  -7.242
  594    HE   ARG  81           HE       ARG  81  12.727  -2.546  -4.976
  595   1HH1  ARG  81          1HH1      ARG  81  15.753  -2.368  -6.705
  596   2HH1  ARG  81          2HH1      ARG  81  16.074  -0.735  -6.227
  597   1HH2  ARG  81          1HH2      ARG  81  13.149  -0.397  -4.346
  598   2HH2  ARG  81          2HH2      ARG  81  14.597   0.383  -4.888
  599    HA   PRO  82           HA       PRO  82  11.632 -10.287  -9.521
  600   1HB   PRO  82          2HB       PRO  82  12.587  -9.081 -11.834
  601   2HB   PRO  82          1HB       PRO  82  10.886  -9.232 -11.390
  602   1HG   PRO  82          2HG       PRO  82  12.734  -6.910 -11.060
  603   2HG   PRO  82          1HG       PRO  82  11.021  -6.926 -11.520
  604   1HD   PRO  82          2HD       PRO  82  11.788  -6.253  -9.046
  605   2HD   PRO  82          1HD       PRO  82  10.308  -7.194  -9.325
  606    H    GLU  83           H        GLU  83  13.441 -10.786 -11.508
  607    HA   GLU  83           HA       GLU  83  15.670 -11.728 -10.145
  608   1HB   GLU  83          2HB       GLU  83  15.401 -11.143 -13.097
  609   2HB   GLU  83          1HB       GLU  83  16.642 -12.155 -12.370
  610   1HG   GLU  83          2HG       GLU  83  14.924 -13.702 -11.586
  611   2HG   GLU  83          1HG       GLU  83  13.679 -12.686 -12.312
  612    H    GLU  84           H        GLU  84  15.038  -8.571 -11.305
  613    HA   GLU  84           HA       GLU  84  17.581  -7.607 -11.879
  614   1HB   GLU  84          2HB       GLU  84  15.295  -6.137 -10.555
  615   2HB   GLU  84          1HB       GLU  84  16.683  -5.385 -11.331
  616   1HG   GLU  84          2HG       GLU  84  14.615  -7.095 -12.693
  617   2HG   GLU  84          1HG       GLU  84  14.718  -5.337 -12.762
  618    H    ARG  85           H        ARG  85  16.308  -8.650  -8.882
  619    HA   ARG  85           HA       ARG  85  17.300  -8.895  -6.845
  620   1HB   ARG  85          2HB       ARG  85  19.649  -7.379  -7.999
  621   2HB   ARG  85          1HB       ARG  85  19.630  -8.283  -6.494
  622   1HG   ARG  85          2HG       ARG  85  19.277 -10.355  -7.720
  623   2HG   ARG  85          1HG       ARG  85  19.258  -9.459  -9.241
  624   1HD   ARG  85          2HD       ARG  85  21.574  -9.638  -7.316
  625   2HD   ARG  85          1HD       ARG  85  21.433 -10.502  -8.846
  626    HE   ARG  85           HE       ARG  85  21.160  -7.765  -9.352
  627   1HH1  ARG  85          1HH1      ARG  85  23.593 -10.030  -8.291
  628   2HH1  ARG  85          2HH1      ARG  85  24.910  -9.106  -8.932
  629   1HH2  ARG  85          1HH2      ARG  85  22.890  -6.552 -10.197
  630   2HH2  ARG  85          2HH2      ARG  85  24.511  -7.132 -10.014
  631    H    ILE  86           H        ILE  86  17.574  -7.684  -4.909
  632    HA   ILE  86           HA       ILE  86  16.394  -5.031  -5.108
  633    HB   ILE  86           HB       ILE  86  16.963  -6.730  -2.673
  634   1HG1  ILE  86          2HG1      ILE  86  14.470  -6.977  -2.633
  635   2HG1  ILE  86          1HG1      ILE  86  14.408  -6.184  -4.202
  636   1HG2  ILE  86          1HG2      ILE  86  15.059  -4.927  -1.930
  637   2HG2  ILE  86          2HG2      ILE  86  16.081  -3.956  -2.989
  638   3HG2  ILE  86          3HG2      ILE  86  16.782  -4.774  -1.593
  639   1HD1  ILE  86          1HD1      ILE  86  16.122  -8.592  -3.879
  640   2HD1  ILE  86          2HD1      ILE  86  15.264  -7.994  -5.301
  641   3HD1  ILE  86          3HD1      ILE  86  14.373  -8.788  -4.002
  Start of MODEL    6
    1    H    ARG   9           H        ARG   9 -12.502  -0.463  -7.640
    2    HA   ARG   9           HA       ARG   9 -13.566   1.992  -8.711
    3   1HB   ARG   9          2HB       ARG   9 -14.259   2.470  -6.435
    4   2HB   ARG   9          1HB       ARG   9 -14.676   0.815  -6.851
    5   1HG   ARG   9          2HG       ARG   9 -12.732   0.008  -5.615
    6   2HG   ARG   9          1HG       ARG   9 -12.305   1.670  -5.204
    7   1HD   ARG   9          2HD       ARG   9 -14.474   1.911  -4.053
    8   2HD   ARG   9          1HD       ARG   9 -14.830   0.222  -4.414
    9    HE   ARG   9           HE       ARG   9 -12.375   0.347  -3.075
   10   1HH1  ARG   9          1HH1      ARG   9 -15.767   0.898  -2.465
   11   2HH1  ARG   9          2HH1      ARG   9 -15.654   0.519  -0.780
   12   1HH2  ARG   9          1HH2      ARG   9 -12.224  -0.148  -0.854
   13   2HH2  ARG   9          2HH2      ARG   9 -13.644  -0.075   0.135
   14    H    HIS  10           H        HIS  10 -12.987   3.871  -6.820
   15    HA   HIS  10           HA       HIS  10 -10.348   4.669  -7.611
   16   1HB   HIS  10          2HB       HIS  10 -12.343   5.969  -5.755
   17   2HB   HIS  10          1HB       HIS  10 -10.852   6.722  -6.314
   18    HD1  HIS  10           1HD      HIS  10 -10.789   6.553  -9.188
   19    HD2  HIS  10           2HD      HIS  10 -14.423   6.873  -7.197
   20    HE1  HIS  10           1HE      HIS  10 -12.414   7.430 -10.894
   21    HE2  HIS  10           2HE      HIS  10 -14.583   7.707  -9.641
   22    H    GLU  11           H        GLU  11 -11.896   4.008  -4.459
   23    HA   GLU  11           HA       GLU  11  -9.745   4.433  -2.801
   24   1HB   GLU  11          2HB       GLU  11 -11.788   2.224  -2.510
   25   2HB   GLU  11          1HB       GLU  11 -10.805   2.898  -1.219
   26   1HG   GLU  11          2HG       GLU  11 -11.911   5.062  -1.516
   27   2HG   GLU  11          1HG       GLU  11 -12.908   4.369  -2.793
   28    H    LEU  12           H        LEU  12  -8.650   2.433  -1.495
   29    HA   LEU  12           HA       LEU  12  -6.818   1.253  -3.223
   30   1HB   LEU  12          2HB       LEU  12  -5.988   1.106  -1.091
   31   2HB   LEU  12          1HB       LEU  12  -7.552   0.834  -0.385
   32    HG   LEU  12           HG       LEU  12  -7.434  -1.539  -1.064
   33   1HD1  LEU  12          1HD1      LEU  12  -5.824  -1.076  -2.995
   34   2HD1  LEU  12          2HD1      LEU  12  -5.550  -2.525  -2.039
   35   3HD1  LEU  12          3HD1      LEU  12  -4.557  -1.094  -1.776
   36   1HD2  LEU  12          1HD2      LEU  12  -6.250  -2.137   0.773
   37   2HD2  LEU  12          2HD2      LEU  12  -6.333  -0.402   1.076
   38   3HD2  LEU  12          3HD2      LEU  12  -4.884  -1.106   0.359
   39    H    ILE  13           H        ILE  13  -6.751  -0.602  -4.395
   40    HA   ILE  13           HA       ILE  13  -8.817  -1.416  -5.706
   41    HB   ILE  13           HB       ILE  13  -6.529  -2.385  -5.931
   42   1HG1  ILE  13          2HG1      ILE  13  -8.593  -4.580  -5.937
   43   2HG1  ILE  13          1HG1      ILE  13  -8.626  -3.262  -7.106
   44   1HG2  ILE  13          1HG2      ILE  13  -6.824  -3.218  -3.378
   45   2HG2  ILE  13          2HG2      ILE  13  -5.643  -3.878  -4.511
   46   3HG2  ILE  13          3HG2      ILE  13  -7.178  -4.706  -4.255
   47   1HD1  ILE  13          1HD1      ILE  13  -6.285  -3.895  -7.739
   48   2HD1  ILE  13          2HD1      ILE  13  -7.526  -5.089  -8.131
   49   3HD1  ILE  13          3HD1      ILE  13  -6.480  -5.331  -6.730
   50    H    GLY  14           H        GLY  14 -10.804  -1.410  -4.760
   51   1HA   GLY  14          2HA       GLY  14 -12.615  -2.163  -3.580
   52   2HA   GLY  14          1HA       GLY  14 -11.767  -3.688  -3.411
   53    H    LEU  15           H        LEU  15  -9.514  -1.977  -2.001
   54    HA   LEU  15           HA       LEU  15 -10.821  -1.935   0.630
   55   1HB   LEU  15          2HB       LEU  15  -8.035  -2.196   0.972
   56   2HB   LEU  15          1HB       LEU  15  -9.290  -3.347   1.362
   57    HG   LEU  15           HG       LEU  15  -8.055  -3.189  -1.379
   58   1HD1  LEU  15          1HD1      LEU  15  -6.998  -4.345   1.097
   59   2HD1  LEU  15          2HD1      LEU  15  -6.173  -3.880  -0.391
   60   3HD1  LEU  15          3HD1      LEU  15  -7.012  -5.429  -0.294
   61   1HD2  LEU  15          1HD2      LEU  15  -9.122  -5.191  -1.813
   62   2HD2  LEU  15          2HD2      LEU  15 -10.321  -4.327  -0.852
   63   3HD2  LEU  15          3HD2      LEU  15  -9.323  -5.572  -0.103
   64    H    SER  16           H        SER  16  -9.470  -0.609   2.261
   65    HA   SER  16           HA       SER  16  -8.572   1.924   0.999
   66   1HB   SER  16          2HB       SER  16 -10.010   1.581   3.673
   67   2HB   SER  16          1HB       SER  16  -9.410   3.107   3.021
   68    HG   SER  16           HG       SER  16 -11.397   1.454   1.841
   69    H    VAL  17           H        VAL  17  -6.798   3.053   2.397
   70    HA   VAL  17           HA       VAL  17  -5.331   0.970   3.896
   71    HB   VAL  17           HB       VAL  17  -4.049   3.105   2.204
   72   1HG1  VAL  17          1HG1      VAL  17  -2.588   2.360   3.933
   73   2HG1  VAL  17          2HG1      VAL  17  -2.064   1.613   2.425
   74   3HG1  VAL  17          3HG1      VAL  17  -2.972   0.672   3.609
   75   1HG2  VAL  17          1HG2      VAL  17  -4.233   0.206   1.482
   76   2HG2  VAL  17          2HG2      VAL  17  -3.759   1.565   0.467
   77   3HG2  VAL  17          3HG2      VAL  17  -5.443   1.373   0.953
   78    H    ARG  18           H        ARG  18  -3.797   1.650   5.437
   79    HA   ARG  18           HA       ARG  18  -3.976   4.381   6.450
   80   1HB   ARG  18          2HB       ARG  18  -4.527   1.938   8.149
   81   2HB   ARG  18          1HB       ARG  18  -4.332   3.572   8.765
   82   1HG   ARG  18          2HG       ARG  18  -6.302   4.279   7.490
   83   2HG   ARG  18          1HG       ARG  18  -6.505   2.627   6.905
   84   1HD   ARG  18          2HD       ARG  18  -6.805   1.847   9.201
   85   2HD   ARG  18          1HD       ARG  18  -6.585   3.493   9.794
   86    HE   ARG  18           HE       ARG  18  -8.674   3.490   7.930
   87   1HH1  ARG  18          1HH1      ARG  18  -7.965   2.275  11.123
   88   2HH1  ARG  18          2HH1      ARG  18  -9.616   2.316  11.642
   89   1HH2  ARG  18          1HH2      ARG  18 -10.846   3.547   8.609
   90   2HH2  ARG  18          2HH2      ARG  18 -11.253   3.038  10.215
   91    H    ILE  19           H        ILE  19  -1.859   4.840   6.090
   92    HA   ILE  19           HA       ILE  19   0.259   2.991   6.483
   93    HB   ILE  19           HB       ILE  19   0.240   5.967   6.020
   94   1HG1  ILE  19          2HG1      ILE  19   1.116   5.366   3.824
   95   2HG1  ILE  19          1HG1      ILE  19   1.167   3.666   4.284
   96   1HG2  ILE  19          1HG2      ILE  19   2.624   4.154   6.347
   97   2HG2  ILE  19          2HG2      ILE  19   2.207   5.563   7.323
   98   3HG2  ILE  19          3HG2      ILE  19   2.695   5.768   5.641
   99   1HD1  ILE  19          1HD1      ILE  19  -1.378   5.275   4.174
  100   2HD1  ILE  19          2HD1      ILE  19  -1.211   3.530   4.334
  101   3HD1  ILE  19          3HD1      ILE  19  -0.765   4.320   2.823
  102    H    ALA  20           H        ALA  20   1.739   2.774   8.070
  103    HA   ALA  20           HA       ALA  20   1.222   4.217  10.578
  104   1HB   ALA  20          1HB       ALA  20   0.977   1.561  10.261
  105   2HB   ALA  20          2HB       ALA  20   1.457   2.316  11.781
  106   3HB   ALA  20          3HB       ALA  20   2.683   1.658  10.698
  107    H    ARG  21           H        ARG  21   3.635   2.986   8.385
  108    HA   ARG  21           HA       ARG  21   5.504   5.001   9.203
  109   1HB   ARG  21          2HB       ARG  21   6.310   2.099   9.430
  110   2HB   ARG  21          1HB       ARG  21   7.345   3.489   9.705
  111   1HG   ARG  21          2HG       ARG  21   5.983   4.132  11.627
  112   2HG   ARG  21          1HG       ARG  21   4.939   2.735  11.351
  113   1HD   ARG  21          2HD       ARG  21   6.861   1.246  11.689
  114   2HD   ARG  21          1HD       ARG  21   7.886   2.648  11.992
  115    HE   ARG  21           HE       ARG  21   5.724   2.749  13.760
  116   1HH1  ARG  21          1HH1      ARG  21   8.534   0.774  13.136
  117   2HH1  ARG  21          2HH1      ARG  21   8.706   0.276  14.786
  118   1HH2  ARG  21          1HH2      ARG  21   5.948   2.094  15.931
  119   2HH2  ARG  21          2HH2      ARG  21   7.238   1.025  16.372
  120    H    SER  22           H        SER  22   6.737   5.645   7.506
  121    HA   SER  22           HA       SER  22   6.994   3.852   5.206
  122   1HB   SER  22          2HB       SER  22   6.012   6.710   5.031
  123   2HB   SER  22          1HB       SER  22   6.372   5.665   3.657
  124    HG   SER  22           HG       SER  22   4.754   4.202   4.709
  125    H    VAL  23           H        VAL  23   8.578   4.663   3.597
  126    HA   VAL  23           HA       VAL  23  10.964   5.518   4.946
  127    HB   VAL  23           HB       VAL  23  11.065   3.819   3.181
  128   1HG1  VAL  23          1HG1      VAL  23  10.725   4.376   0.851
  129   2HG1  VAL  23          2HG1      VAL  23  10.350   6.046   1.272
  130   3HG1  VAL  23          3HG1      VAL  23   9.262   4.748   1.763
  131   1HG2  VAL  23          1HG2      VAL  23  12.540   6.347   2.437
  132   2HG2  VAL  23          2HG2      VAL  23  12.988   4.707   1.972
  133   3HG2  VAL  23          3HG2      VAL  23  13.045   5.189   3.668
  134    H    HIS  24           H        HIS  24   8.817   6.888   2.478
  135    HA   HIS  24           HA       HIS  24  10.337   9.363   2.441
  136   1HB   HIS  24          2HB       HIS  24   9.390   8.361   0.351
  137   2HB   HIS  24          1HB       HIS  24   7.780   8.690   0.974
  138    HD1  HIS  24           1HD      HIS  24  10.897  10.863   0.677
  139    HD2  HIS  24           2HD      HIS  24   6.863  10.867  -0.316
  140    HE1  HIS  24           1HE      HIS  24  10.479  13.082  -0.430
  141    HE2  HIS  24           2HE      HIS  24   8.054  13.022  -1.108
  142    H    ARG  25           H        ARG  25   9.724  11.254   3.358
  143    HA   ARG  25           HA       ARG  25   7.981  11.180   5.559
  144   1HB   ARG  25          2HB       ARG  25   8.434  13.590   5.750
  145   2HB   ARG  25          1HB       ARG  25   9.901  12.648   5.520
  146   1HG   ARG  25          2HG       ARG  25   9.880  13.248   3.131
  147   2HG   ARG  25          1HG       ARG  25   8.455  14.251   3.420
  148   1HD   ARG  25          2HD       ARG  25  11.167  14.609   4.695
  149   2HD   ARG  25          1HD       ARG  25  10.498  15.593   3.394
  150    HE   ARG  25           HE       ARG  25   8.710  15.646   5.543
  151   1HH1  ARG  25          1HH1      ARG  25  11.925  16.747   4.750
  152   2HH1  ARG  25          2HH1      ARG  25  11.860  18.107   5.821
  153   1HH2  ARG  25          1HH2      ARG  25   8.622  17.436   6.952
  154   2HH2  ARG  25          2HH2      ARG  25   9.985  18.497   7.070
  155    H    ASP  26           H        ASP  26   7.567  12.553   2.350
  156    HA   ASP  26           HA       ASP  26   5.197  13.939   2.803
  157   1HB   ASP  26          2HB       ASP  26   6.040  12.566   0.249
  158   2HB   ASP  26          1HB       ASP  26   4.822  13.826   0.385
  159    H    ILE  27           H        ILE  27   5.708  10.558   2.661
  160    HA   ILE  27           HA       ILE  27   2.836  10.091   2.405
  161    HB   ILE  27           HB       ILE  27   3.360   7.776   1.830
  162   1HG1  ILE  27          2HG1      ILE  27   6.241   8.686   2.030
  163   2HG1  ILE  27          1HG1      ILE  27   5.440   7.535   3.093
  164   1HG2  ILE  27          1HG2      ILE  27   4.650   9.949   0.208
  165   2HG2  ILE  27          2HG2      ILE  27   3.094   9.158  -0.043
  166   3HG2  ILE  27          3HG2      ILE  27   4.592   8.276  -0.350
  167   1HD1  ILE  27          1HD1      ILE  27   5.301   6.811   0.272
  168   2HD1  ILE  27          2HD1      ILE  27   5.750   5.841   1.675
  169   3HD1  ILE  27          3HD1      ILE  27   6.942   6.892   0.911
  170    H    GLN  28           H        GLN  28   5.536   9.840   4.500
  171    HA   GLN  28           HA       GLN  28   4.824   7.801   6.220
  172   1HB   GLN  28          2HB       GLN  28   6.962   8.849   6.434
  173   2HB   GLN  28          1HB       GLN  28   6.236  10.420   6.743
  174   1HG   GLN  28          2HG       GLN  28   7.154   9.455   8.772
  175   2HG   GLN  28          1HG       GLN  28   5.404   9.632   8.886
  176   1HE2  GLN  28          1HE2      GLN  28   7.868   7.655   9.617
  177   2HE2  GLN  28          2HE2      GLN  28   7.050   6.134   9.634
  178    H    GLY  29           H        GLY  29   3.394   7.524   7.827
  179   1HA   GLY  29          2HA       GLY  29   1.622   7.897   9.230
  180   2HA   GLY  29          1HA       GLY  29   2.182   9.556   9.340
  181    H    ILE  30           H        ILE  30   1.491   8.559   6.156
  182    HA   ILE  30           HA       ILE  30  -0.989  10.084   6.239
  183    HB   ILE  30           HB       ILE  30   0.747   9.421   3.862
  184   1HG1  ILE  30          2HG1      ILE  30   1.832  10.999   5.380
  185   2HG1  ILE  30          1HG1      ILE  30   1.330  11.814   3.901
  186   1HG2  ILE  30          1HG2      ILE  30  -1.916  10.660   4.141
  187   2HG2  ILE  30          2HG2      ILE  30  -1.210   9.774   2.789
  188   3HG2  ILE  30          3HG2      ILE  30  -0.794  11.468   3.047
  189   1HD1  ILE  30          1HD1      ILE  30   0.879  13.184   5.861
  190   2HD1  ILE  30          2HD1      ILE  30  -0.119  11.900   6.544
  191   3HD1  ILE  30          3HD1      ILE  30  -0.624  12.715   5.065
  192    H    SER  31           H        SER  31  -2.803   8.927   6.255
  193    HA   SER  31           HA       SER  31  -2.806   6.210   5.183
  194   1HB   SER  31          2HB       SER  31  -4.930   7.731   6.721
  195   2HB   SER  31          1HB       SER  31  -5.037   6.038   6.244
  196    HG   SER  31           HG       SER  31  -3.286   7.241   8.105
  197    H    GLY  32           H        GLY  32  -4.806   5.555   3.848
  198   1HA   GLY  32          2HA       GLY  32  -6.465   7.283   2.547
  199   2HA   GLY  32          1HA       GLY  32  -4.953   7.403   1.654
  200    H    ARG  33           H        ARG  33  -6.458   6.603  -0.037
  201    HA   ARG  33           HA       ARG  33  -6.839   3.713   0.121
  202   1HB   ARG  33          2HB       ARG  33  -8.121   5.841  -1.509
  203   2HB   ARG  33          1HB       ARG  33  -8.257   4.156  -1.950
  204   1HG   ARG  33          2HG       ARG  33 -10.197   4.822  -0.699
  205   2HG   ARG  33          1HG       ARG  33  -9.244   3.681   0.249
  206   1HD   ARG  33          2HD       ARG  33  -8.311   5.497   1.550
  207   2HD   ARG  33          1HD       ARG  33  -9.156   6.681   0.554
  208    HE   ARG  33           HE       ARG  33 -11.042   4.923   1.642
  209   1HH1  ARG  33          1HH1      ARG  33  -8.823   7.406   2.685
  210   2HH1  ARG  33          2HH1      ARG  33  -9.785   7.869   4.047
  211   1HH2  ARG  33          1HH2      ARG  33 -12.310   5.531   3.434
  212   2HH2  ARG  33          2HH2      ARG  33 -11.765   6.805   4.474
  213    H    VAL  34           H        VAL  34  -6.709   2.605  -2.038
  214    HA   VAL  34           HA       VAL  34  -4.055   3.209  -3.180
  215    HB   VAL  34           HB       VAL  34  -5.370   0.677  -2.585
  216   1HG1  VAL  34          1HG1      VAL  34  -4.315  -0.608  -4.366
  217   2HG1  VAL  34          2HG1      VAL  34  -3.835   0.891  -5.154
  218   3HG1  VAL  34          3HG1      VAL  34  -5.550   0.483  -4.994
  219   1HG2  VAL  34          1HG2      VAL  34  -3.403   1.289  -1.413
  220   2HG2  VAL  34          2HG2      VAL  34  -2.538   1.589  -2.920
  221   3HG2  VAL  34          3HG2      VAL  34  -2.989  -0.057  -2.474
  222    H    VAL  35           H        VAL  35  -3.605   2.847  -5.415
  223    HA   VAL  35           HA       VAL  35  -5.963   3.230  -7.136
  224    HB   VAL  35           HB       VAL  35  -4.294   5.194  -7.057
  225   1HG1  VAL  35          1HG1      VAL  35  -2.360   4.992  -8.526
  226   2HG1  VAL  35          2HG1      VAL  35  -2.652   3.262  -8.660
  227   3HG1  VAL  35          3HG1      VAL  35  -2.243   3.969  -7.102
  228   1HG2  VAL  35          1HG2      VAL  35  -4.258   4.865  -9.819
  229   2HG2  VAL  35          2HG2      VAL  35  -5.505   5.662  -8.863
  230   3HG2  VAL  35          3HG2      VAL  35  -5.664   3.954  -9.270
  231    H    ASP  36           H        ASP  36  -2.695   1.942  -6.836
  232    HA   ASP  36           HA       ASP  36  -3.445  -0.540  -8.021
  233   1HB   ASP  36          2HB       ASP  36  -1.794  -0.520  -9.843
  234   2HB   ASP  36          1HB       ASP  36  -3.032   0.710 -10.076
  235    H    GLU  37           H        GLU  37  -1.918  -2.192  -7.575
  236    HA   GLU  37           HA       GLU  37   0.219  -1.345  -5.727
  237   1HB   GLU  37          2HB       GLU  37  -1.690  -2.604  -4.707
  238   2HB   GLU  37          1HB       GLU  37  -1.266  -3.976  -5.714
  239   1HG   GLU  37          2HG       GLU  37   0.749  -2.770  -3.866
  240   2HG   GLU  37          1HG       GLU  37  -0.465  -3.894  -3.263
  241    H    THR  38           H        THR  38   2.240  -1.785  -6.303
  242    HA   THR  38           HA       THR  38   2.702  -3.943  -8.255
  243    HB   THR  38           HB       THR  38   4.249  -1.349  -8.056
  244    HG1  THR  38           1HG      THR  38   3.098  -0.657  -9.756
  245   1HG2  THR  38          1HG2      THR  38   5.621  -3.112  -8.961
  246   2HG2  THR  38          2HG2      THR  38   5.158  -1.994 -10.241
  247   3HG2  THR  38          3HG2      THR  38   4.351  -3.555 -10.098
  248    H    ARG  39           H        ARG  39   4.681  -5.092  -8.039
  249    HA   ARG  39           HA       ARG  39   5.404  -5.701  -5.407
  250   1HB   ARG  39          2HB       ARG  39   6.805  -6.298  -8.007
  251   2HB   ARG  39          1HB       ARG  39   7.273  -6.987  -6.458
  252   1HG   ARG  39          2HG       ARG  39   5.087  -8.027  -6.240
  253   2HG   ARG  39          1HG       ARG  39   4.587  -7.315  -7.774
  254   1HD   ARG  39          2HD       ARG  39   6.841  -9.279  -7.382
  255   2HD   ARG  39          1HD       ARG  39   5.252  -9.656  -8.043
  256    HE   ARG  39           HE       ARG  39   7.447  -8.561  -9.453
  257   1HH1  ARG  39          1HH1      ARG  39   3.967  -8.396  -9.232
  258   2HH1  ARG  39          2HH1      ARG  39   3.766  -7.840 -10.858
  259   1HH2  ARG  39          1HH2      ARG  39   7.182  -7.833 -11.593
  260   2HH2  ARG  39          2HH2      ARG  39   5.590  -7.523 -12.200
  261    H    ASN  40           H        ASN  40   6.357  -3.003  -7.193
  262    HA   ASN  40           HA       ASN  40   8.643  -2.655  -5.385
  263   1HB   ASN  40          2HB       ASN  40   9.847  -1.423  -7.131
  264   2HB   ASN  40          1HB       ASN  40   9.530  -3.086  -7.591
  265   1HD2  ASN  40          1HD2      ASN  40   6.639  -1.462  -7.907
  266   2HD2  ASN  40          2HD2      ASN  40   6.758  -1.036  -9.568
  267    H    THR  41           H        THR  41   5.638  -1.474  -6.151
  268    HA   THR  41           HA       THR  41   6.150   0.926  -4.646
  269    HB   THR  41           HB       THR  41   6.791   1.668  -6.891
  270    HG1  THR  41           1HG      THR  41   5.449   3.465  -6.939
  271   1HG2  THR  41          1HG2      THR  41   5.467   0.214  -8.281
  272   2HG2  THR  41          2HG2      THR  41   5.098   1.899  -8.645
  273   3HG2  THR  41          3HG2      THR  41   3.981   0.941  -7.672
  274    H    LEU  42           H        LEU  42   4.173   2.180  -4.238
  275    HA   LEU  42           HA       LEU  42   1.684   0.678  -4.615
  276   1HB   LEU  42          2HB       LEU  42   2.590   0.096  -2.393
  277   2HB   LEU  42          1HB       LEU  42   2.638   1.791  -1.969
  278    HG   LEU  42           HG       LEU  42   0.743   0.604  -0.947
  279   1HD1  LEU  42          1HD1      LEU  42  -0.460   2.459  -2.960
  280   2HD1  LEU  42          2HD1      LEU  42   0.697   3.073  -1.779
  281   3HD1  LEU  42          3HD1      LEU  42  -0.794   2.305  -1.235
  282   1HD2  LEU  42          1HD2      LEU  42  -0.988   0.388  -3.202
  283   2HD2  LEU  42          2HD2      LEU  42  -0.454  -0.878  -2.097
  284   3HD2  LEU  42          3HD2      LEU  42   0.488  -0.514  -3.542
  285    H    ARG  43           H        ARG  43   0.575   2.103  -5.847
  286    HA   ARG  43           HA       ARG  43   0.754   4.938  -5.167
  287   1HB   ARG  43          2HB       ARG  43   1.120   4.183  -7.517
  288   2HB   ARG  43          1HB       ARG  43  -0.552   3.660  -7.573
  289   1HG   ARG  43          2HG       ARG  43  -1.307   5.943  -7.259
  290   2HG   ARG  43          1HG       ARG  43   0.361   6.487  -7.068
  291   1HD   ARG  43          2HD       ARG  43   0.868   5.801  -9.349
  292   2HD   ARG  43          1HD       ARG  43  -0.775   5.198  -9.551
  293    HE   ARG  43           HE       ARG  43  -0.893   7.900  -8.815
  294   1HH1  ARG  43          1HH1      ARG  43   0.100   5.908 -11.504
  295   2HH1  ARG  43          2HH1      ARG  43  -0.207   7.135 -12.688
  296   1HH2  ARG  43          1HH2      ARG  43  -1.295   9.515 -10.373
  297   2HH2  ARG  43          2HH2      ARG  43  -0.999   9.181 -12.046
  298    H    ILE  44           H        ILE  44  -0.731   5.904  -4.073
  299    HA   ILE  44           HA       ILE  44  -3.090   4.495  -3.194
  300    HB   ILE  44           HB       ILE  44  -1.509   6.843  -2.305
  301   1HG1  ILE  44          2HG1      ILE  44  -2.580   4.404  -0.888
  302   2HG1  ILE  44          1HG1      ILE  44  -0.947   4.609  -1.515
  303   1HG2  ILE  44          1HG2      ILE  44  -3.098   7.981  -1.274
  304   2HG2  ILE  44          2HG2      ILE  44  -3.776   6.521  -0.561
  305   3HG2  ILE  44          3HG2      ILE  44  -4.280   7.031  -2.168
  306   1HD1  ILE  44          1HD1      ILE  44  -0.854   6.650   0.059
  307   2HD1  ILE  44          2HD1      ILE  44  -0.702   5.031   0.740
  308   3HD1  ILE  44          3HD1      ILE  44  -2.237   5.894   0.850
  309    H    GLU  45           H        GLU  45  -5.061   4.738  -4.076
  310    HA   GLU  45           HA       GLU  45  -5.810   7.419  -4.994
  311   1HB   GLU  45          2HB       GLU  45  -5.648   6.103  -7.008
  312   2HB   GLU  45          1HB       GLU  45  -6.574   4.791  -6.293
  313   1HG   GLU  45          2HG       GLU  45  -8.506   6.372  -6.132
  314   2HG   GLU  45          1HG       GLU  45  -7.552   7.531  -7.054
  315    H    MET  46           H        MET  46  -7.597   8.172  -4.113
  316    HA   MET  46           HA       MET  46  -9.288   6.358  -2.529
  317   1HB   MET  46          2HB       MET  46  -9.611   8.145  -0.908
  318   2HB   MET  46          1HB       MET  46  -7.904   7.765  -1.085
  319   1HG   MET  46          2HG       MET  46  -7.895   9.714  -2.776
  320   2HG   MET  46          1HG       MET  46  -9.404  10.176  -1.991
  321   1HE   MET  46          1HE       MET  46  -5.640   9.670  -1.760
  322   2HE   MET  46          2HE       MET  46  -6.038   8.593  -0.418
  323   3HE   MET  46          3HE       MET  46  -5.217  10.123  -0.107
  324    H    ASP  47           H        ASP  47 -11.453   6.673  -2.450
  325    HA   ASP  47           HA       ASP  47 -12.862   7.281  -4.668
  326   1HB   ASP  47          2HB       ASP  47 -13.817   6.141  -2.726
  327   2HB   ASP  47          1HB       ASP  47 -13.815   7.656  -1.830
  328    H    ASP  48           H        ASP  48 -11.614   9.591  -2.420
  329    HA   ASP  48           HA       ASP  48 -13.284  11.752  -3.189
  330   1HB   ASP  48          2HB       ASP  48 -10.534  11.791  -1.929
  331   2HB   ASP  48          1HB       ASP  48 -11.620  13.171  -2.048
  332    H    GLY  49           H        GLY  49 -11.484  10.075  -5.181
  333   1HA   GLY  49          2HA       GLY  49 -10.604  10.494  -7.249
  334   2HA   GLY  49          1HA       GLY  49 -11.193  12.144  -7.091
  335    H    ARG  50           H        ARG  50  -9.144  10.869  -4.633
  336    HA   ARG  50           HA       ARG  50  -6.999  12.645  -5.594
  337   1HB   ARG  50          2HB       ARG  50  -7.529  11.615  -2.816
  338   2HB   ARG  50          1HB       ARG  50  -6.173  12.631  -3.267
  339   1HG   ARG  50          2HG       ARG  50  -7.710  14.410  -3.906
  340   2HG   ARG  50          1HG       ARG  50  -9.081  13.387  -3.475
  341   1HD   ARG  50          2HD       ARG  50  -8.576  14.969  -1.688
  342   2HD   ARG  50          1HD       ARG  50  -8.307  13.308  -1.160
  343    HE   ARG  50           HE       ARG  50  -6.141  13.871  -0.768
  344   1HH1  ARG  50          1HH1      ARG  50  -7.422  16.118  -3.113
  345   2HH1  ARG  50          2HH1      ARG  50  -5.955  17.031  -3.224
  346   1HH2  ARG  50          1HH2      ARG  50  -4.214  15.075  -0.908
  347   2HH2  ARG  50          2HH2      ARG  50  -4.135  16.441  -1.971
  348    H    GLU  51           H        GLU  51  -5.432  11.665  -6.620
  349    HA   GLU  51           HA       GLU  51  -4.659   8.961  -5.767
  350   1HB   GLU  51          2HB       GLU  51  -3.787   8.650  -8.040
  351   2HB   GLU  51          1HB       GLU  51  -5.491   9.077  -8.061
  352   1HG   GLU  51          2HG       GLU  51  -4.564  10.322  -9.788
  353   2HG   GLU  51          1HG       GLU  51  -4.721  11.470  -8.460
  354    H    ILE  52           H        ILE  52  -2.524   8.512  -5.339
  355    HA   ILE  52           HA       ILE  52  -0.443  10.452  -5.835
  356    HB   ILE  52           HB       ILE  52  -1.430  11.366  -3.793
  357   1HG1  ILE  52          2HG1      ILE  52   1.238  10.018  -3.299
  358   2HG1  ILE  52          1HG1      ILE  52   1.001  11.550  -4.138
  359   1HG2  ILE  52          1HG2      ILE  52  -2.289  10.042  -2.239
  360   2HG2  ILE  52          2HG2      ILE  52  -0.674   9.448  -1.854
  361   3HG2  ILE  52          3HG2      ILE  52  -1.649   8.625  -3.071
  362   1HD1  ILE  52          1HD1      ILE  52   1.744  11.905  -1.840
  363   2HD1  ILE  52          2HD1      ILE  52   0.347  11.006  -1.242
  364   3HD1  ILE  52          3HD1      ILE  52   0.114  12.541  -2.080
  365    H    THR  53           H        THR  53   1.693   9.607  -5.372
  366    HA   THR  53           HA       THR  53   1.724   6.689  -5.465
  367    HB   THR  53           HB       THR  53   3.931   8.698  -5.945
  368    HG1  THR  53           1HG      THR  53   2.963   8.855  -7.790
  369   1HG2  THR  53          1HG2      THR  53   3.879   5.716  -6.259
  370   2HG2  THR  53          2HG2      THR  53   5.030   6.706  -5.360
  371   3HG2  THR  53          3HG2      THR  53   5.016   6.751  -7.124
  372    H    VAL  54           H        VAL  54   3.104   5.412  -4.148
  373    HA   VAL  54           HA       VAL  54   4.384   6.642  -1.852
  374    HB   VAL  54           HB       VAL  54   2.158   4.633  -1.458
  375   1HG1  VAL  54          1HG1      VAL  54   4.339   4.838   0.100
  376   2HG1  VAL  54          2HG1      VAL  54   2.742   4.440   0.728
  377   3HG1  VAL  54          3HG1      VAL  54   3.340   6.096   0.829
  378   1HG2  VAL  54          1HG2      VAL  54   2.313   7.599  -1.003
  379   2HG2  VAL  54          2HG2      VAL  54   1.161   6.583  -0.137
  380   3HG2  VAL  54          3HG2      VAL  54   1.100   6.683  -1.898
  381    HA   PRO  55           HA       PRO  55   7.125   3.337  -3.379
  382   1HB   PRO  55          2HB       PRO  55   8.544   4.357  -0.951
  383   2HB   PRO  55          1HB       PRO  55   9.190   3.984  -2.556
  384   1HG   PRO  55          2HG       PRO  55   8.782   6.501  -1.847
  385   2HG   PRO  55          1HG       PRO  55   8.362   5.955  -3.483
  386   1HD   PRO  55          2HD       PRO  55   6.581   6.529  -1.160
  387   2HD   PRO  55          1HD       PRO  55   6.304   6.812  -2.888
  388    H    LYS  56           H        LYS  56   7.355   1.247  -2.801
  389    HA   LYS  56           HA       LYS  56   6.209   0.415  -0.234
  390   1HB   LYS  56          2HB       LYS  56   6.700  -1.075  -2.802
  391   2HB   LYS  56          1HB       LYS  56   6.241  -1.882  -1.310
  392   1HG   LYS  56          2HG       LYS  56   4.180  -0.580  -1.239
  393   2HG   LYS  56          1HG       LYS  56   4.641   0.223  -2.740
  394   1HD   LYS  56          2HD       LYS  56   3.072  -1.580  -3.194
  395   2HD   LYS  56          1HD       LYS  56   4.654  -1.952  -3.881
  396   1HE   LYS  56          2HE       LYS  56   5.156  -3.389  -1.973
  397   2HE   LYS  56          1HE       LYS  56   3.594  -2.997  -1.257
  398   1HZ   LYS  56          1HZ       LYS  56   3.540  -4.052  -3.967
  399   2HZ   LYS  56          2HZ       LYS  56   2.507  -4.361  -2.664
  400   3HZ   LYS  56          3HZ       LYS  56   4.006  -5.139  -2.758
  401    H    GLY  57           H        GLY  57   9.216   1.045  -1.447
  402   1HA   GLY  57          2HA       GLY  57  10.821  -1.106  -0.897
  403   2HA   GLY  57          1HA       GLY  57  11.313   0.558  -0.635
  404    H    ILE  58           H        ILE  58   9.544   1.209   1.467
  405    HA   ILE  58           HA       ILE  58   9.867  -0.718   3.565
  406    HB   ILE  58           HB       ILE  58  11.244   1.951   3.877
  407   1HG1  ILE  58          2HG1      ILE  58  13.335   0.438   4.074
  408   2HG1  ILE  58          1HG1      ILE  58  12.369  -0.770   3.235
  409   1HG2  ILE  58          1HG2      ILE  58  10.184   0.731   5.874
  410   2HG2  ILE  58          2HG2      ILE  58  11.849   1.289   6.024
  411   3HG2  ILE  58          3HG2      ILE  58  11.515  -0.412   5.701
  412   1HD1  ILE  58          1HD1      ILE  58  13.066   0.135   1.342
  413   2HD1  ILE  58          2HD1      ILE  58  13.786   1.502   2.192
  414   3HD1  ILE  58          3HD1      ILE  58  12.086   1.548   1.726
  415    H    ALA  59           H        ALA  59   7.493  -0.136   2.904
  416    HA   ALA  59           HA       ALA  59   6.638   1.994   4.735
  417   1HB   ALA  59          1HB       ALA  59   5.354   3.036   3.215
  418   2HB   ALA  59          2HB       ALA  59   4.887   1.531   2.425
  419   3HB   ALA  59          3HB       ALA  59   6.451   2.264   2.072
  420    H    VAL  60           H        VAL  60   5.646   1.058   6.416
  421    HA   VAL  60           HA       VAL  60   4.054  -1.350   6.001
  422    HB   VAL  60           HB       VAL  60   5.561  -1.246   7.957
  423   1HG1  VAL  60          1HG1      VAL  60   3.717   0.620   9.349
  424   2HG1  VAL  60          2HG1      VAL  60   4.917   1.301   8.251
  425   3HG1  VAL  60          3HG1      VAL  60   5.432   0.313   9.618
  426   1HG2  VAL  60          1HG2      VAL  60   3.874  -1.970   9.643
  427   2HG2  VAL  60          2HG2      VAL  60   3.693  -2.741   8.068
  428   3HG2  VAL  60          3HG2      VAL  60   2.609  -1.431   8.540
  429    H    PHE  61           H        PHE  61   1.898  -1.374   5.867
  430    HA   PHE  61           HA       PHE  61   0.334   0.751   7.037
  431   1HB   PHE  61          2HB       PHE  61  -0.857   1.077   4.754
  432   2HB   PHE  61          1HB       PHE  61   0.657   1.917   5.056
  433    HD1  PHE  61           1HD      PHE  61  -0.408  -1.416   3.727
  434    HD2  PHE  61           2HD      PHE  61   2.107   1.989   3.312
  435    HE1  PHE  61           1HE      PHE  61   0.551  -2.378   1.677
  436    HE2  PHE  61           2HE      PHE  61   3.069   1.036   1.260
  437    HZ   PHE  61           HZ       PHE  61   2.291  -1.152   0.440
  438    H    HIS  62           H        HIS  62  -1.761   0.210   7.432
  439    HA   HIS  62           HA       HIS  62  -2.429  -2.605   6.949
  440   1HB   HIS  62          2HB       HIS  62  -3.580  -0.656   8.959
  441   2HB   HIS  62          1HB       HIS  62  -4.001  -2.359   8.825
  442    HD1  HIS  62           1HD      HIS  62  -1.583  -3.905   8.947
  443    HD2  HIS  62           2HD      HIS  62  -1.839  -0.289  10.975
  444    HE1  HIS  62           1HE      HIS  62   0.185  -4.010  10.732
  445    HE2  HIS  62           2HE      HIS  62  -0.046  -1.847  12.002
  446    H    PHE  63           H        PHE  63  -4.205  -3.193   5.833
  447    HA   PHE  63           HA       PHE  63  -5.674  -1.066   4.472
  448   1HB   PHE  63          2HB       PHE  63  -5.455  -4.041   3.969
  449   2HB   PHE  63          1HB       PHE  63  -6.506  -2.977   3.045
  450    HD1  PHE  63           1HD      PHE  63  -4.964  -4.249   1.290
  451    HD2  PHE  63           2HD      PHE  63  -3.674  -1.116   3.863
  452    HE1  PHE  63           1HE      PHE  63  -3.122  -3.741  -0.258
  453    HE2  PHE  63           2HE      PHE  63  -1.834  -0.603   2.319
  454    HZ   PHE  63           HZ       PHE  63  -1.551  -1.917   0.256
  455    H    ARG  64           H        ARG  64  -7.977  -1.140   4.276
  456    HA   ARG  64           HA       ARG  64  -9.365  -2.704   6.343
  457   1HB   ARG  64          2HB       ARG  64  -9.634   0.254   5.799
  458   2HB   ARG  64          1HB       ARG  64 -10.845  -0.664   6.683
  459   1HG   ARG  64          2HG       ARG  64  -7.959  -0.355   7.482
  460   2HG   ARG  64          1HG       ARG  64  -9.322   0.524   8.175
  461   1HD   ARG  64          2HD       ARG  64 -10.311  -1.687   8.811
  462   2HD   ARG  64          1HD       ARG  64  -8.804  -2.441   8.298
  463    HE   ARG  64           HE       ARG  64  -9.285  -1.155  10.763
  464   1HH1  ARG  64          1HH1      ARG  64  -6.807  -1.563   8.339
  465   2HH1  ARG  64          2HH1      ARG  64  -5.510  -1.240   9.437
  466   1HH2  ARG  64          1HH2      ARG  64  -7.578  -0.740  12.207
  467   2HH2  ARG  64          2HH2      ARG  64  -5.944  -0.779  11.633
  468    H    THR  65           H        THR  65 -11.390  -3.439   5.801
  469    HA   THR  65           HA       THR  65 -12.316  -2.811   3.075
  470    HB   THR  65           HB       THR  65 -12.510  -5.452   4.533
  471    HG1  THR  65           1HG      THR  65 -10.962  -4.639   2.302
  472   1HG2  THR  65          1HG2      THR  65 -14.140  -4.508   2.476
  473   2HG2  THR  65          2HG2      THR  65 -13.978  -6.168   3.046
  474   3HG2  THR  65          3HG2      THR  65 -12.981  -5.594   1.711
  475    HA   PRO  66           HA       PRO  66 -15.930  -1.111   5.081
  476   1HB   PRO  66          2HB       PRO  66 -17.146  -2.037   2.512
  477   2HB   PRO  66          1HB       PRO  66 -17.306  -0.480   3.335
  478   1HG   PRO  66          2HG       PRO  66 -15.717  -0.733   1.218
  479   2HG   PRO  66          1HG       PRO  66 -15.239   0.273   2.599
  480   1HD   PRO  66          2HD       PRO  66 -14.249  -2.410   1.775
  481   2HD   PRO  66          1HD       PRO  66 -13.392  -1.090   2.595
  482    H    GLN  67           H        GLN  67 -15.801  -4.288   3.596
  483    HA   GLN  67           HA       GLN  67 -18.274  -5.259   4.543
  484   1HB   GLN  67          2HB       GLN  67 -15.744  -6.775   3.884
  485   2HB   GLN  67          1HB       GLN  67 -17.331  -7.499   4.105
  486   1HG   GLN  67          2HG       GLN  67 -18.175  -6.231   2.193
  487   2HG   GLN  67          1HG       GLN  67 -16.579  -5.517   1.968
  488   1HE2  GLN  67          1HE2      GLN  67 -15.483  -6.411   0.392
  489   2HE2  GLN  67          2HE2      GLN  67 -15.543  -8.069  -0.089
  490    H    GLY  68           H        GLY  68 -15.411  -4.499   6.201
  491   1HA   GLY  68          2HA       GLY  68 -15.410  -4.447   8.594
  492   2HA   GLY  68          1HA       GLY  68 -16.446  -5.866   8.589
  493    H    GLU  69           H        GLU  69 -13.503  -5.401   6.690
  494    HA   GLU  69           HA       GLU  69 -12.233  -7.526   8.297
  495   1HB   GLU  69          2HB       GLU  69 -11.991  -7.119   5.310
  496   2HB   GLU  69          1HB       GLU  69 -11.157  -8.348   6.249
  497   1HG   GLU  69          2HG       GLU  69 -14.139  -8.131   5.921
  498   2HG   GLU  69          1HG       GLU  69 -13.088  -9.242   5.046
  499    H    LEU  70           H        LEU  70  -9.985  -7.415   8.572
  500    HA   LEU  70           HA       LEU  70  -8.752  -4.844   7.832
  501   1HB   LEU  70          2HB       LEU  70  -9.418  -4.923  10.227
  502   2HB   LEU  70          1HB       LEU  70  -8.383  -6.319  10.441
  503    HG   LEU  70           HG       LEU  70  -7.395  -3.587   9.606
  504   1HD1  LEU  70          1HD1      LEU  70  -7.423  -4.925  12.311
  505   2HD1  LEU  70          2HD1      LEU  70  -8.286  -3.458  11.845
  506   3HD1  LEU  70          3HD1      LEU  70  -6.522  -3.459  11.921
  507   1HD2  LEU  70          1HD2      LEU  70  -6.108  -6.228  10.093
  508   2HD2  LEU  70          2HD2      LEU  70  -5.246  -4.773  10.593
  509   3HD2  LEU  70          3HD2      LEU  70  -5.719  -4.982   8.907
  510    H    VAL  71           H        VAL  71  -6.921  -5.052   6.721
  511    HA   VAL  71           HA       VAL  71  -5.418  -7.578   6.962
  512    HB   VAL  71           HB       VAL  71  -5.740  -5.917   4.457
  513   1HG1  VAL  71          1HG1      VAL  71  -3.616  -6.948   4.381
  514   2HG1  VAL  71          2HG1      VAL  71  -4.680  -7.961   3.404
  515   3HG1  VAL  71          3HG1      VAL  71  -4.243  -8.461   5.038
  516   1HG2  VAL  71          1HG2      VAL  71  -7.410  -7.266   3.766
  517   2HG2  VAL  71          2HG2      VAL  71  -7.640  -7.525   5.495
  518   3HG2  VAL  71          3HG2      VAL  71  -6.723  -8.692   4.542
  519    H    GLU  72           H        GLU  72  -3.112  -7.409   6.483
  520    HA   GLU  72           HA       GLU  72  -2.042  -4.710   6.968
  521   1HB   GLU  72          2HB       GLU  72  -0.241  -5.786   8.320
  522   2HB   GLU  72          1HB       GLU  72  -1.842  -5.904   9.033
  523   1HG   GLU  72          2HG       GLU  72  -0.729  -7.988   9.327
  524   2HG   GLU  72          1HG       GLU  72  -2.016  -8.211   8.145
  525    H    ILE  73           H        ILE  73  -0.027  -4.214   6.053
  526    HA   ILE  73           HA       ILE  73   1.189  -6.162   4.254
  527    HB   ILE  73           HB       ILE  73   0.236  -3.461   3.285
  528   1HG1  ILE  73          2HG1      ILE  73  -1.588  -5.110   3.530
  529   2HG1  ILE  73          1HG1      ILE  73  -1.290  -4.697   1.844
  530   1HG2  ILE  73          1HG2      ILE  73   1.711  -5.668   1.856
  531   2HG2  ILE  73          2HG2      ILE  73   2.331  -4.065   2.250
  532   3HG2  ILE  73          3HG2      ILE  73   1.024  -4.241   1.079
  533   1HD1  ILE  73          1HD1      ILE  73  -0.384  -6.770   1.364
  534   2HD1  ILE  73          2HD1      ILE  73  -1.675  -7.166   2.499
  535   3HD1  ILE  73          3HD1      ILE  73  -0.001  -7.109   3.052
  536    H    ASP  74           H        ASP  74   3.160  -6.145   5.205
  537    HA   ASP  74           HA       ASP  74   4.333  -3.722   6.207
  538   1HB   ASP  74          2HB       ASP  74   5.509  -6.493   5.919
  539   2HB   ASP  74          1HB       ASP  74   6.253  -5.158   6.792
  540    H    GLY  75           H        GLY  75   4.835  -2.295   4.654
  541   1HA   GLY  75          2HA       GLY  75   5.924  -2.913   2.125
  542   2HA   GLY  75          1HA       GLY  75   5.930  -1.332   2.879
  543    H    ARG  76           H        ARG  76   7.375  -2.953   5.189
  544    HA   ARG  76           HA       ARG  76  10.002  -2.400   4.109
  545   1HB   ARG  76          2HB       ARG  76  10.765  -2.407   6.448
  546   2HB   ARG  76          1HB       ARG  76   9.469  -1.252   6.168
  547   1HG   ARG  76          2HG       ARG  76   7.860  -2.849   7.113
  548   2HG   ARG  76          1HG       ARG  76   9.185  -3.971   7.430
  549   1HD   ARG  76          2HD       ARG  76  10.230  -2.328   8.905
  550   2HD   ARG  76          1HD       ARG  76   8.927  -1.189   8.570
  551    HE   ARG  76           HE       ARG  76   7.699  -2.251  10.160
  552   1HH1  ARG  76          1HH1      ARG  76  10.126  -4.484   9.014
  553   2HH1  ARG  76          2HH1      ARG  76   9.647  -5.750  10.093
  554   1HH2  ARG  76          1HH2      ARG  76   7.074  -3.914  11.581
  555   2HH2  ARG  76          2HH2      ARG  76   7.916  -5.426  11.551
  556    H    ALA  77           H        ALA  77   8.341  -4.922   5.909
  557    HA   ALA  77           HA       ALA  77  10.534  -6.742   5.349
  558   1HB   ALA  77          1HB       ALA  77   9.876  -6.532   7.674
  559   2HB   ALA  77          2HB       ALA  77   9.602  -8.172   7.082
  560   3HB   ALA  77          3HB       ALA  77   8.244  -7.060   7.265
  561    H    LEU  78           H        LEU  78   7.388  -6.106   4.182
  562    HA   LEU  78           HA       LEU  78   7.045  -8.875   3.306
  563   1HB   LEU  78          2HB       LEU  78   5.155  -7.600   4.376
  564   2HB   LEU  78          1HB       LEU  78   5.108  -6.606   2.934
  565    HG   LEU  78           HG       LEU  78   3.382  -8.383   2.964
  566   1HD1  LEU  78          1HD1      LEU  78   3.442  -8.574   0.729
  567   2HD1  LEU  78          2HD1      LEU  78   5.071  -9.249   0.726
  568   3HD1  LEU  78          3HD1      LEU  78   4.838  -7.504   0.856
  569   1HD2  LEU  78          1HD2      LEU  78   5.296  -9.985   3.998
  570   2HD2  LEU  78          2HD2      LEU  78   5.326 -10.488   2.308
  571   3HD2  LEU  78          3HD2      LEU  78   3.823 -10.572   3.227
  572    H    VAL  79           H        VAL  79   7.536  -5.671   1.988
  573    HA   VAL  79           HA       VAL  79   6.980  -6.123  -0.677
  574    HB   VAL  79           HB       VAL  79   7.575  -3.909   0.197
  575   1HG1  VAL  79          1HG1      VAL  79  10.475  -4.624   0.029
  576   2HG1  VAL  79          2HG1      VAL  79   9.572  -4.904   1.518
  577   3HG1  VAL  79          3HG1      VAL  79   9.701  -3.274   0.858
  578   1HG2  VAL  79          1HG2      VAL  79   8.278  -3.151  -1.819
  579   2HG2  VAL  79          2HG2      VAL  79   7.957  -4.821  -2.289
  580   3HG2  VAL  79          3HG2      VAL  79   9.606  -4.309  -1.917
  581    H    ALA  80           H        ALA  80   7.560  -7.991  -1.621
  582    HA   ALA  80           HA       ALA  80  10.407  -8.735  -1.581
  583   1HB   ALA  80          1HB       ALA  80   8.986 -10.468  -0.683
  584   2HB   ALA  80          2HB       ALA  80   9.648 -10.993  -2.232
  585   3HB   ALA  80          3HB       ALA  80   7.978 -10.435  -2.131
  586    H    ARG  81           H        ARG  81  11.439  -7.998  -3.330
  587    HA   ARG  81           HA       ARG  81  10.020  -7.627  -5.838
  588   1HB   ARG  81          2HB       ARG  81  12.940  -7.138  -5.213
  589   2HB   ARG  81          1HB       ARG  81  12.060  -6.569  -6.626
  590   1HG   ARG  81          2HG       ARG  81  10.651  -5.182  -5.157
  591   2HG   ARG  81          1HG       ARG  81  11.609  -5.715  -3.773
  592   1HD   ARG  81          2HD       ARG  81  13.633  -4.806  -4.916
  593   2HD   ARG  81          1HD       ARG  81  12.574  -4.144  -6.160
  594    HE   ARG  81           HE       ARG  81  12.127  -2.417  -4.752
  595   1HH1  ARG  81          1HH1      ARG  81  13.194  -5.128  -2.827
  596   2HH1  ARG  81          2HH1      ARG  81  13.133  -4.252  -1.335
  597   1HH2  ARG  81          1HH2      ARG  81  12.057  -1.263  -2.792
  598   2HH2  ARG  81          2HH2      ARG  81  12.493  -2.059  -1.315
  599    HA   PRO  82           HA       PRO  82  11.450 -11.766  -6.995
  600   1HB   PRO  82          2HB       PRO  82   9.945 -12.006  -9.223
  601   2HB   PRO  82          1HB       PRO  82   9.271 -12.208  -7.602
  602   1HG   PRO  82          2HG       PRO  82   9.177  -9.820  -9.407
  603   2HG   PRO  82          1HG       PRO  82   7.883 -10.530  -8.424
  604   1HD   PRO  82          2HD       PRO  82   9.296  -8.342  -7.648
  605   2HD   PRO  82          1HD       PRO  82   8.618  -9.509  -6.495
  606    H    GLU  83           H        GLU  83  11.777  -8.780  -8.622
  607    HA   GLU  83           HA       GLU  83  13.190  -9.822 -10.907
  608   1HB   GLU  83          2HB       GLU  83  12.910  -6.984  -9.908
  609   2HB   GLU  83          1HB       GLU  83  13.590  -7.455 -11.459
  610   1HG   GLU  83          2HG       GLU  83  10.754  -7.914 -10.561
  611   2HG   GLU  83          1HG       GLU  83  11.300  -6.676 -11.692
  612    H    GLU  84           H        GLU  84  13.967  -8.666  -7.745
  613    HA   GLU  84           HA       GLU  84  16.833  -8.722  -8.391
  614   1HB   GLU  84          2HB       GLU  84  15.415  -7.499  -6.018
  615   2HB   GLU  84          1HB       GLU  84  17.152  -7.472  -6.285
  616   1HG   GLU  84          2HG       GLU  84  16.821  -6.174  -8.328
  617   2HG   GLU  84          1HG       GLU  84  15.079  -6.197  -8.057
  618    H    ARG  85           H        ARG  85  14.464 -10.654  -7.092
  619    HA   ARG  85           HA       ARG  85  14.491 -12.597  -5.916
  620   1HB   ARG  85          2HB       ARG  85  17.490 -12.372  -6.231
  621   2HB   ARG  85          1HB       ARG  85  16.627 -13.808  -5.701
  622   1HG   ARG  85          2HG       ARG  85  15.494 -13.923  -7.865
  623   2HG   ARG  85          1HG       ARG  85  16.370 -12.487  -8.395
  624   1HD   ARG  85          2HD       ARG  85  18.490 -13.670  -8.118
  625   2HD   ARG  85          1HD       ARG  85  17.624 -15.104  -7.569
  626    HE   ARG  85           HE       ARG  85  18.074 -14.330 -10.251
  627   1HH1  ARG  85          1HH1      ARG  85  15.668 -15.797  -8.188
  628   2HH1  ARG  85          2HH1      ARG  85  14.893 -16.643  -9.483
  629   1HH2  ARG  85          1HH2      ARG  85  17.060 -15.450 -11.954
  630   2HH2  ARG  85          2HH2      ARG  85  15.685 -16.450 -11.620
  631    H    ILE  86           H        ILE  86  14.204 -13.000  -3.809
  632    HA   ILE  86           HA       ILE  86  15.085 -11.044  -1.891
  633    HB   ILE  86           HB       ILE  86  13.582 -13.621  -1.407
  634   1HG1  ILE  86          2HG1      ILE  86  12.363 -12.197  -2.971
  635   2HG1  ILE  86          1HG1      ILE  86  11.560 -12.203  -1.405
  636   1HG2  ILE  86          1HG2      ILE  86  14.315 -11.295   0.300
  637   2HG2  ILE  86          2HG2      ILE  86  14.265 -13.014   0.692
  638   3HG2  ILE  86          3HG2      ILE  86  12.765 -12.092   0.573
  639   1HD1  ILE  86          1HD1      ILE  86  13.411 -10.032  -2.357
  640   2HD1  ILE  86          2HD1      ILE  86  12.423 -10.028  -0.896
  641   3HD1  ILE  86          3HD1      ILE  86  11.652  -9.982  -2.482
  Start of MODEL    7
    1    H    ARG   9           H        ARG   9  -2.522  -9.145 -12.180
    2    HA   ARG   9           HA       ARG   9  -0.405  -7.139 -12.394
    3   1HB   ARG   9          2HB       ARG   9  -3.204  -6.748 -13.466
    4   2HB   ARG   9          1HB       ARG   9  -1.976  -5.494 -13.353
    5   1HG   ARG   9          2HG       ARG   9  -0.568  -6.720 -14.920
    6   2HG   ARG   9          1HG       ARG   9  -1.788  -7.991 -15.026
    7   1HD   ARG   9          2HD       ARG   9  -1.951  -6.477 -16.926
    8   2HD   ARG   9          1HD       ARG   9  -3.395  -6.376 -15.917
    9    HE   ARG   9           HE       ARG   9  -2.928  -4.174 -15.613
   10   1HH1  ARG   9          1HH1      ARG   9   0.047  -5.789 -16.464
   11   2HH1  ARG   9          2HH1      ARG   9   0.989  -4.338 -16.432
   12   1HH2  ARG   9          1HH2      ARG   9  -1.691  -2.263 -15.579
   13   2HH2  ARG   9          2HH2      ARG   9   0.003  -2.337 -15.932
   14    H    HIS  10           H        HIS  10  -3.884  -7.057 -11.630
   15    HA   HIS  10           HA       HIS  10  -3.167  -6.120  -8.931
   16   1HB   HIS  10          2HB       HIS  10  -5.194  -4.720  -8.963
   17   2HB   HIS  10          1HB       HIS  10  -4.072  -4.272 -10.243
   18    HD1  HIS  10           1HD      HIS  10  -6.640  -3.237 -10.907
   19    HD2  HIS  10           2HD      HIS  10  -5.817  -7.248 -11.605
   20    HE1  HIS  10           1HE      HIS  10  -8.315  -3.977 -12.629
   21    HE2  HIS  10           2HE      HIS  10  -7.847  -6.428 -12.977
   22    H    GLU  11           H        GLU  11  -4.791  -6.545  -7.263
   23    HA   GLU  11           HA       GLU  11  -6.985  -8.245  -7.605
   24   1HB   GLU  11          2HB       GLU  11  -6.093 -10.360  -6.708
   25   2HB   GLU  11          1HB       GLU  11  -5.362  -9.939  -8.251
   26   1HG   GLU  11          2HG       GLU  11  -3.384  -9.102  -7.086
   27   2HG   GLU  11          1HG       GLU  11  -4.117  -9.528  -5.541
   28    H    LEU  12           H        LEU  12  -6.214  -5.939  -6.076
   29    HA   LEU  12           HA       LEU  12  -7.319  -6.681  -3.561
   30   1HB   LEU  12          2HB       LEU  12  -4.945  -7.425  -3.308
   31   2HB   LEU  12          1HB       LEU  12  -4.445  -5.760  -3.524
   32    HG   LEU  12           HG       LEU  12  -5.652  -5.129  -1.476
   33   1HD1  LEU  12          1HD1      LEU  12  -7.402  -6.839  -1.575
   34   2HD1  LEU  12          2HD1      LEU  12  -6.577  -6.837  -0.015
   35   3HD1  LEU  12          3HD1      LEU  12  -6.203  -8.079  -1.210
   36   1HD2  LEU  12          1HD2      LEU  12  -3.750  -7.440  -1.110
   37   2HD2  LEU  12          2HD2      LEU  12  -4.166  -6.239   0.114
   38   3HD2  LEU  12          3HD2      LEU  12  -3.297  -5.753  -1.342
   39    H    ILE  13           H        ILE  13  -7.652  -4.743  -5.778
   40    HA   ILE  13           HA       ILE  13  -7.141  -2.176  -4.501
   41    HB   ILE  13           HB       ILE  13  -8.070  -1.187  -6.568
   42   1HG1  ILE  13          2HG1      ILE  13  -8.238  -4.063  -7.497
   43   2HG1  ILE  13          1HG1      ILE  13  -9.610  -3.012  -7.167
   44   1HG2  ILE  13          1HG2      ILE  13  -6.186  -1.692  -7.959
   45   2HG2  ILE  13          2HG2      ILE  13  -5.928  -3.229  -7.133
   46   3HG2  ILE  13          3HG2      ILE  13  -5.659  -1.709  -6.275
   47   1HD1  ILE  13          1HD1      ILE  13  -9.099  -3.247  -9.565
   48   2HD1  ILE  13          2HD1      ILE  13  -7.530  -2.495  -9.276
   49   3HD1  ILE  13          3HD1      ILE  13  -9.012  -1.579  -8.997
   50    H    GLY  14           H        GLY  14  -8.900  -0.548  -4.433
   51   1HA   GLY  14          2HA       GLY  14 -11.152   0.066  -4.147
   52   2HA   GLY  14          1HA       GLY  14 -11.600  -1.630  -4.207
   53    H    LEU  15           H        LEU  15  -8.978  -1.171  -2.162
   54    HA   LEU  15           HA       LEU  15 -10.746  -1.229   0.190
   55   1HB   LEU  15          2HB       LEU  15  -7.895  -2.197   0.000
   56   2HB   LEU  15          1HB       LEU  15  -9.013  -2.455   1.325
   57    HG   LEU  15           HG       LEU  15  -9.271  -3.630  -1.444
   58   1HD1  LEU  15          1HD1      LEU  15  -7.427  -4.549  -0.062
   59   2HD1  LEU  15          2HD1      LEU  15  -8.689  -5.724  -0.436
   60   3HD1  LEU  15          3HD1      LEU  15  -8.618  -4.987   1.163
   61   1HD2  LEU  15          1HD2      LEU  15 -11.405  -3.099  -0.160
   62   2HD2  LEU  15          2HD2      LEU  15 -10.885  -4.336   0.988
   63   3HD2  LEU  15          3HD2      LEU  15 -11.185  -4.765  -0.695
   64    H    SER  16           H        SER  16  -9.730  -0.326   2.210
   65    HA   SER  16           HA       SER  16  -8.464   2.238   1.559
   66   1HB   SER  16          2HB       SER  16  -9.781   1.295   4.124
   67   2HB   SER  16          1HB       SER  16  -9.130   2.911   3.847
   68    HG   SER  16           HG       SER  16 -11.190   3.175   3.309
   69    H    VAL  17           H        VAL  17  -6.498   2.858   2.432
   70    HA   VAL  17           HA       VAL  17  -5.050   0.793   3.950
   71    HB   VAL  17           HB       VAL  17  -3.816   2.620   1.893
   72   1HG1  VAL  17          1HG1      VAL  17  -2.607   0.084   2.895
   73   2HG1  VAL  17          2HG1      VAL  17  -2.497   1.549   3.871
   74   3HG1  VAL  17          3HG1      VAL  17  -1.824   1.522   2.241
   75   1HG2  VAL  17          1HG2      VAL  17  -5.173   1.232   0.592
   76   2HG2  VAL  17          2HG2      VAL  17  -4.903  -0.164   1.639
   77   3HG2  VAL  17          3HG2      VAL  17  -3.609   0.414   0.589
   78    H    ARG  18           H        ARG  18  -3.769   1.459   5.618
   79    HA   ARG  18           HA       ARG  18  -3.713   4.353   6.177
   80   1HB   ARG  18          2HB       ARG  18  -5.240   3.160   7.698
   81   2HB   ARG  18          1HB       ARG  18  -3.926   2.094   8.178
   82   1HG   ARG  18          2HG       ARG  18  -2.717   3.984   9.121
   83   2HG   ARG  18          1HG       ARG  18  -4.011   5.071   8.617
   84   1HD   ARG  18          2HD       ARG  18  -5.581   3.830  10.054
   85   2HD   ARG  18          1HD       ARG  18  -4.258   2.792  10.581
   86    HE   ARG  18           HE       ARG  18  -3.684   4.413  12.065
   87   1HH1  ARG  18          1HH1      ARG  18  -5.493   5.916   9.483
   88   2HH1  ARG  18          2HH1      ARG  18  -5.428   7.495  10.190
   89   1HH2  ARG  18          1HH2      ARG  18  -3.602   6.490  12.995
   90   2HH2  ARG  18          2HH2      ARG  18  -4.357   7.821  12.183
   91    H    ILE  19           H        ILE  19  -1.681   4.833   5.501
   92    HA   ILE  19           HA       ILE  19   0.569   3.138   5.986
   93    HB   ILE  19           HB       ILE  19   0.554   6.041   5.155
   94   1HG1  ILE  19          2HG1      ILE  19  -0.743   4.678   3.594
   95   2HG1  ILE  19          1HG1      ILE  19   0.778   5.181   2.859
   96   1HG2  ILE  19          1HG2      ILE  19   2.668   4.022   5.515
   97   2HG2  ILE  19          2HG2      ILE  19   2.748   5.782   5.605
   98   3HG2  ILE  19          3HG2      ILE  19   2.760   4.977   4.035
   99   1HD1  ILE  19          1HD1      ILE  19   1.706   2.925   3.497
  100   2HD1  ILE  19          2HD1      ILE  19   0.440   2.905   2.267
  101   3HD1  ILE  19          3HD1      ILE  19   0.061   2.459   3.932
  102    H    ALA  20           H        ALA  20   1.737   2.982   7.776
  103    HA   ALA  20           HA       ALA  20   1.323   4.839   9.951
  104   1HB   ALA  20          1HB       ALA  20   3.366   3.015  10.612
  105   2HB   ALA  20          2HB       ALA  20   2.149   2.120   9.705
  106   3HB   ALA  20          3HB       ALA  20   1.688   3.009  11.156
  107    H    ARG  21           H        ARG  21   3.985   3.731   7.954
  108    HA   ARG  21           HA       ARG  21   5.212   6.260   7.822
  109   1HB   ARG  21          2HB       ARG  21   7.254   5.835   9.088
  110   2HB   ARG  21          1HB       ARG  21   5.847   5.759  10.140
  111   1HG   ARG  21          2HG       ARG  21   5.915   3.328  10.080
  112   2HG   ARG  21          1HG       ARG  21   7.301   3.386   8.991
  113   1HD   ARG  21          2HD       ARG  21   8.599   4.556  10.713
  114   2HD   ARG  21          1HD       ARG  21   7.214   4.484  11.803
  115    HE   ARG  21           HE       ARG  21   9.108   2.434  11.348
  116   1HH1  ARG  21          1HH1      ARG  21   5.701   2.938  11.932
  117   2HH1  ARG  21          2HH1      ARG  21   5.456   1.356  12.594
  118   1HH2  ARG  21          1HH2      ARG  21   8.785   0.359  12.224
  119   2HH2  ARG  21          2HH2      ARG  21   7.206  -0.106  12.762
  120    H    SER  22           H        SER  22   6.419   6.337   6.031
  121    HA   SER  22           HA       SER  22   7.262   3.774   4.854
  122   1HB   SER  22          2HB       SER  22   6.538   6.326   3.405
  123   2HB   SER  22          1HB       SER  22   6.996   4.803   2.653
  124    HG   SER  22           HG       SER  22   4.775   5.072   4.389
  125    H    VAL  23           H        VAL  23   9.135   3.943   3.358
  126    HA   VAL  23           HA       VAL  23  11.475   4.527   4.484
  127    HB   VAL  23           HB       VAL  23  11.314   3.469   2.298
  128   1HG1  VAL  23          1HG1      VAL  23  10.855   6.225   1.162
  129   2HG1  VAL  23          2HG1      VAL  23   9.592   5.011   1.378
  130   3HG1  VAL  23          3HG1      VAL  23  10.932   4.704   0.272
  131   1HG2  VAL  23          1HG2      VAL  23  13.082   5.917   2.234
  132   2HG2  VAL  23          2HG2      VAL  23  13.285   4.466   1.253
  133   3HG2  VAL  23          3HG2      VAL  23  13.476   4.380   3.004
  134    H    HIS  24           H        HIS  24   9.615   6.930   2.621
  135    HA   HIS  24           HA       HIS  24  11.525   9.007   3.297
  136   1HB   HIS  24          2HB       HIS  24  10.421   8.886   1.056
  137   2HB   HIS  24          1HB       HIS  24   8.892   9.269   1.834
  138    HD1  HIS  24           1HD      HIS  24  12.352  10.856   2.018
  139    HD2  HIS  24           2HD      HIS  24   8.376  11.871   1.382
  140    HE1  HIS  24           1HE      HIS  24  12.340  13.350   1.694
  141    HE2  HIS  24           2HE      HIS  24   9.934  13.929   1.224
  142    H    ARG  25           H        ARG  25  11.257  10.586   4.788
  143    HA   ARG  25           HA       ARG  25   9.420  10.113   6.903
  144   1HB   ARG  25          2HB       ARG  25  11.277  12.444   6.443
  145   2HB   ARG  25          1HB       ARG  25  10.450  12.083   7.952
  146   1HG   ARG  25          2HG       ARG  25  11.669   9.989   8.143
  147   2HG   ARG  25          1HG       ARG  25  12.473  10.309   6.605
  148   1HD   ARG  25          2HD       ARG  25  12.681  12.004   9.095
  149   2HD   ARG  25          1HD       ARG  25  13.907  10.877   8.514
  150    HE   ARG  25           HE       ARG  25  13.511  13.536   7.639
  151   1HH1  ARG  25          1HH1      ARG  25  14.370  10.363   6.458
  152   2HH1  ARG  25          2HH1      ARG  25  15.238  10.972   5.089
  153   1HH2  ARG  25          1HH2      ARG  25  14.658  14.335   5.841
  154   2HH2  ARG  25          2HH2      ARG  25  15.404  13.225   4.740
  155    H    ASP  26           H        ASP  26   9.240  12.112   4.103
  156    HA   ASP  26           HA       ASP  26   7.277  13.873   5.267
  157   1HB   ASP  26          2HB       ASP  26   8.197  13.695   2.398
  158   2HB   ASP  26          1HB       ASP  26   7.223  14.981   3.098
  159    H    ILE  27           H        ILE  27   6.976  10.799   4.488
  160    HA   ILE  27           HA       ILE  27   4.258  11.150   3.485
  161    HB   ILE  27           HB       ILE  27   4.481   9.127   2.114
  162   1HG1  ILE  27          2HG1      ILE  27   7.400   9.303   2.890
  163   2HG1  ILE  27          1HG1      ILE  27   6.269   8.059   3.403
  164   1HG2  ILE  27          1HG2      ILE  27   6.241  11.488   1.605
  165   2HG2  ILE  27          2HG2      ILE  27   4.734  11.021   0.818
  166   3HG2  ILE  27          3HG2      ILE  27   6.221  10.140   0.468
  167   1HD1  ILE  27          1HD1      ILE  27   7.871   7.495   1.504
  168   2HD1  ILE  27          2HD1      ILE  27   6.859   8.540   0.506
  169   3HD1  ILE  27          3HD1      ILE  27   6.165   7.110   1.271
  170    H    GLN  28           H        GLN  28   5.843  10.290   6.109
  171    HA   GLN  28           HA       GLN  28   4.674   7.706   6.584
  172   1HB   GLN  28          2HB       GLN  28   5.707   7.878   8.815
  173   2HB   GLN  28          1HB       GLN  28   6.862   8.156   7.518
  174   1HG   GLN  28          2HG       GLN  28   6.757  10.542   7.899
  175   2HG   GLN  28          1HG       GLN  28   5.529  10.311   9.142
  176   1HE2  GLN  28          1HE2      GLN  28   8.729  10.822   8.638
  177   2HE2  GLN  28          2HE2      GLN  28   9.362  10.208  10.124
  178    H    GLY  29           H        GLY  29   2.672   7.386   7.280
  179   1HA   GLY  29          2HA       GLY  29   1.005   7.719   8.988
  180   2HA   GLY  29          1HA       GLY  29   1.460   9.414   9.040
  181    H    ILE  30           H        ILE  30   1.172   8.034   5.902
  182    HA   ILE  30           HA       ILE  30  -1.032   9.762   5.309
  183    HB   ILE  30           HB       ILE  30   0.335   7.728   3.544
  184   1HG1  ILE  30          2HG1      ILE  30   0.700  10.726   3.767
  185   2HG1  ILE  30          1HG1      ILE  30   1.842   9.508   4.330
  186   1HG2  ILE  30          1HG2      ILE  30  -2.071   9.178   3.164
  187   2HG2  ILE  30          2HG2      ILE  30  -1.221   8.143   2.017
  188   3HG2  ILE  30          3HG2      ILE  30  -0.853   9.866   2.091
  189   1HD1  ILE  30          1HD1      ILE  30   2.530  10.476   2.196
  190   2HD1  ILE  30          2HD1      ILE  30   1.013   9.947   1.465
  191   3HD1  ILE  30          3HD1      ILE  30   2.179   8.753   2.036
  192    H    SER  31           H        SER  31  -3.125   9.272   5.179
  193    HA   SER  31           HA       SER  31  -3.904   6.430   5.247
  194   1HB   SER  31          2HB       SER  31  -4.299   7.443   7.445
  195   2HB   SER  31          1HB       SER  31  -5.239   8.734   6.696
  196    HG   SER  31           HG       SER  31  -6.797   7.255   6.132
  197    H    GLY  32           H        GLY  32  -5.244   5.818   3.645
  198   1HA   GLY  32          2HA       GLY  32  -7.317   7.413   2.598
  199   2HA   GLY  32          1HA       GLY  32  -5.914   7.545   1.546
  200    H    ARG  33           H        ARG  33  -7.337   6.574  -0.052
  201    HA   ARG  33           HA       ARG  33  -7.788   3.722   0.341
  202   1HB   ARG  33          2HB       ARG  33  -8.971   5.674  -1.575
  203   2HB   ARG  33          1HB       ARG  33  -9.121   3.945  -1.818
  204   1HG   ARG  33          2HG       ARG  33 -11.073   4.970  -0.699
  205   2HG   ARG  33          1HG       ARG  33 -10.310   3.673   0.220
  206   1HD   ARG  33          2HD       ARG  33  -9.180   5.308   1.620
  207   2HD   ARG  33          1HD       ARG  33  -9.870   6.624   0.675
  208    HE   ARG  33           HE       ARG  33 -11.962   5.042   1.638
  209   1HH1  ARG  33          1HH1      ARG  33  -9.494   7.187   2.856
  210   2HH1  ARG  33          2HH1      ARG  33 -10.422   7.677   4.232
  211   1HH2  ARG  33          1HH2      ARG  33 -13.183   5.684   3.450
  212   2HH2  ARG  33          2HH2      ARG  33 -12.516   6.823   4.570
  213    H    VAL  34           H        VAL  34  -7.609   2.442  -1.764
  214    HA   VAL  34           HA       VAL  34  -4.825   2.703  -2.631
  215    HB   VAL  34           HB       VAL  34  -5.487   0.623  -1.488
  216   1HG1  VAL  34          1HG1      VAL  34  -7.012  -0.906  -2.350
  217   2HG1  VAL  34          2HG1      VAL  34  -7.019  -0.147  -3.942
  218   3HG1  VAL  34          3HG1      VAL  34  -7.809   0.650  -2.583
  219   1HG2  VAL  34          1HG2      VAL  34  -4.336  -0.868  -2.958
  220   2HG2  VAL  34          2HG2      VAL  34  -3.619   0.733  -3.145
  221   3HG2  VAL  34          3HG2      VAL  34  -4.739   0.119  -4.363
  222    H    VAL  35           H        VAL  35  -4.146   2.172  -4.796
  223    HA   VAL  35           HA       VAL  35  -6.257   2.437  -6.829
  224    HB   VAL  35           HB       VAL  35  -3.669   3.280  -7.812
  225   1HG1  VAL  35          1HG1      VAL  35  -5.180   3.811  -9.339
  226   2HG1  VAL  35          2HG1      VAL  35  -5.365   5.289  -8.395
  227   3HG1  VAL  35          3HG1      VAL  35  -6.480   3.942  -8.158
  228   1HG2  VAL  35          1HG2      VAL  35  -4.215   4.325  -5.321
  229   2HG2  VAL  35          2HG2      VAL  35  -4.707   5.589  -6.439
  230   3HG2  VAL  35          3HG2      VAL  35  -3.070   4.952  -6.496
  231    H    ASP  36           H        ASP  36  -2.907   1.494  -6.194
  232    HA   ASP  36           HA       ASP  36  -3.287  -1.060  -7.442
  233   1HB   ASP  36          2HB       ASP  36  -2.900   0.353  -9.418
  234   2HB   ASP  36          1HB       ASP  36  -1.387   0.916  -8.718
  235    H    GLU  37           H        GLU  37  -1.214  -2.360  -7.413
  236    HA   GLU  37           HA       GLU  37   0.499  -1.531  -5.159
  237   1HB   GLU  37          2HB       GLU  37  -0.957  -3.409  -4.538
  238   2HB   GLU  37          1HB       GLU  37  -0.376  -4.328  -5.921
  239   1HG   GLU  37          2HG       GLU  37   1.871  -4.345  -4.971
  240   2HG   GLU  37          1HG       GLU  37   1.292  -3.419  -3.588
  241    H    THR  38           H        THR  38   2.631  -1.354  -5.637
  242    HA   THR  38           HA       THR  38   3.586  -2.715  -8.071
  243    HB   THR  38           HB       THR  38   4.372   0.013  -7.053
  244    HG1  THR  38           1HG      THR  38   3.253   0.768  -8.806
  245   1HG2  THR  38          1HG2      THR  38   5.625   0.276  -9.101
  246   2HG2  THR  38          2HG2      THR  38   5.219  -1.370  -9.586
  247   3HG2  THR  38          3HG2      THR  38   6.244  -1.094  -8.178
  248    H    ARG  39           H        ARG  39   5.796  -3.265  -8.171
  249    HA   ARG  39           HA       ARG  39   6.876  -4.766  -6.201
  250   1HB   ARG  39          2HB       ARG  39   8.926  -4.691  -7.365
  251   2HB   ARG  39          1HB       ARG  39   7.675  -4.481  -8.578
  252   1HG   ARG  39          2HG       ARG  39   8.087  -1.990  -8.358
  253   2HG   ARG  39          1HG       ARG  39   9.534  -2.419  -7.440
  254   1HD   ARG  39          2HD       ARG  39  10.135  -2.064  -9.748
  255   2HD   ARG  39          1HD       ARG  39  10.301  -3.774  -9.352
  256    HE   ARG  39           HE       ARG  39   8.783  -4.216 -10.979
  257   1HH1  ARG  39          1HH1      ARG  39   8.290  -0.925  -9.925
  258   2HH1  ARG  39          2HH1      ARG  39   7.007  -0.627 -11.046
  259   1HH2  ARG  39          1HH2      ARG  39   7.098  -3.821 -12.460
  260   2HH2  ARG  39          2HH2      ARG  39   6.331  -2.268 -12.485
  261    H    ASN  40           H        ASN  40   7.460  -1.283  -6.631
  262    HA   ASN  40           HA       ASN  40   8.355  -1.180  -3.846
  263   1HB   ASN  40          2HB       ASN  40  10.208   0.334  -4.429
  264   2HB   ASN  40          1HB       ASN  40  10.403  -1.263  -5.129
  265   1HD2  ASN  40          1HD2      ASN  40   8.047   0.359  -6.885
  266   2HD2  ASN  40          2HD2      ASN  40   9.049   0.969  -8.142
  267    H    THR  41           H        THR  41   5.872  -0.367  -5.230
  268    HA   THR  41           HA       THR  41   5.731   2.269  -4.059
  269    HB   THR  41           HB       THR  41   4.570   3.132  -6.215
  270    HG1  THR  41           1HG      THR  41   6.329   1.246  -7.370
  271   1HG2  THR  41          1HG2      THR  41   6.666   4.040  -5.319
  272   2HG2  THR  41          2HG2      THR  41   6.601   4.049  -7.082
  273   3HG2  THR  41          3HG2      THR  41   7.557   2.828  -6.240
  274    H    LEU  42           H        LEU  42   3.669   2.935  -3.546
  275    HA   LEU  42           HA       LEU  42   1.562   0.914  -3.972
  276   1HB   LEU  42          2HB       LEU  42   2.545   1.004  -1.664
  277   2HB   LEU  42          1HB       LEU  42   1.900   2.620  -1.509
  278    HG   LEU  42           HG       LEU  42   0.489   0.983  -0.380
  279   1HD1  LEU  42          1HD1      LEU  42  -0.448   3.023  -1.608
  280   2HD1  LEU  42          2HD1      LEU  42  -1.583   1.746  -1.169
  281   3HD1  LEU  42          3HD1      LEU  42  -1.004   1.878  -2.829
  282   1HD2  LEU  42          1HD2      LEU  42  -0.740  -0.705  -1.670
  283   2HD2  LEU  42          2HD2      LEU  42   1.002  -0.967  -1.750
  284   3HD2  LEU  42          3HD2      LEU  42   0.154  -0.246  -3.119
  285    H    ARG  43           H        ARG  43   0.134   1.738  -5.308
  286    HA   ARG  43           HA       ARG  43  -0.339   4.570  -5.496
  287   1HB   ARG  43          2HB       ARG  43  -0.950   2.176  -7.041
  288   2HB   ARG  43          1HB       ARG  43  -2.295   3.291  -6.977
  289   1HG   ARG  43          2HG       ARG  43  -0.888   5.079  -7.832
  290   2HG   ARG  43          1HG       ARG  43   0.494   3.981  -7.857
  291   1HD   ARG  43          2HD       ARG  43  -0.657   2.565  -9.483
  292   2HD   ARG  43          1HD       ARG  43  -2.052   3.643  -9.444
  293    HE   ARG  43           HE       ARG  43   0.208   5.148 -10.112
  294   1HH1  ARG  43          1HH1      ARG  43  -1.778   2.617 -11.463
  295   2HH1  ARG  43          2HH1      ARG  43  -1.465   3.074 -13.104
  296   1HH2  ARG  43          1HH2      ARG  43   0.621   5.752 -12.269
  297   2HH2  ARG  43          2HH2      ARG  43  -0.103   4.855 -13.562
  298    H    ILE  44           H        ILE  44  -1.720   5.662  -4.316
  299    HA   ILE  44           HA       ILE  44  -3.788   4.271  -2.755
  300    HB   ILE  44           HB       ILE  44  -2.387   6.917  -2.355
  301   1HG1  ILE  44          2HG1      ILE  44  -1.129   4.859  -1.773
  302   2HG1  ILE  44          1HG1      ILE  44  -1.420   5.914  -0.394
  303   1HG2  ILE  44          1HG2      ILE  44  -4.221   5.869  -0.271
  304   2HG2  ILE  44          2HG2      ILE  44  -4.904   6.749  -1.637
  305   3HG2  ILE  44          3HG2      ILE  44  -3.705   7.520  -0.602
  306   1HD1  ILE  44          1HD1      ILE  44  -3.183   4.480   0.386
  307   2HD1  ILE  44          2HD1      ILE  44  -1.723   3.529   0.121
  308   3HD1  ILE  44          3HD1      ILE  44  -3.042   3.466  -1.050
  309    H    GLU  45           H        GLU  45  -5.706   4.295  -3.877
  310    HA   GLU  45           HA       GLU  45  -6.658   6.915  -4.783
  311   1HB   GLU  45          2HB       GLU  45  -6.299   5.760  -6.793
  312   2HB   GLU  45          1HB       GLU  45  -6.928   4.250  -6.154
  313   1HG   GLU  45          2HG       GLU  45  -9.178   5.239  -6.105
  314   2HG   GLU  45          1HG       GLU  45  -8.523   6.729  -6.779
  315    H    MET  46           H        MET  46  -8.686   7.454  -4.424
  316    HA   MET  46           HA       MET  46 -10.288   5.798  -2.594
  317   1HB   MET  46          2HB       MET  46 -10.292   8.793  -3.022
  318   2HB   MET  46          1HB       MET  46 -11.399   7.940  -1.966
  319   1HG   MET  46          2HG       MET  46  -9.944   8.507  -0.375
  320   2HG   MET  46          1HG       MET  46  -9.028   7.128  -0.958
  321   1HE   MET  46          1HE       MET  46  -7.091   8.224  -3.562
  322   2HE   MET  46          2HE       MET  46  -7.153   7.065  -2.235
  323   3HE   MET  46          3HE       MET  46  -5.911   8.314  -2.257
  324    H    ASP  47           H        ASP  47 -12.302   5.210  -3.154
  325    HA   ASP  47           HA       ASP  47 -13.160   5.105  -5.757
  326   1HB   ASP  47          2HB       ASP  47 -14.889   5.175  -3.277
  327   2HB   ASP  47          1HB       ASP  47 -15.407   4.605  -4.862
  328    H    ASP  48           H        ASP  48 -13.378   7.760  -3.569
  329    HA   ASP  48           HA       ASP  48 -15.478   9.189  -4.782
  330   1HB   ASP  48          2HB       ASP  48 -13.108  10.224  -3.212
  331   2HB   ASP  48          1HB       ASP  48 -14.555  11.152  -3.599
  332    H    GLY  49           H        GLY  49 -12.428   8.424  -5.979
  333   1HA   GLY  49          2HA       GLY  49 -11.851   8.952  -8.230
  334   2HA   GLY  49          1HA       GLY  49 -12.716  10.471  -8.064
  335    H    ARG  50           H        ARG  50 -10.642   9.465  -5.504
  336    HA   ARG  50           HA       ARG  50  -8.746  11.591  -6.252
  337   1HB   ARG  50          2HB       ARG  50  -9.279  10.319  -3.565
  338   2HB   ARG  50          1HB       ARG  50  -8.086  11.574  -3.863
  339   1HG   ARG  50          2HG       ARG  50  -9.864  13.111  -4.518
  340   2HG   ARG  50          1HG       ARG  50 -11.063  11.849  -4.236
  341   1HD   ARG  50          2HD       ARG  50 -10.401  11.754  -1.878
  342   2HD   ARG  50          1HD       ARG  50  -9.215  13.026  -2.161
  343    HE   ARG  50           HE       ARG  50 -11.980  13.375  -1.683
  344   1HH1  ARG  50          1HH1      ARG  50  -9.336  14.675  -3.556
  345   2HH1  ARG  50          2HH1      ARG  50 -10.060  16.238  -3.723
  346   1HH2  ARG  50          1HH2      ARG  50 -12.928  15.431  -1.899
  347   2HH2  ARG  50          2HH2      ARG  50 -12.097  16.669  -2.780
  348    H    GLU  51           H        GLU  51  -6.485  11.200  -6.162
  349    HA   GLU  51           HA       GLU  51  -5.636   8.448  -5.697
  350   1HB   GLU  51          2HB       GLU  51  -5.109   9.874  -8.311
  351   2HB   GLU  51          1HB       GLU  51  -4.498   8.287  -7.858
  352   1HG   GLU  51          2HG       GLU  51  -6.768   7.417  -7.792
  353   2HG   GLU  51          1HG       GLU  51  -7.399   9.011  -8.203
  354    H    ILE  52           H        ILE  52  -3.513   8.219  -5.125
  355    HA   ILE  52           HA       ILE  52  -1.587  10.336  -5.409
  356    HB   ILE  52           HB       ILE  52  -2.823  11.136  -3.448
  357   1HG1  ILE  52          2HG1      ILE  52  -0.081  10.034  -2.783
  358   2HG1  ILE  52          1HG1      ILE  52  -0.412  11.567  -3.591
  359   1HG2  ILE  52          1HG2      ILE  52  -1.910   8.845  -1.797
  360   2HG2  ILE  52          2HG2      ILE  52  -3.339   8.628  -2.808
  361   3HG2  ILE  52          3HG2      ILE  52  -3.304   9.905  -1.592
  362   1HD1  ILE  52          1HD1      ILE  52  -1.523  12.393  -1.572
  363   2HD1  ILE  52          2HD1      ILE  52   0.139  11.905  -1.234
  364   3HD1  ILE  52          3HD1      ILE  52  -1.202  10.859  -0.764
  365    H    THR  53           H        THR  53   0.502   9.534  -5.288
  366    HA   THR  53           HA       THR  53   0.716   6.642  -4.991
  367    HB   THR  53           HB       THR  53   1.698   7.638  -6.975
  368    HG1  THR  53           1HG      THR  53   2.795   5.852  -6.216
  369   1HG2  THR  53          1HG2      THR  53   2.295   9.824  -6.365
  370   2HG2  THR  53          2HG2      THR  53   3.807   8.987  -6.711
  371   3HG2  THR  53          3HG2      THR  53   3.312   9.259  -5.040
  372    H    VAL  54           H        VAL  54   2.244   5.597  -3.671
  373    HA   VAL  54           HA       VAL  54   3.728   7.144  -1.715
  374    HB   VAL  54           HB       VAL  54   1.632   5.165  -0.807
  375   1HG1  VAL  54          1HG1      VAL  54   3.655   5.186   0.589
  376   2HG1  VAL  54          2HG1      VAL  54   2.261   5.841   1.448
  377   3HG1  VAL  54          3HG1      VAL  54   3.487   6.929   0.796
  378   1HG2  VAL  54          1HG2      VAL  54   0.559   7.148   0.232
  379   2HG2  VAL  54          2HG2      VAL  54   0.566   7.204  -1.531
  380   3HG2  VAL  54          3HG2      VAL  54   1.717   8.176  -0.614
  381    HA   PRO  55           HA       PRO  55   6.432   3.686  -2.810
  382   1HB   PRO  55          2HB       PRO  55   8.044   4.887  -0.621
  383   2HB   PRO  55          1HB       PRO  55   8.515   4.480  -2.275
  384   1HG   PRO  55          2HG       PRO  55   8.133   7.013  -1.561
  385   2HG   PRO  55          1HG       PRO  55   7.606   6.429  -3.152
  386   1HD   PRO  55          2HD       PRO  55   5.982   6.965  -0.696
  387   2HD   PRO  55          1HD       PRO  55   5.596   7.298  -2.395
  388    H    LYS  56           H        LYS  56   6.029   1.697  -2.087
  389    HA   LYS  56           HA       LYS  56   5.549   1.270   0.772
  390   1HB   LYS  56          2HB       LYS  56   4.648  -0.941   0.059
  391   2HB   LYS  56          1HB       LYS  56   3.771   0.437  -0.567
  392   1HG   LYS  56          2HG       LYS  56   5.066   0.180  -2.696
  393   2HG   LYS  56          1HG       LYS  56   5.713  -1.321  -2.039
  394   1HD   LYS  56          2HD       LYS  56   2.809  -0.694  -2.573
  395   2HD   LYS  56          1HD       LYS  56   3.836  -1.783  -3.504
  396   1HE   LYS  56          2HE       LYS  56   2.540  -3.166  -2.106
  397   2HE   LYS  56          1HE       LYS  56   4.138  -3.105  -1.369
  398   1HZ   LYS  56          1HZ       LYS  56   2.436  -1.037  -0.386
  399   2HZ   LYS  56          2HZ       LYS  56   3.299  -2.213   0.469
  400   3HZ   LYS  56          3HZ       LYS  56   1.762  -2.567  -0.136
  401    H    GLY  57           H        GLY  57   8.133   1.052  -1.282
  402   1HA   GLY  57          2HA       GLY  57   9.265  -1.430  -0.945
  403   2HA   GLY  57          1HA       GLY  57  10.199   0.058  -0.998
  404    H    ILE  58           H        ILE  58   8.832   1.032   1.464
  405    HA   ILE  58           HA       ILE  58   9.594  -0.798   3.539
  406    HB   ILE  58           HB       ILE  58  10.992   1.879   3.405
  407   1HG1  ILE  58          2HG1      ILE  58  13.081   0.354   3.256
  408   2HG1  ILE  58          1HG1      ILE  58  11.960  -0.886   2.705
  409   1HG2  ILE  58          1HG2      ILE  58  11.593  -0.386   5.281
  410   2HG2  ILE  58          2HG2      ILE  58  10.386   0.842   5.653
  411   3HG2  ILE  58          3HG2      ILE  58  12.068   1.308   5.405
  412   1HD1  ILE  58          1HD1      ILE  58  11.384   1.366   1.167
  413   2HD1  ILE  58          2HD1      ILE  58  12.230  -0.095   0.659
  414   3HD1  ILE  58          3HD1      ILE  58  13.143   1.290   1.257
  415    H    ALA  59           H        ALA  59   7.133  -0.234   3.334
  416    HA   ALA  59           HA       ALA  59   6.640   1.929   5.252
  417   1HB   ALA  59          1HB       ALA  59   6.158   2.778   3.018
  418   2HB   ALA  59          2HB       ALA  59   4.706   2.703   4.015
  419   3HB   ALA  59          3HB       ALA  59   4.992   1.477   2.780
  420    H    VAL  60           H        VAL  60   5.824   1.010   7.044
  421    HA   VAL  60           HA       VAL  60   4.225  -1.384   6.926
  422    HB   VAL  60           HB       VAL  60   5.668  -1.004   8.870
  423   1HG1  VAL  60          1HG1      VAL  60   3.924   1.021  10.086
  424   2HG1  VAL  60          2HG1      VAL  60   4.894   1.594   8.728
  425   3HG1  VAL  60          3HG1      VAL  60   5.680   0.861  10.126
  426   1HG2  VAL  60          1HG2      VAL  60   3.823  -2.443   9.271
  427   2HG2  VAL  60          2HG2      VAL  60   2.700  -1.087   9.399
  428   3HG2  VAL  60          3HG2      VAL  60   3.911  -1.353  10.655
  429    H    PHE  61           H        PHE  61   2.052  -1.526   6.817
  430    HA   PHE  61           HA       PHE  61   0.402   0.674   7.693
  431   1HB   PHE  61          2HB       PHE  61  -0.685   1.075   5.557
  432   2HB   PHE  61          1HB       PHE  61   1.042   1.380   5.418
  433    HD1  PHE  61           1HD      PHE  61   2.187   0.495   3.640
  434    HD2  PHE  61           2HD      PHE  61  -1.451  -1.341   4.867
  435    HE1  PHE  61           1HE      PHE  61   2.303  -1.020   1.708
  436    HE2  PHE  61           2HE      PHE  61  -1.338  -2.862   2.939
  437    HZ   PHE  61           HZ       PHE  61   0.540  -2.703   1.356
  438    H    HIS  62           H        HIS  62  -1.933   0.197   7.356
  439    HA   HIS  62           HA       HIS  62  -2.497  -2.679   7.226
  440   1HB   HIS  62          2HB       HIS  62  -3.780  -0.931   9.315
  441   2HB   HIS  62          1HB       HIS  62  -3.692  -2.688   9.258
  442    HD1  HIS  62           1HD      HIS  62  -0.761  -3.252   9.100
  443    HD2  HIS  62           2HD      HIS  62  -2.307  -0.188  11.439
  444    HE1  HIS  62           1HE      HIS  62   0.973  -2.816  10.866
  445    HE2  HIS  62           2HE      HIS  62  -0.013  -1.005  12.310
  446    H    PHE  63           H        PHE  63  -4.090  -3.017   5.768
  447    HA   PHE  63           HA       PHE  63  -5.735  -0.722   5.012
  448   1HB   PHE  63          2HB       PHE  63  -6.245  -1.898   2.972
  449   2HB   PHE  63          1HB       PHE  63  -4.509  -1.955   3.238
  450    HD1  PHE  63           1HD      PHE  63  -3.440  -3.948   2.901
  451    HD2  PHE  63           2HD      PHE  63  -7.567  -3.989   3.938
  452    HE1  PHE  63           1HE      PHE  63  -3.485  -6.389   2.609
  453    HE2  PHE  63           2HE      PHE  63  -7.618  -6.429   3.655
  454    HZ   PHE  63           HZ       PHE  63  -5.577  -7.634   2.989
  455    H    ARG  64           H        ARG  64  -7.935  -0.716   4.973
  456    HA   ARG  64           HA       ARG  64  -9.231  -2.821   6.575
  457   1HB   ARG  64          2HB       ARG  64  -9.170  -0.373   7.374
  458   2HB   ARG  64          1HB       ARG  64 -10.320  -0.053   6.088
  459   1HG   ARG  64          2HG       ARG  64 -10.721  -1.926   8.410
  460   2HG   ARG  64          1HG       ARG  64 -11.460  -0.341   8.199
  461   1HD   ARG  64          2HD       ARG  64 -12.504  -1.231   6.092
  462   2HD   ARG  64          1HD       ARG  64 -11.910  -2.825   6.561
  463    HE   ARG  64           HE       ARG  64 -13.675  -2.975   7.981
  464   1HH1  ARG  64          1HH1      ARG  64 -13.054   0.411   7.402
  465   2HH1  ARG  64          2HH1      ARG  64 -14.364   0.947   8.400
  466   1HH2  ARG  64          1HH2      ARG  64 -15.399  -2.268   9.291
  467   2HH2  ARG  64          2HH2      ARG  64 -15.695  -0.570   9.469
  468    H    THR  65           H        THR  65 -10.452  -4.180   5.431
  469    HA   THR  65           HA       THR  65 -11.296  -3.515   2.754
  470    HB   THR  65           HB       THR  65 -11.784  -5.992   4.412
  471    HG1  THR  65           1HG      THR  65  -9.567  -5.482   3.831
  472   1HG2  THR  65          1HG2      THR  65 -13.339  -6.329   2.797
  473   2HG2  THR  65          2HG2      THR  65 -11.913  -6.934   1.957
  474   3HG2  THR  65          3HG2      THR  65 -12.508  -5.308   1.626
  475    HA   PRO  66           HA       PRO  66 -15.207  -1.622   3.722
  476   1HB   PRO  66          2HB       PRO  66 -15.982  -3.185   1.287
  477   2HB   PRO  66          1HB       PRO  66 -16.334  -1.502   1.700
  478   1HG   PRO  66          2HG       PRO  66 -14.404  -2.087  -0.031
  479   2HG   PRO  66          1HG       PRO  66 -14.196  -0.782   1.151
  480   1HD   PRO  66          2HD       PRO  66 -12.983  -3.493   1.090
  481   2HD   PRO  66          1HD       PRO  66 -12.338  -1.980   1.758
  482    H    GLN  67           H        GLN  67 -14.811  -5.059   3.158
  483    HA   GLN  67           HA       GLN  67 -17.386  -5.924   3.844
  484   1HB   GLN  67          2HB       GLN  67 -15.728  -7.394   2.802
  485   2HB   GLN  67          1HB       GLN  67 -14.735  -7.321   4.250
  486   1HG   GLN  67          2HG       GLN  67 -16.504  -8.422   5.522
  487   2HG   GLN  67          1HG       GLN  67 -17.503  -8.490   4.073
  488   1HE2  GLN  67          1HE2      GLN  67 -14.412  -8.944   3.034
  489   2HE2  GLN  67          2HE2      GLN  67 -14.346 -10.668   3.075
  490    H    GLY  68           H        GLY  68 -14.966  -4.479   5.753
  491   1HA   GLY  68          2HA       GLY  68 -15.501  -3.690   7.943
  492   2HA   GLY  68          1HA       GLY  68 -16.512  -5.108   8.169
  493    H    GLU  69           H        GLU  69 -13.337  -5.370   6.760
  494    HA   GLU  69           HA       GLU  69 -12.345  -6.471   9.310
  495   1HB   GLU  69          2HB       GLU  69 -11.150  -8.218   8.055
  496   2HB   GLU  69          1HB       GLU  69 -12.893  -8.328   7.846
  497   1HG   GLU  69          2HG       GLU  69 -12.705  -7.245   5.669
  498   2HG   GLU  69          1HG       GLU  69 -10.958  -7.128   5.879
  499    H    LEU  70           H        LEU  70 -10.094  -6.370   9.665
  500    HA   LEU  70           HA       LEU  70  -8.721  -4.318   8.055
  501   1HB   LEU  70          2HB       LEU  70  -8.752  -4.865  10.998
  502   2HB   LEU  70          1HB       LEU  70  -7.355  -4.096  10.272
  503    HG   LEU  70           HG       LEU  70 -10.158  -3.007  10.029
  504   1HD1  LEU  70          1HD1      LEU  70  -7.976  -2.156  11.935
  505   2HD1  LEU  70          2HD1      LEU  70  -9.406  -3.085  12.389
  506   3HD1  LEU  70          3HD1      LEU  70  -9.580  -1.440  11.776
  507   1HD2  LEU  70          1HD2      LEU  70  -7.514  -1.615   9.653
  508   2HD2  LEU  70          2HD2      LEU  70  -9.120  -1.041   9.207
  509   3HD2  LEU  70          3HD2      LEU  70  -8.387  -2.385   8.329
  510    H    VAL  71           H        VAL  71  -6.504  -4.583   7.628
  511    HA   VAL  71           HA       VAL  71  -5.345  -7.194   8.303
  512    HB   VAL  71           HB       VAL  71  -5.332  -6.028   5.520
  513   1HG1  VAL  71          1HG1      VAL  71  -4.412  -8.378   5.018
  514   2HG1  VAL  71          2HG1      VAL  71  -4.042  -8.443   6.741
  515   3HG1  VAL  71          3HG1      VAL  71  -3.322  -7.190   5.731
  516   1HG2  VAL  71          1HG2      VAL  71  -6.782  -8.442   6.600
  517   2HG2  VAL  71          2HG2      VAL  71  -6.732  -7.940   4.910
  518   3HG2  VAL  71          3HG2      VAL  71  -7.525  -6.920   6.110
  519    H    GLU  72           H        GLU  72  -3.168  -7.183   8.646
  520    HA   GLU  72           HA       GLU  72  -1.881  -4.553   8.588
  521   1HB   GLU  72          2HB       GLU  72  -0.268  -5.512  10.183
  522   2HB   GLU  72          1HB       GLU  72  -1.922  -5.639  10.767
  523   1HG   GLU  72          2HG       GLU  72  -1.986  -7.982  10.075
  524   2HG   GLU  72          1HG       GLU  72  -0.326  -7.852   9.493
  525    H    ILE  73           H        ILE  73  -0.147  -4.129   7.340
  526    HA   ILE  73           HA       ILE  73   1.174  -6.378   5.985
  527    HB   ILE  73           HB       ILE  73   0.414  -3.788   4.624
  528   1HG1  ILE  73          2HG1      ILE  73  -0.991  -5.456   3.206
  529   2HG1  ILE  73          1HG1      ILE  73  -0.854  -6.515   4.605
  530   1HG2  ILE  73          1HG2      ILE  73   1.681  -4.392   2.884
  531   2HG2  ILE  73          2HG2      ILE  73   1.189  -6.083   2.989
  532   3HG2  ILE  73          3HG2      ILE  73   2.480  -5.474   4.026
  533   1HD1  ILE  73          1HD1      ILE  73  -2.224  -3.855   4.402
  534   2HD1  ILE  73          2HD1      ILE  73  -1.803  -4.567   5.955
  535   3HD1  ILE  73          3HD1      ILE  73  -2.900  -5.415   4.869
  536    H    ASP  74           H        ASP  74   3.360  -6.208   5.819
  537    HA   ASP  74           HA       ASP  74   4.562  -3.850   7.077
  538   1HB   ASP  74          2HB       ASP  74   5.746  -6.582   6.524
  539   2HB   ASP  74          1HB       ASP  74   6.570  -5.263   7.351
  540    H    GLY  75           H        GLY  75   4.826  -2.357   5.525
  541   1HA   GLY  75          2HA       GLY  75   5.437  -2.769   2.844
  542   2HA   GLY  75          1HA       GLY  75   5.737  -1.291   3.720
  543    H    ARG  76           H        ARG  76   7.495  -3.230   5.513
  544    HA   ARG  76           HA       ARG  76   9.942  -2.481   4.293
  545   1HB   ARG  76          2HB       ARG  76   9.772  -2.650   6.711
  546   2HB   ARG  76          1HB       ARG  76   9.358  -4.354   6.591
  547   1HG   ARG  76          2HG       ARG  76  11.655  -4.105   7.277
  548   2HG   ARG  76          1HG       ARG  76  11.585  -4.812   5.662
  549   1HD   ARG  76          2HD       ARG  76  12.020  -2.590   4.694
  550   2HD   ARG  76          1HD       ARG  76  12.137  -1.923   6.322
  551    HE   ARG  76           HE       ARG  76  13.940  -4.048   6.117
  552   1HH1  ARG  76          1HH1      ARG  76  13.472  -0.847   4.805
  553   2HH1  ARG  76          2HH1      ARG  76  15.163  -0.564   4.563
  554   1HH2  ARG  76          1HH2      ARG  76  16.164  -3.676   5.800
  555   2HH2  ARG  76          2HH2      ARG  76  16.691  -2.170   5.129
  556    H    ALA  77           H        ALA  77   7.892  -5.211   4.031
  557    HA   ALA  77           HA       ALA  77   9.972  -6.833   2.820
  558   1HB   ALA  77          1HB       ALA  77   8.796  -8.664   3.398
  559   2HB   ALA  77          2HB       ALA  77   7.246  -7.919   3.007
  560   3HB   ALA  77          3HB       ALA  77   8.038  -7.555   4.541
  561    H    LEU  78           H        LEU  78   7.913  -4.502   1.797
  562    HA   LEU  78           HA       LEU  78   7.142  -5.828  -0.684
  563   1HB   LEU  78          2HB       LEU  78   6.461  -3.134   0.476
  564   2HB   LEU  78          1HB       LEU  78   5.993  -3.623  -1.141
  565    HG   LEU  78           HG       LEU  78   4.153  -3.917   0.441
  566   1HD1  LEU  78          1HD1      LEU  78   4.320  -5.427  -1.473
  567   2HD1  LEU  78          2HD1      LEU  78   3.610  -6.234  -0.077
  568   3HD1  LEU  78          3HD1      LEU  78   5.290  -6.542  -0.511
  569   1HD2  LEU  78          1HD2      LEU  78   6.003  -4.570   2.274
  570   2HD2  LEU  78          2HD2      LEU  78   5.449  -6.180   1.815
  571   3HD2  LEU  78          3HD2      LEU  78   4.297  -4.990   2.420
  572    H    VAL  79           H        VAL  79   9.944  -5.124  -0.002
  573    HA   VAL  79           HA       VAL  79  10.985  -2.953  -1.317
  574    HB   VAL  79           HB       VAL  79  12.344  -4.539  -0.016
  575   1HG1  VAL  79          1HG1      VAL  79  13.160  -6.603  -1.225
  576   2HG1  VAL  79          2HG1      VAL  79  11.833  -6.351  -2.362
  577   3HG1  VAL  79          3HG1      VAL  79  11.490  -6.649  -0.658
  578   1HG2  VAL  79          1HG2      VAL  79  13.416  -4.346  -2.825
  579   2HG2  VAL  79          2HG2      VAL  79  14.330  -4.380  -1.316
  580   3HG2  VAL  79          3HG2      VAL  79  13.341  -2.975  -1.718
  581    H    ALA  80           H        ALA  80  12.142  -2.865  -3.416
  582    HA   ALA  80           HA       ALA  80  10.517  -3.123  -5.598
  583   1HB   ALA  80          1HB       ALA  80  12.266  -2.318  -6.772
  584   2HB   ALA  80          2HB       ALA  80  13.377  -3.541  -6.159
  585   3HB   ALA  80          3HB       ALA  80  12.991  -2.130  -5.176
  586    H    ARG  81           H        ARG  81  10.778  -4.577  -7.552
  587    HA   ARG  81           HA       ARG  81  11.206  -7.339  -6.627
  588   1HB   ARG  81          2HB       ARG  81   9.176  -6.260  -8.566
  589   2HB   ARG  81          1HB       ARG  81   9.509  -7.976  -8.377
  590   1HG   ARG  81          2HG       ARG  81   8.876  -7.830  -6.013
  591   2HG   ARG  81          1HG       ARG  81   8.507  -6.119  -6.226
  592   1HD   ARG  81          2HD       ARG  81   6.470  -7.441  -6.325
  593   2HD   ARG  81          1HD       ARG  81   6.802  -6.710  -7.896
  594    HE   ARG  81           HE       ARG  81   7.940  -9.242  -7.917
  595   1HH1  ARG  81          1HH1      ARG  81   4.755  -7.840  -7.645
  596   2HH1  ARG  81          2HH1      ARG  81   3.962  -9.186  -8.392
  597   1HH2  ARG  81          1HH2      ARG  81   6.897 -11.014  -8.899
  598   2HH2  ARG  81          2HH2      ARG  81   5.178 -10.987  -9.103
  599    HA   PRO  82           HA       PRO  82  14.275  -7.258  -9.924
  600   1HB   PRO  82          2HB       PRO  82  15.526  -9.537  -9.269
  601   2HB   PRO  82          1HB       PRO  82  15.725  -8.061  -8.316
  602   1HG   PRO  82          2HG       PRO  82  13.983 -10.439  -7.785
  603   2HG   PRO  82          1HG       PRO  82  15.006  -9.528  -6.659
  604   1HD   PRO  82          2HD       PRO  82  12.305  -9.165  -6.883
  605   2HD   PRO  82          1HD       PRO  82  13.426  -7.897  -6.353
  606    H    GLU  83           H        GLU  83  11.555  -9.128  -9.640
  607    HA   GLU  83           HA       GLU  83  12.261 -10.909 -11.855
  608   1HB   GLU  83          2HB       GLU  83  11.227 -11.951  -9.899
  609   2HB   GLU  83          1HB       GLU  83   9.835 -10.889 -10.054
  610   1HG   GLU  83          2HG       GLU  83   9.306 -11.893 -12.215
  611   2HG   GLU  83          1HG       GLU  83  10.704 -12.956 -12.062
  612    H    GLU  84           H        GLU  84  10.678  -7.963 -11.261
  613    HA   GLU  84           HA       GLU  84   9.085  -8.221 -13.715
  614   1HB   GLU  84          2HB       GLU  84   8.864  -6.253 -11.437
  615   2HB   GLU  84          1HB       GLU  84   7.892  -6.188 -12.901
  616   1HG   GLU  84          2HG       GLU  84   6.988  -8.413 -12.372
  617   2HG   GLU  84          1HG       GLU  84   7.920  -8.415 -10.876
  618    H    ARG  85           H        ARG  85  11.653  -6.367 -12.206
  619    HA   ARG  85           HA       ARG  85  12.676  -5.480 -14.665
  620   1HB   ARG  85          2HB       ARG  85  10.704  -4.047 -14.716
  621   2HB   ARG  85          1HB       ARG  85  11.111  -3.398 -13.135
  622   1HG   ARG  85          2HG       ARG  85  11.720  -1.802 -14.801
  623   2HG   ARG  85          1HG       ARG  85  13.196  -2.474 -14.108
  624   1HD   ARG  85          2HD       ARG  85  11.957  -3.475 -16.664
  625   2HD   ARG  85          1HD       ARG  85  13.179  -2.205 -16.616
  626    HE   ARG  85           HE       ARG  85  14.186  -4.378 -15.203
  627   1HH1  ARG  85          1HH1      ARG  85  13.233  -3.614 -18.471
  628   2HH1  ARG  85          2HH1      ARG  85  14.358  -4.717 -19.190
  629   1HH2  ARG  85          1HH2      ARG  85  15.665  -5.828 -16.144
  630   2HH2  ARG  85          2HH2      ARG  85  15.740  -5.975 -17.868
  631    H    ILE  86           H        ILE  86  12.498  -5.105 -11.185
  632    HA   ILE  86           HA       ILE  86  14.688  -3.445 -10.771
  633    HB   ILE  86           HB       ILE  86  13.797  -5.701  -9.002
  634   1HG1  ILE  86          2HG1      ILE  86  11.983  -4.159  -9.525
  635   2HG1  ILE  86          1HG1      ILE  86  12.494  -3.964  -7.858
  636   1HG2  ILE  86          1HG2      ILE  86  14.801  -4.261  -7.210
  637   2HG2  ILE  86          2HG2      ILE  86  15.533  -3.298  -8.493
  638   3HG2  ILE  86          3HG2      ILE  86  15.959  -5.001  -8.313
  639   1HD1  ILE  86          1HD1      ILE  86  13.325  -2.181 -10.128
  640   2HD1  ILE  86          2HD1      ILE  86  13.709  -1.960  -8.421
  641   3HD1  ILE  86          3HD1      ILE  86  12.040  -1.830  -8.974
  Start of MODEL    8
    1    H    ARG   9           H        ARG   9 -10.771 -15.687  -3.322
    2    HA   ARG   9           HA       ARG   9 -10.472 -13.289  -1.652
    3   1HB   ARG   9          2HB       ARG   9  -8.280 -14.344  -1.796
    4   2HB   ARG   9          1HB       ARG   9  -8.397 -14.398  -3.550
    5   1HG   ARG   9          2HG       ARG   9  -8.388 -11.965  -3.637
    6   2HG   ARG   9          1HG       ARG   9  -8.309 -11.894  -1.878
    7   1HD   ARG   9          2HD       ARG   9  -6.229 -13.139  -3.675
    8   2HD   ARG   9          1HD       ARG   9  -6.114 -11.544  -2.938
    9    HE   ARG   9           HE       ARG   9  -5.583 -12.531  -0.931
   10   1HH1  ARG   9          1HH1      ARG   9  -6.590 -14.993  -3.195
   11   2HH1  ARG   9          2HH1      ARG   9  -6.201 -16.301  -2.131
   12   1HH2  ARG   9          1HH2      ARG   9  -5.062 -14.251   0.457
   13   2HH2  ARG   9          2HH2      ARG   9  -5.331 -15.881  -0.061
   14    H    HIS  10           H        HIS  10 -11.084 -11.430  -2.583
   15    HA   HIS  10           HA       HIS  10 -11.635 -11.436  -5.474
   16   1HB   HIS  10          2HB       HIS  10 -13.744 -11.690  -4.263
   17   2HB   HIS  10          1HB       HIS  10 -13.374 -10.275  -3.286
   18    HD1  HIS  10           1HD      HIS  10 -13.124  -7.975  -4.787
   19    HD2  HIS  10           2HD      HIS  10 -15.241 -11.142  -6.446
   20    HE1  HIS  10           1HE      HIS  10 -14.499  -6.970  -6.638
   21    HE2  HIS  10           2HE      HIS  10 -15.692  -8.923  -7.693
   22    H    GLU  11           H        GLU  11  -9.567 -10.411  -5.673
   23    HA   GLU  11           HA       GLU  11  -8.085  -8.686  -5.738
   24   1HB   GLU  11          2HB       GLU  11  -9.028  -6.541  -6.499
   25   2HB   GLU  11          1HB       GLU  11  -9.681  -7.909  -7.388
   26   1HG   GLU  11          2HG       GLU  11 -11.725  -7.806  -6.133
   27   2HG   GLU  11          1HG       GLU  11 -11.075  -6.528  -5.108
   28    H    LEU  12           H        LEU  12  -7.951  -6.133  -4.928
   29    HA   LEU  12           HA       LEU  12  -8.707  -6.108  -2.092
   30   1HB   LEU  12          2HB       LEU  12  -6.374  -6.988  -2.401
   31   2HB   LEU  12          1HB       LEU  12  -5.938  -5.434  -3.082
   32    HG   LEU  12           HG       LEU  12  -6.505  -4.348  -0.937
   33   1HD1  LEU  12          1HD1      LEU  12  -6.832  -5.799   1.048
   34   2HD1  LEU  12          2HD1      LEU  12  -7.000  -7.180  -0.035
   35   3HD1  LEU  12          3HD1      LEU  12  -8.172  -5.864  -0.098
   36   1HD2  LEU  12          1HD2      LEU  12  -4.622  -5.350   0.374
   37   2HD2  LEU  12          2HD2      LEU  12  -4.218  -4.914  -1.287
   38   3HD2  LEU  12          3HD2      LEU  12  -4.510  -6.603  -0.865
   39    H    ILE  13           H        ILE  13  -9.308  -4.624  -4.762
   40    HA   ILE  13           HA       ILE  13  -8.574  -1.902  -4.033
   41    HB   ILE  13           HB       ILE  13 -10.167  -2.882  -6.407
   42   1HG1  ILE  13          2HG1      ILE  13  -7.880  -3.759  -6.434
   43   2HG1  ILE  13          1HG1      ILE  13  -8.088  -2.537  -7.682
   44   1HG2  ILE  13          1HG2      ILE  13  -8.987  -0.198  -5.721
   45   2HG2  ILE  13          2HG2      ILE  13 -10.682  -0.596  -6.011
   46   3HG2  ILE  13          3HG2      ILE  13  -9.526  -0.640  -7.342
   47   1HD1  ILE  13          1HD1      ILE  13  -6.031  -2.020  -6.775
   48   2HD1  ILE  13          2HD1      ILE  13  -6.549  -2.385  -5.130
   49   3HD1  ILE  13          3HD1      ILE  13  -7.115  -0.917  -5.928
   50    H    GLY  14           H        GLY  14 -10.069  -0.255  -3.600
   51   1HA   GLY  14          2HA       GLY  14 -12.367   0.505  -3.429
   52   2HA   GLY  14          1HA       GLY  14 -12.830  -1.148  -3.060
   53    H    LEU  15           H        LEU  15 -10.169  -0.973  -1.325
   54    HA   LEU  15           HA       LEU  15 -11.571   0.110   1.022
   55   1HB   LEU  15          2HB       LEU  15  -9.914  -1.354   2.298
   56   2HB   LEU  15          1HB       LEU  15 -11.220  -2.150   1.442
   57    HG   LEU  15           HG       LEU  15  -9.691  -2.749  -0.372
   58   1HD1  LEU  15          1HD1      LEU  15  -8.145  -0.924  -0.320
   59   2HD1  LEU  15          2HD1      LEU  15  -7.254  -2.416  -0.037
   60   3HD1  LEU  15          3HD1      LEU  15  -7.628  -1.344   1.313
   61   1HD2  LEU  15          1HD2      LEU  15  -9.315  -3.595   2.419
   62   2HD2  LEU  15          2HD2      LEU  15  -8.014  -4.035   1.311
   63   3HD2  LEU  15          3HD2      LEU  15  -9.669  -4.549   0.977
   64    H    SER  16           H        SER  16 -10.106   0.930   2.771
   65    HA   SER  16           HA       SER  16  -8.261   2.842   1.595
   66   1HB   SER  16          2HB       SER  16  -9.256   2.552   4.443
   67   2HB   SER  16          1HB       SER  16  -8.266   3.881   3.838
   68    HG   SER  16           HG       SER  16 -10.956   3.287   3.342
   69    H    VAL  17           H        VAL  17  -6.142   3.237   2.555
   70    HA   VAL  17           HA       VAL  17  -4.943   0.867   3.816
   71    HB   VAL  17           HB       VAL  17  -3.626   2.444   1.607
   72   1HG1  VAL  17          1HG1      VAL  17  -2.864  -0.181   2.877
   73   2HG1  VAL  17          2HG1      VAL  17  -2.109   1.376   3.222
   74   3HG1  VAL  17          3HG1      VAL  17  -1.978   0.669   1.610
   75   1HG2  VAL  17          1HG2      VAL  17  -5.265  -0.056   1.523
   76   2HG2  VAL  17          2HG2      VAL  17  -3.968   0.201   0.356
   77   3HG2  VAL  17          3HG2      VAL  17  -5.309   1.346   0.451
   78    H    ARG  18           H        ARG  18  -4.339   1.581   5.770
   79    HA   ARG  18           HA       ARG  18  -3.371   4.313   6.086
   80   1HB   ARG  18          2HB       ARG  18  -4.092   2.167   8.079
   81   2HB   ARG  18          1HB       ARG  18  -3.391   3.710   8.543
   82   1HG   ARG  18          2HG       ARG  18  -5.791   3.745   8.828
   83   2HG   ARG  18          1HG       ARG  18  -5.306   4.875   7.564
   84   1HD   ARG  18          2HD       ARG  18  -5.983   3.315   5.851
   85   2HD   ARG  18          1HD       ARG  18  -6.345   2.087   7.062
   86    HE   ARG  18           HE       ARG  18  -8.057   4.163   6.203
   87   1HH1  ARG  18          1HH1      ARG  18  -7.124   2.395   9.066
   88   2HH1  ARG  18          2HH1      ARG  18  -8.614   2.703   9.891
   89   1HH2  ARG  18          1HH2      ARG  18 -10.019   4.561   7.286
   90   2HH2  ARG  18          2HH2      ARG  18 -10.259   3.929   8.881
   91    H    ILE  19           H        ILE  19  -1.291   4.795   6.086
   92    HA   ILE  19           HA       ILE  19   0.682   2.659   6.331
   93    HB   ILE  19           HB       ILE  19   0.990   5.537   5.459
   94   1HG1  ILE  19          2HG1      ILE  19   1.429   4.555   3.236
   95   2HG1  ILE  19          1HG1      ILE  19   1.109   2.953   3.887
   96   1HG2  ILE  19          1HG2      ILE  19   2.971   3.435   6.078
   97   2HG2  ILE  19          2HG2      ILE  19   3.108   5.191   6.170
   98   3HG2  ILE  19          3HG2      ILE  19   3.249   4.376   4.613
   99   1HD1  ILE  19          1HD1      ILE  19  -0.963   5.121   4.005
  100   2HD1  ILE  19          2HD1      ILE  19  -1.184   3.376   4.113
  101   3HD1  ILE  19          3HD1      ILE  19  -0.760   4.116   2.569
  102    H    ALA  20           H        ALA  20   1.765   2.324   8.153
  103    HA   ALA  20           HA       ALA  20   1.530   4.222  10.335
  104   1HB   ALA  20          1HB       ALA  20   1.655   2.430  11.645
  105   2HB   ALA  20          2HB       ALA  20   3.185   1.934  10.923
  106   3HB   ALA  20          3HB       ALA  20   1.662   1.445  10.183
  107    H    ARG  21           H        ARG  21   3.838   3.261   7.980
  108    HA   ARG  21           HA       ARG  21   5.621   5.350   8.706
  109   1HB   ARG  21          2HB       ARG  21   6.312   3.692  10.376
  110   2HB   ARG  21          1HB       ARG  21   6.582   2.515   9.101
  111   1HG   ARG  21          2HG       ARG  21   8.683   3.435   9.808
  112   2HG   ARG  21          1HG       ARG  21   8.333   3.966   8.162
  113   1HD   ARG  21          2HD       ARG  21   9.203   5.818   9.474
  114   2HD   ARG  21          1HD       ARG  21   7.521   6.114   9.040
  115    HE   ARG  21           HE       ARG  21   7.049   6.207  11.259
  116   1HH1  ARG  21          1HH1      ARG  21   9.979   4.350  10.866
  117   2HH1  ARG  21          2HH1      ARG  21  10.198   4.102  12.563
  118   1HH2  ARG  21          1HH2      ARG  21   7.339   5.882  13.495
  119   2HH2  ARG  21          2HH2      ARG  21   8.702   4.973  14.056
  120    H    SER  22           H        SER  22   7.183   5.751   7.119
  121    HA   SER  22           HA       SER  22   7.168   4.007   4.770
  122   1HB   SER  22          2HB       SER  22   5.459   5.730   4.354
  123   2HB   SER  22          1HB       SER  22   6.664   6.988   4.636
  124    HG   SER  22           HG       SER  22   6.126   5.808   2.367
  125    H    VAL  23           H        VAL  23   8.873   4.613   3.185
  126    HA   VAL  23           HA       VAL  23  11.385   4.687   4.348
  127    HB   VAL  23           HB       VAL  23  11.003   3.878   2.072
  128   1HG1  VAL  23          1HG1      VAL  23   9.375   5.660   1.440
  129   2HG1  VAL  23          2HG1      VAL  23  10.610   5.347   0.219
  130   3HG1  VAL  23          3HG1      VAL  23  10.735   6.768   1.255
  131   1HG2  VAL  23          1HG2      VAL  23  12.987   4.863   1.009
  132   2HG2  VAL  23          2HG2      VAL  23  13.268   4.500   2.712
  133   3HG2  VAL  23          3HG2      VAL  23  12.973   6.163   2.201
  134    H    HIS  24           H        HIS  24   9.558   7.362   2.871
  135    HA   HIS  24           HA       HIS  24  11.560   9.238   3.925
  136   1HB   HIS  24          2HB       HIS  24  10.694   9.144   1.421
  137   2HB   HIS  24          1HB       HIS  24   9.380  10.109   2.079
  138    HD1  HIS  24           1HD      HIS  24  10.737  12.084   3.852
  139    HD2  HIS  24           2HD      HIS  24  12.385  10.869   0.241
  140    HE1  HIS  24           1HE      HIS  24  12.307  13.927   3.179
  141    HE2  HIS  24           2HE      HIS  24  13.364  13.125   1.038
  142    H    ARG  25           H        ARG  25  11.022  10.763   5.411
  143    HA   ARG  25           HA       ARG  25   8.793  10.344   7.058
  144   1HB   ARG  25          2HB       ARG  25  10.607  12.747   6.869
  145   2HB   ARG  25          1HB       ARG  25   9.475  12.441   8.179
  146   1HG   ARG  25          2HG       ARG  25  10.688  10.379   8.729
  147   2HG   ARG  25          1HG       ARG  25  11.839  10.729   7.437
  148   1HD   ARG  25          2HD       ARG  25  12.714  11.415   9.613
  149   2HD   ARG  25          1HD       ARG  25  12.472  12.804   8.554
  150    HE   ARG  25           HE       ARG  25  10.168  12.467  10.102
  151   1HH1  ARG  25          1HH1      ARG  25  13.521  13.347  10.504
  152   2HH1  ARG  25          2HH1      ARG  25  13.222  14.350  11.884
  153   1HH2  ARG  25          1HH2      ARG  25   9.773  13.786  11.917
  154   2HH2  ARG  25          2HH2      ARG  25  11.095  14.598  12.687
  155    H    ASP  26           H        ASP  26   8.972  12.052   4.117
  156    HA   ASP  26           HA       ASP  26   6.888  13.924   4.743
  157   1HB   ASP  26          2HB       ASP  26   7.071  14.629   2.417
  158   2HB   ASP  26          1HB       ASP  26   8.667  14.518   3.152
  159    H    ILE  27           H        ILE  27   6.855  10.680   4.125
  160    HA   ILE  27           HA       ILE  27   4.104  10.819   3.178
  161    HB   ILE  27           HB       ILE  27   4.499   8.766   1.819
  162   1HG1  ILE  27          2HG1      ILE  27   7.406   9.452   2.315
  163   2HG1  ILE  27          1HG1      ILE  27   6.563   8.047   2.955
  164   1HG2  ILE  27          1HG2      ILE  27   5.803  11.379   1.168
  165   2HG2  ILE  27          2HG2      ILE  27   4.307  10.689   0.540
  166   3HG2  ILE  27          3HG2      ILE  27   5.864  10.035   0.026
  167   1HD1  ILE  27          1HD1      ILE  27   7.980   7.549   0.994
  168   2HD1  ILE  27          2HD1      ILE  27   6.954   8.606   0.025
  169   3HD1  ILE  27          3HD1      ILE  27   6.281   7.146   0.747
  170    H    GLN  28           H        GLN  28   6.034   9.878   5.640
  171    HA   GLN  28           HA       GLN  28   4.890   7.292   6.141
  172   1HB   GLN  28          2HB       GLN  28   6.210   7.293   8.174
  173   2HB   GLN  28          1HB       GLN  28   7.202   7.811   6.818
  174   1HG   GLN  28          2HG       GLN  28   6.956  10.130   7.505
  175   2HG   GLN  28          1HG       GLN  28   5.922   9.633   8.842
  176   1HE2  GLN  28          1HE2      GLN  28   6.930   9.660  10.705
  177   2HE2  GLN  28          2HE2      GLN  28   8.589   9.266  10.980
  178    H    GLY  29           H        GLY  29   3.603   6.752   7.983
  179   1HA   GLY  29          2HA       GLY  29   1.836   7.036   9.416
  180   2HA   GLY  29          1HA       GLY  29   2.504   8.624   9.763
  181    H    ILE  30           H        ILE  30   1.746   8.014   6.477
  182    HA   ILE  30           HA       ILE  30  -0.534   9.807   6.697
  183    HB   ILE  30           HB       ILE  30   1.000   9.027   4.219
  184   1HG1  ILE  30          2HG1      ILE  30   2.413  10.281   5.782
  185   2HG1  ILE  30          1HG1      ILE  30   2.019  11.262   4.372
  186   1HG2  ILE  30          1HG2      ILE  30  -0.178  11.364   3.615
  187   2HG2  ILE  30          2HG2      ILE  30  -1.375  10.703   4.729
  188   3HG2  ILE  30          3HG2      ILE  30  -0.913   9.793   3.291
  189   1HD1  ILE  30          1HD1      ILE  30   1.892  12.577   6.411
  190   2HD1  ILE  30          2HD1      ILE  30   0.711  11.451   7.082
  191   3HD1  ILE  30          3HD1      ILE  30   0.298  12.425   5.670
  192    H    SER  31           H        SER  31  -2.554   9.141   6.273
  193    HA   SER  31           HA       SER  31  -2.940   6.368   5.443
  194   1HB   SER  31          2HB       SER  31  -5.292   6.725   6.121
  195   2HB   SER  31          1HB       SER  31  -4.173   7.134   7.421
  196    HG   SER  31           HG       SER  31  -5.655   8.779   7.275
  197    H    GLY  32           H        GLY  32  -4.066   5.771   3.580
  198   1HA   GLY  32          2HA       GLY  32  -5.171   7.865   1.891
  199   2HA   GLY  32          1HA       GLY  32  -3.745   7.057   1.261
  200    H    ARG  33           H        ARG  33  -5.715   6.847  -0.339
  201    HA   ARG  33           HA       ARG  33  -7.199   4.412   0.255
  202   1HB   ARG  33          2HB       ARG  33  -7.614   6.610  -1.725
  203   2HB   ARG  33          1HB       ARG  33  -8.425   5.062  -1.897
  204   1HG   ARG  33          2HG       ARG  33  -9.751   6.833  -0.726
  205   2HG   ARG  33          1HG       ARG  33  -9.577   5.306   0.138
  206   1HD   ARG  33          2HD       ARG  33  -7.864   6.250   1.545
  207   2HD   ARG  33          1HD       ARG  33  -7.874   7.750   0.623
  208    HE   ARG  33           HE       ARG  33 -10.456   7.286   1.604
  209   1HH1  ARG  33          1HH1      ARG  33  -7.267   8.076   2.779
  210   2HH1  ARG  33          2HH1      ARG  33  -7.852   8.927   4.169
  211   1HH2  ARG  33          1HH2      ARG  33 -11.230   8.409   3.433
  212   2HH2  ARG  33          2HH2      ARG  33 -10.101   9.116   4.541
  213    H    VAL  34           H        VAL  34  -7.611   2.999  -1.761
  214    HA   VAL  34           HA       VAL  34  -4.936   2.264  -2.731
  215    HB   VAL  34           HB       VAL  34  -6.170   0.601  -1.403
  216   1HG1  VAL  34          1HG1      VAL  34  -8.127  -0.490  -2.231
  217   2HG1  VAL  34          2HG1      VAL  34  -8.053   0.405  -3.748
  218   3HG1  VAL  34          3HG1      VAL  34  -8.432   1.247  -2.245
  219   1HG2  VAL  34          1HG2      VAL  34  -6.041  -0.617  -4.103
  220   2HG2  VAL  34          2HG2      VAL  34  -5.330  -1.154  -2.581
  221   3HG2  VAL  34          3HG2      VAL  34  -4.579   0.157  -3.490
  222    H    VAL  35           H        VAL  35  -4.451   1.779  -4.868
  223    HA   VAL  35           HA       VAL  35  -6.604   2.005  -6.815
  224    HB   VAL  35           HB       VAL  35  -5.484   4.254  -6.701
  225   1HG1  VAL  35          1HG1      VAL  35  -3.262   3.129  -8.284
  226   2HG1  VAL  35          2HG1      VAL  35  -3.185   3.140  -6.527
  227   3HG1  VAL  35          3HG1      VAL  35  -3.374   4.650  -7.402
  228   1HG2  VAL  35          1HG2      VAL  35  -6.814   3.604  -8.604
  229   2HG2  VAL  35          2HG2      VAL  35  -5.439   2.746  -9.301
  230   3HG2  VAL  35          3HG2      VAL  35  -5.399   4.503  -9.153
  231    H    ASP  36           H        ASP  36  -3.129   1.324  -6.360
  232    HA   ASP  36           HA       ASP  36  -3.412  -1.187  -7.704
  233   1HB   ASP  36          2HB       ASP  36  -1.691   0.968  -8.947
  234   2HB   ASP  36          1HB       ASP  36  -1.701  -0.723  -9.436
  235    H    GLU  37           H        GLU  37  -1.265  -2.344  -7.819
  236    HA   GLU  37           HA       GLU  37   0.556  -1.459  -5.683
  237   1HB   GLU  37          2HB       GLU  37  -0.894  -3.234  -4.798
  238   2HB   GLU  37          1HB       GLU  37  -0.442  -4.280  -6.138
  239   1HG   GLU  37          2HG       GLU  37   1.873  -4.282  -5.359
  240   2HG   GLU  37          1HG       GLU  37   1.420  -3.233  -4.016
  241    H    THR  38           H        THR  38   2.640  -1.384  -6.325
  242    HA   THR  38           HA       THR  38   3.354  -2.883  -8.761
  243    HB   THR  38           HB       THR  38   4.561  -0.300  -7.768
  244    HG1  THR  38           1HG      THR  38   3.295   0.714  -9.203
  245   1HG2  THR  38          1HG2      THR  38   4.814  -1.391 -10.537
  246   2HG2  THR  38          2HG2      THR  38   5.946  -1.859  -9.269
  247   3HG2  THR  38          3HG2      THR  38   5.787  -0.164  -9.726
  248    H    ARG  39           H        ARG  39   5.388  -3.831  -8.891
  249    HA   ARG  39           HA       ARG  39   6.324  -5.172  -6.672
  250   1HB   ARG  39          2HB       ARG  39   8.294  -5.730  -8.026
  251   2HB   ARG  39          1HB       ARG  39   6.809  -5.869  -8.958
  252   1HG   ARG  39          2HG       ARG  39   7.245  -3.687  -9.976
  253   2HG   ARG  39          1HG       ARG  39   8.741  -3.562  -9.052
  254   1HD   ARG  39          2HD       ARG  39   9.582  -5.583 -10.162
  255   2HD   ARG  39          1HD       ARG  39   8.091  -5.683 -11.098
  256    HE   ARG  39           HE       ARG  39   9.227  -3.154 -11.492
  257   1HH1  ARG  39          1HH1      ARG  39   9.862  -6.500 -12.251
  258   2HH1  ARG  39          2HH1      ARG  39  10.741  -6.136 -13.697
  259   1HH2  ARG  39          1HH2      ARG  39  10.384  -2.673 -13.393
  260   2HH2  ARG  39          2HH2      ARG  39  11.038  -3.961 -14.345
  261    H    ASN  40           H        ASN  40   7.033  -1.919  -7.644
  262    HA   ASN  40           HA       ASN  40   8.959  -1.764  -5.434
  263   1HB   ASN  40          2HB       ASN  40  10.342  -0.195  -6.719
  264   2HB   ASN  40          1HB       ASN  40  10.252  -1.778  -7.474
  265   1HD2  ASN  40          1HD2      ASN  40   7.333  -0.238  -8.032
  266   2HD2  ASN  40          2HD2      ASN  40   7.689   0.427  -9.576
  267    H    THR  41           H        THR  41   6.006  -0.751  -6.287
  268    HA   THR  41           HA       THR  41   6.192   1.521  -4.532
  269    HB   THR  41           HB       THR  41   6.849   2.578  -6.640
  270    HG1  THR  41           1HG      THR  41   5.518   4.257  -6.399
  271   1HG2  THR  41          1HG2      THR  41   5.219   2.844  -8.456
  272   2HG2  THR  41          2HG2      THR  41   4.185   1.646  -7.676
  273   3HG2  THR  41          3HG2      THR  41   5.779   1.182  -8.276
  274    H    LEU  42           H        LEU  42   4.063   2.519  -4.125
  275    HA   LEU  42           HA       LEU  42   1.885   0.578  -4.533
  276   1HB   LEU  42          2HB       LEU  42   2.793   0.625  -2.226
  277   2HB   LEU  42          1HB       LEU  42   2.371   2.315  -2.112
  278    HG   LEU  42           HG       LEU  42   0.783   0.860  -0.936
  279   1HD1  LEU  42          1HD1      LEU  42  -0.647   2.007  -3.311
  280   2HD1  LEU  42          2HD1      LEU  42   0.145   3.049  -2.129
  281   3HD1  LEU  42          3HD1      LEU  42  -1.154   1.968  -1.623
  282   1HD2  LEU  42          1HD2      LEU  42   0.325  -0.284  -3.691
  283   2HD2  LEU  42          2HD2      LEU  42  -0.773  -0.525  -2.333
  284   3HD2  LEU  42          3HD2      LEU  42   0.880  -1.136  -2.250
  285    H    ARG  43           H        ARG  43   0.223   1.381  -5.633
  286    HA   ARG  43           HA       ARG  43   0.048   4.273  -5.958
  287   1HB   ARG  43          2HB       ARG  43  -0.005   2.352  -7.802
  288   2HB   ARG  43          1HB       ARG  43  -1.721   2.391  -7.444
  289   1HG   ARG  43          2HG       ARG  43  -1.412   3.842  -9.270
  290   2HG   ARG  43          1HG       ARG  43  -1.601   4.895  -7.867
  291   1HD   ARG  43          2HD       ARG  43   0.807   5.171  -7.716
  292   2HD   ARG  43          1HD       ARG  43   1.036   4.069  -9.073
  293    HE   ARG  43           HE       ARG  43  -0.647   6.173  -9.868
  294   1HH1  ARG  43          1HH1      ARG  43   2.686   5.578  -9.017
  295   2HH1  ARG  43          2HH1      ARG  43   3.297   6.867  -9.998
  296   1HH2  ARG  43          1HH2      ARG  43   0.155   7.868 -11.161
  297   2HH2  ARG  43          2HH2      ARG  43   1.860   8.168 -11.215
  298    H    ILE  44           H        ILE  44  -1.668   5.469  -5.271
  299    HA   ILE  44           HA       ILE  44  -3.685   4.098  -3.608
  300    HB   ILE  44           HB       ILE  44  -2.280   6.736  -3.284
  301   1HG1  ILE  44          2HG1      ILE  44  -2.598   4.346  -1.463
  302   2HG1  ILE  44          1HG1      ILE  44  -1.160   4.753  -2.393
  303   1HG2  ILE  44          1HG2      ILE  44  -4.985   6.266  -2.577
  304   2HG2  ILE  44          2HG2      ILE  44  -3.983   7.679  -2.255
  305   3HG2  ILE  44          3HG2      ILE  44  -4.026   6.352  -1.099
  306   1HD1  ILE  44          1HD1      ILE  44  -1.234   6.975  -1.071
  307   2HD1  ILE  44          2HD1      ILE  44  -0.642   5.515  -0.279
  308   3HD1  ILE  44          3HD1      ILE  44  -2.282   6.083   0.032
  309    H    GLU  45           H        GLU  45  -5.802   4.307  -4.157
  310    HA   GLU  45           HA       GLU  45  -6.621   6.769  -5.511
  311   1HB   GLU  45          2HB       GLU  45  -6.678   5.293  -7.345
  312   2HB   GLU  45          1HB       GLU  45  -7.354   3.979  -6.391
  313   1HG   GLU  45          2HG       GLU  45  -9.458   5.204  -6.216
  314   2HG   GLU  45          1HG       GLU  45  -8.766   6.525  -7.156
  315    H    MET  46           H        MET  46  -8.405   7.642  -4.838
  316    HA   MET  46           HA       MET  46  -9.797   6.439  -2.552
  317   1HB   MET  46          2HB       MET  46  -9.780   9.307  -3.512
  318   2HB   MET  46          1HB       MET  46 -10.471   8.719  -2.006
  319   1HG   MET  46          2HG       MET  46  -8.376   8.314  -1.072
  320   2HG   MET  46          1HG       MET  46  -7.564   8.385  -2.631
  321   1HE   MET  46          1HE       MET  46  -6.279   9.791  -3.219
  322   2HE   MET  46          2HE       MET  46  -5.645  10.863  -1.967
  323   3HE   MET  46          3HE       MET  46  -6.521  11.537  -3.342
  324    H    ASP  47           H        ASP  47 -11.902   5.918  -2.658
  325    HA   ASP  47           HA       ASP  47 -13.273   5.489  -4.972
  326   1HB   ASP  47          2HB       ASP  47 -13.969   4.577  -2.811
  327   2HB   ASP  47          1HB       ASP  47 -14.470   6.181  -2.285
  328    H    ASP  48           H        ASP  48 -12.961   8.484  -3.264
  329    HA   ASP  48           HA       ASP  48 -15.120   9.886  -4.395
  330   1HB   ASP  48          2HB       ASP  48 -12.456  10.932  -3.415
  331   2HB   ASP  48          1HB       ASP  48 -13.872  11.924  -3.749
  332    H    GLY  49           H        GLY  49 -12.292   8.705  -5.831
  333   1HA   GLY  49          2HA       GLY  49 -12.022   8.755  -8.198
  334   2HA   GLY  49          1HA       GLY  49 -12.821  10.320  -8.225
  335    H    ARG  50           H        ARG  50 -10.422   9.666  -5.822
  336    HA   ARG  50           HA       ARG  50  -8.624  11.569  -7.174
  337   1HB   ARG  50          2HB       ARG  50  -8.754  10.766  -4.263
  338   2HB   ARG  50          1HB       ARG  50  -7.622  11.923  -4.943
  339   1HG   ARG  50          2HG       ARG  50  -9.482  13.375  -5.576
  340   2HG   ARG  50          1HG       ARG  50 -10.620  12.211  -4.892
  341   1HD   ARG  50          2HD       ARG  50  -9.567  12.502  -2.690
  342   2HD   ARG  50          1HD       ARG  50  -8.465  13.692  -3.383
  343    HE   ARG  50           HE       ARG  50 -11.080  14.506  -3.928
  344   1HH1  ARG  50          1HH1      ARG  50  -8.964  14.085  -1.185
  345   2HH1  ARG  50          2HH1      ARG  50  -9.729  15.321  -0.245
  346   1HH2  ARG  50          1HH2      ARG  50 -12.089  16.133  -2.692
  347   2HH2  ARG  50          2HH2      ARG  50 -11.505  16.483  -1.101
  348    H    GLU  51           H        GLU  51  -6.399  11.123  -7.365
  349    HA   GLU  51           HA       GLU  51  -5.585   8.387  -6.714
  350   1HB   GLU  51          2HB       GLU  51  -4.689   8.024  -8.892
  351   2HB   GLU  51          1HB       GLU  51  -6.329   8.624  -9.096
  352   1HG   GLU  51          2HG       GLU  51  -3.843  10.293  -9.361
  353   2HG   GLU  51          1HG       GLU  51  -4.757   9.604 -10.701
  354    H    ILE  52           H        ILE  52  -3.508   8.140  -6.065
  355    HA   ILE  52           HA       ILE  52  -1.471  10.118  -6.520
  356    HB   ILE  52           HB       ILE  52  -2.665  11.141  -4.634
  357   1HG1  ILE  52          2HG1      ILE  52  -0.734  11.359  -3.098
  358   2HG1  ILE  52          1HG1      ILE  52   0.025   9.972  -3.877
  359   1HG2  ILE  52          1HG2      ILE  52  -3.304  10.069  -2.762
  360   2HG2  ILE  52          2HG2      ILE  52  -1.852   9.066  -2.711
  361   3HG2  ILE  52          3HG2      ILE  52  -3.185   8.638  -3.786
  362   1HD1  ILE  52          1HD1      ILE  52   0.985  12.044  -4.707
  363   2HD1  ILE  52          2HD1      ILE  52  -0.615  12.618  -5.184
  364   3HD1  ILE  52          3HD1      ILE  52   0.101  11.225  -5.997
  365    H    THR  53           H        THR  53   0.634   9.317  -6.025
  366    HA   THR  53           HA       THR  53   0.686   6.419  -5.573
  367    HB   THR  53           HB       THR  53   1.669   7.234  -7.660
  368    HG1  THR  53           1HG      THR  53   3.595   6.253  -5.823
  369   1HG2  THR  53          1HG2      THR  53   2.622   9.353  -6.254
  370   2HG2  THR  53          2HG2      THR  53   3.160   8.871  -7.863
  371   3HG2  THR  53          3HG2      THR  53   4.064   8.357  -6.439
  372    H    VAL  54           H        VAL  54   2.318   5.456  -4.237
  373    HA   VAL  54           HA       VAL  54   3.804   7.161  -2.420
  374    HB   VAL  54           HB       VAL  54   1.767   5.210  -1.334
  375   1HG1  VAL  54          1HG1      VAL  54   3.800   5.358   0.024
  376   2HG1  VAL  54          2HG1      VAL  54   2.420   6.077   0.856
  377   3HG1  VAL  54          3HG1      VAL  54   3.628   7.111   0.094
  378   1HG2  VAL  54          1HG2      VAL  54   0.641   7.170  -2.177
  379   2HG2  VAL  54          2HG2      VAL  54   1.787   8.229  -1.353
  380   3HG2  VAL  54          3HG2      VAL  54   0.670   7.239  -0.414
  381    HA   PRO  55           HA       PRO  55   6.550   3.681  -3.243
  382   1HB   PRO  55          2HB       PRO  55   8.174   4.995  -1.137
  383   2HB   PRO  55          1HB       PRO  55   8.617   4.553  -2.790
  384   1HG   PRO  55          2HG       PRO  55   8.206   7.099  -2.121
  385   2HG   PRO  55          1HG       PRO  55   7.675   6.470  -3.693
  386   1HD   PRO  55          2HD       PRO  55   6.064   7.015  -1.228
  387   2HD   PRO  55          1HD       PRO  55   5.665   7.337  -2.930
  388    H    LYS  56           H        LYS  56   6.067   1.744  -2.397
  389    HA   LYS  56           HA       LYS  56   5.687   1.498   0.500
  390   1HB   LYS  56          2HB       LYS  56   4.684  -0.704  -0.011
  391   2HB   LYS  56          1HB       LYS  56   3.847   0.637  -0.772
  392   1HG   LYS  56          2HG       LYS  56   4.810   0.122  -2.897
  393   2HG   LYS  56          1HG       LYS  56   5.883  -1.077  -2.176
  394   1HD   LYS  56          2HD       LYS  56   2.869  -1.255  -2.199
  395   2HD   LYS  56          1HD       LYS  56   3.934  -2.075  -3.340
  396   1HE   LYS  56          2HE       LYS  56   4.989  -3.277  -1.488
  397   2HE   LYS  56          1HE       LYS  56   3.924  -2.456  -0.348
  398   1HZ   LYS  56          1HZ       LYS  56   3.393  -4.835  -1.390
  399   2HZ   LYS  56          2HZ       LYS  56   2.615  -3.858  -2.530
  400   3HZ   LYS  56          3HZ       LYS  56   2.188  -3.755  -0.898
  401    H    GLY  57           H        GLY  57   8.189   1.103  -1.633
  402   1HA   GLY  57          2HA       GLY  57   9.283  -1.380  -1.202
  403   2HA   GLY  57          1HA       GLY  57  10.246   0.080  -1.364
  404    H    ILE  58           H        ILE  58   8.908   1.165   1.104
  405    HA   ILE  58           HA       ILE  58   9.808  -0.573   3.205
  406    HB   ILE  58           HB       ILE  58  11.009   2.187   2.977
  407   1HG1  ILE  58          2HG1      ILE  58  13.194   0.817   2.777
  408   2HG1  ILE  58          1HG1      ILE  58  12.148  -0.518   2.303
  409   1HG2  ILE  58          1HG2      ILE  58  12.154   1.755   4.961
  410   2HG2  ILE  58          2HG2      ILE  58  11.857   0.019   4.866
  411   3HG2  ILE  58          3HG2      ILE  58  10.537   1.118   5.258
  412   1HD1  ILE  58          1HD1      ILE  58  13.128   1.666   0.742
  413   2HD1  ILE  58          2HD1      ILE  58  11.364   1.667   0.741
  414   3HD1  ILE  58          3HD1      ILE  58  12.245   0.229   0.229
  415    H    ALA  59           H        ALA  59   7.304  -0.176   2.993
  416    HA   ALA  59           HA       ALA  59   6.679   1.883   4.966
  417   1HB   ALA  59          1HB       ALA  59   6.288   2.576   2.483
  418   2HB   ALA  59          2HB       ALA  59   5.110   2.997   3.726
  419   3HB   ALA  59          3HB       ALA  59   4.816   1.620   2.663
  420    H    VAL  60           H        VAL  60   5.804   0.832   6.636
  421    HA   VAL  60           HA       VAL  60   4.248  -1.573   6.288
  422    HB   VAL  60           HB       VAL  60   5.656  -1.326   8.274
  423   1HG1  VAL  60          1HG1      VAL  60   3.872   0.567   9.629
  424   2HG1  VAL  60          2HG1      VAL  60   4.835   1.264   8.325
  425   3HG1  VAL  60          3HG1      VAL  60   5.631   0.438   9.666
  426   1HG2  VAL  60          1HG2      VAL  60   2.690  -1.473   8.781
  427   2HG2  VAL  60          2HG2      VAL  60   3.907  -1.864   9.997
  428   3HG2  VAL  60          3HG2      VAL  60   3.809  -2.810   8.512
  429    H    PHE  61           H        PHE  61   2.075  -1.709   6.095
  430    HA   PHE  61           HA       PHE  61   0.421   0.469   7.048
  431   1HB   PHE  61          2HB       PHE  61  -0.734   0.588   4.760
  432   2HB   PHE  61          1HB       PHE  61   0.811   1.405   4.948
  433    HD1  PHE  61           1HD      PHE  61  -0.282  -2.074   4.099
  434    HD2  PHE  61           2HD      PHE  61   2.132   1.286   3.104
  435    HE1  PHE  61           1HE      PHE  61   0.621  -3.298   2.164
  436    HE2  PHE  61           2HE      PHE  61   3.034   0.071   1.168
  437    HZ   PHE  61           HZ       PHE  61   2.278  -2.224   0.695
  438    H    HIS  62           H        HIS  62  -1.807   0.044   7.080
  439    HA   HIS  62           HA       HIS  62  -2.485  -2.819   6.932
  440   1HB   HIS  62          2HB       HIS  62  -3.436  -0.705   8.876
  441   2HB   HIS  62          1HB       HIS  62  -4.111  -2.326   8.778
  442    HD1  HIS  62           1HD      HIS  62  -3.134  -1.887  11.430
  443    HD2  HIS  62           2HD      HIS  62  -0.480  -2.904   8.400
  444    HE1  HIS  62           1HE      HIS  62  -1.105  -2.808  12.594
  445    HE2  HIS  62           2HE      HIS  62   0.526  -3.321  10.745
  446    H    PHE  63           H        PHE  63  -4.318  -3.375   5.839
  447    HA   PHE  63           HA       PHE  63  -5.639  -1.235   4.359
  448   1HB   PHE  63          2HB       PHE  63  -5.802  -4.242   4.071
  449   2HB   PHE  63          1HB       PHE  63  -6.643  -3.089   3.041
  450    HD1  PHE  63           1HD      PHE  63  -5.702  -2.837   0.982
  451    HD2  PHE  63           2HD      PHE  63  -3.148  -3.515   4.313
  452    HE1  PHE  63           1HE      PHE  63  -3.745  -2.729  -0.504
  453    HE2  PHE  63           2HE      PHE  63  -1.190  -3.404   2.839
  454    HZ   PHE  63           HZ       PHE  63  -1.483  -3.011   0.426
  455    H    ARG  64           H        ARG  64  -7.386  -0.344   5.207
  456    HA   ARG  64           HA       ARG  64  -9.075  -1.921   7.005
  457   1HB   ARG  64          2HB       ARG  64  -8.199   0.298   7.749
  458   2HB   ARG  64          1HB       ARG  64  -9.129   1.055   6.465
  459   1HG   ARG  64          2HG       ARG  64 -10.443  -0.643   8.555
  460   2HG   ARG  64          1HG       ARG  64 -10.096   1.063   8.830
  461   1HD   ARG  64          2HD       ARG  64 -11.811  -0.088   6.632
  462   2HD   ARG  64          1HD       ARG  64 -12.374   0.780   8.054
  463    HE   ARG  64           HE       ARG  64 -10.559   2.396   6.642
  464   1HH1  ARG  64          1HH1      ARG  64 -13.794   1.119   6.389
  465   2HH1  ARG  64          2HH1      ARG  64 -14.366   2.420   5.398
  466   1HH2  ARG  64          1HH2      ARG  64 -11.309   4.110   5.340
  467   2HH2  ARG  64          2HH2      ARG  64 -12.956   4.119   4.804
  468    H    THR  65           H        THR  65 -10.562  -3.041   5.907
  469    HA   THR  65           HA       THR  65 -11.725  -2.062   3.464
  470    HB   THR  65           HB       THR  65 -12.407  -4.498   5.120
  471    HG1  THR  65           1HG      THR  65 -10.790  -5.413   4.168
  472   1HG2  THR  65          1HG2      THR  65 -13.962  -3.489   3.149
  473   2HG2  THR  65          2HG2      THR  65 -13.847  -5.199   3.565
  474   3HG2  THR  65          3HG2      THR  65 -12.888  -4.547   2.235
  475    HA   PRO  66           HA       PRO  66 -15.068   0.361   5.094
  476   1HB   PRO  66          2HB       PRO  66 -16.551  -0.942   2.851
  477   2HB   PRO  66          1HB       PRO  66 -16.469   0.766   3.304
  478   1HG   PRO  66          2HG       PRO  66 -15.064  -0.152   1.239
  479   2HG   PRO  66          1HG       PRO  66 -14.378   1.058   2.341
  480   1HD   PRO  66          2HD       PRO  66 -13.784  -1.848   2.109
  481   2HD   PRO  66          1HD       PRO  66 -12.714  -0.508   2.567
  482    H    GLN  67           H        GLN  67 -15.479  -3.048   4.310
  483    HA   GLN  67           HA       GLN  67 -17.955  -3.466   5.567
  484   1HB   GLN  67          2HB       GLN  67 -15.657  -5.392   5.185
  485   2HB   GLN  67          1HB       GLN  67 -17.292  -5.850   5.641
  486   1HG   GLN  67          2HG       GLN  67 -18.126  -4.962   3.519
  487   2HG   GLN  67          1HG       GLN  67 -16.480  -4.526   3.063
  488   1HE2  GLN  67          1HE2      GLN  67 -15.593  -5.898   1.712
  489   2HE2  GLN  67          2HE2      GLN  67 -15.877  -7.601   1.648
  490    H    GLY  68           H        GLY  68 -14.906  -2.754   6.902
  491   1HA   GLY  68          2HA       GLY  68 -14.738  -2.169   9.219
  492   2HA   GLY  68          1HA       GLY  68 -15.946  -3.394   9.577
  493    H    GLU  69           H        GLU  69 -13.085  -3.736   7.534
  494    HA   GLU  69           HA       GLU  69 -12.013  -5.664   9.494
  495   1HB   GLU  69          2HB       GLU  69 -11.864  -5.827   6.479
  496   2HB   GLU  69          1HB       GLU  69 -11.112  -6.956   7.598
  497   1HG   GLU  69          2HG       GLU  69 -13.312  -7.605   8.429
  498   2HG   GLU  69          1HG       GLU  69 -14.068  -6.468   7.315
  499    H    LEU  70           H        LEU  70  -9.786  -5.699   9.807
  500    HA   LEU  70           HA       LEU  70  -8.275  -3.545   8.485
  501   1HB   LEU  70          2HB       LEU  70  -8.957  -2.972  10.820
  502   2HB   LEU  70          1HB       LEU  70  -8.027  -4.346  11.385
  503    HG   LEU  70           HG       LEU  70  -6.874  -2.158  11.652
  504   1HD1  LEU  70          1HD1      LEU  70  -5.738  -4.443  11.294
  505   2HD1  LEU  70          2HD1      LEU  70  -4.762  -2.983  11.134
  506   3HD1  LEU  70          3HD1      LEU  70  -5.335  -3.822   9.694
  507   1HD2  LEU  70          1HD2      LEU  70  -6.773  -2.216   8.637
  508   2HD2  LEU  70          2HD2      LEU  70  -5.951  -1.058   9.681
  509   3HD2  LEU  70          3HD2      LEU  70  -7.713  -1.090   9.615
  510    H    VAL  71           H        VAL  71  -6.828  -4.502   7.230
  511    HA   VAL  71           HA       VAL  71  -5.556  -6.996   8.114
  512    HB   VAL  71           HB       VAL  71  -5.489  -5.703   5.382
  513   1HG1  VAL  71          1HG1      VAL  71  -4.813  -8.119   4.772
  514   2HG1  VAL  71          2HG1      VAL  71  -4.391  -8.263   6.477
  515   3HG1  VAL  71          3HG1      VAL  71  -3.599  -7.050   5.474
  516   1HG2  VAL  71          1HG2      VAL  71  -7.730  -6.607   6.318
  517   2HG2  VAL  71          2HG2      VAL  71  -7.008  -8.193   6.051
  518   3HG2  VAL  71          3HG2      VAL  71  -7.221  -7.083   4.697
  519    H    GLU  72           H        GLU  72  -3.205  -7.238   7.718
  520    HA   GLU  72           HA       GLU  72  -1.803  -4.660   8.014
  521   1HB   GLU  72          2HB       GLU  72  -1.055  -7.284   9.315
  522   2HB   GLU  72          1HB       GLU  72  -0.218  -5.751   9.510
  523   1HG   GLU  72          2HG       GLU  72  -1.541  -6.103  11.445
  524   2HG   GLU  72          1HG       GLU  72  -2.304  -4.820  10.507
  525    H    ILE  73           H        ILE  73   0.166  -4.394   7.028
  526    HA   ILE  73           HA       ILE  73   1.344  -6.568   5.497
  527    HB   ILE  73           HB       ILE  73   0.461  -4.006   4.151
  528   1HG1  ILE  73          2HG1      ILE  73  -1.388  -5.600   4.527
  529   2HG1  ILE  73          1HG1      ILE  73  -1.009  -5.423   2.815
  530   1HG2  ILE  73          1HG2      ILE  73   1.268  -5.309   2.090
  531   2HG2  ILE  73          2HG2      ILE  73   2.155  -6.307   3.242
  532   3HG2  ILE  73          3HG2      ILE  73   2.483  -4.577   3.138
  533   1HD1  ILE  73          1HD1      ILE  73  -1.455  -7.775   3.750
  534   2HD1  ILE  73          2HD1      ILE  73   0.173  -7.658   4.416
  535   3HD1  ILE  73          3HD1      ILE  73  -0.078  -7.543   2.674
  536    H    ASP  74           H        ASP  74   3.548  -6.262   5.123
  537    HA   ASP  74           HA       ASP  74   4.679  -3.902   6.467
  538   1HB   ASP  74          2HB       ASP  74   5.930  -6.615   5.985
  539   2HB   ASP  74          1HB       ASP  74   6.702  -5.267   6.817
  540    H    GLY  75           H        GLY  75   4.963  -2.426   4.901
  541   1HA   GLY  75          2HA       GLY  75   5.789  -2.943   2.260
  542   2HA   GLY  75          1HA       GLY  75   5.828  -1.383   3.057
  543    H    ARG  76           H        ARG  76   7.585  -3.019   5.141
  544    HA   ARG  76           HA       ARG  76  10.035  -2.027   4.127
  545   1HB   ARG  76          2HB       ARG  76   9.490  -3.793   6.502
  546   2HB   ARG  76          1HB       ARG  76  11.044  -3.055   6.141
  547   1HG   ARG  76          2HG       ARG  76   9.863  -0.822   6.263
  548   2HG   ARG  76          1HG       ARG  76   8.488  -1.698   6.939
  549   1HD   ARG  76          2HD       ARG  76   9.930  -2.550   8.733
  550   2HD   ARG  76          1HD       ARG  76  11.287  -1.645   8.064
  551    HE   ARG  76           HE       ARG  76  10.475   0.225   9.081
  552   1HH1  ARG  76          1HH1      ARG  76   7.907  -2.131   8.901
  553   2HH1  ARG  76          2HH1      ARG  76   6.791  -1.166   9.807
  554   1HH2  ARG  76          1HH2      ARG  76   9.004   1.499  10.264
  555   2HH2  ARG  76          2HH2      ARG  76   7.409   0.898  10.573
  556    H    ALA  77           H        ALA  77   9.168  -5.331   5.025
  557    HA   ALA  77           HA       ALA  77  11.265  -6.304   3.277
  558   1HB   ALA  77          1HB       ALA  77   9.731  -8.010   5.186
  559   2HB   ALA  77          2HB       ALA  77  11.059  -6.980   5.724
  560   3HB   ALA  77          3HB       ALA  77  11.354  -8.254   4.541
  561    H    LEU  78           H        LEU  78   7.809  -6.585   3.731
  562    HA   LEU  78           HA       LEU  78   7.209  -8.747   2.156
  563   1HB   LEU  78          2HB       LEU  78   5.608  -7.302   3.472
  564   2HB   LEU  78          1HB       LEU  78   5.612  -6.197   2.112
  565    HG   LEU  78           HG       LEU  78   3.644  -7.705   2.161
  566   1HD1  LEU  78          1HD1      LEU  78   3.514  -7.692  -0.075
  567   2HD1  LEU  78          2HD1      LEU  78   5.003  -8.615  -0.271
  568   3HD1  LEU  78          3HD1      LEU  78   5.074  -6.875   0.008
  569   1HD2  LEU  78          1HD2      LEU  78   5.680  -9.864   1.634
  570   2HD2  LEU  78          2HD2      LEU  78   3.930 -10.058   1.580
  571   3HD2  LEU  78          3HD2      LEU  78   4.727  -9.675   3.105
  572    H    VAL  79           H        VAL  79   8.271  -5.612   1.145
  573    HA   VAL  79           HA       VAL  79   7.508  -5.655  -1.544
  574    HB   VAL  79           HB       VAL  79   8.395  -3.646  -0.470
  575   1HG1  VAL  79          1HG1      VAL  79  10.466  -5.349   0.356
  576   2HG1  VAL  79          2HG1      VAL  79  10.288  -3.627   0.687
  577   3HG1  VAL  79          3HG1      VAL  79  11.206  -4.163  -0.719
  578   1HG2  VAL  79          1HG2      VAL  79   9.919  -4.613  -2.882
  579   2HG2  VAL  79          2HG2      VAL  79   9.969  -2.950  -2.296
  580   3HG2  VAL  79          3HG2      VAL  79   8.445  -3.643  -2.851
  581    H    ALA  80           H        ALA  80   7.925  -7.239  -2.940
  582    HA   ALA  80           HA       ALA  80  10.558  -8.549  -2.848
  583   1HB   ALA  80          1HB       ALA  80   8.415  -9.768  -4.465
  584   2HB   ALA  80          2HB       ALA  80   8.154  -9.751  -2.720
  585   3HB   ALA  80          3HB       ALA  80   9.596 -10.517  -3.387
  586    H    ARG  81           H        ARG  81  11.793  -8.753  -4.692
  587    HA   ARG  81           HA       ARG  81  10.918  -7.125  -6.987
  588   1HB   ARG  81          2HB       ARG  81  13.732  -7.659  -6.020
  589   2HB   ARG  81          1HB       ARG  81  13.297  -6.685  -7.418
  590   1HG   ARG  81          2HG       ARG  81  12.125  -5.114  -5.954
  591   2HG   ARG  81          1HG       ARG  81  12.584  -6.086  -4.555
  592   1HD   ARG  81          2HD       ARG  81  14.092  -4.198  -4.785
  593   2HD   ARG  81          1HD       ARG  81  14.956  -5.705  -5.092
  594    HE   ARG  81           HE       ARG  81  15.427  -4.915  -7.170
  595   1HH1  ARG  81          1HH1      ARG  81  12.574  -3.264  -6.017
  596   2HH1  ARG  81          2HH1      ARG  81  12.422  -2.278  -7.432
  597   1HH2  ARG  81          1HH2      ARG  81  15.231  -3.613  -9.026
  598   2HH2  ARG  81          2HH2      ARG  81  13.932  -2.474  -9.139
  599    HA   PRO  82           HA       PRO  82  11.199 -11.127  -9.028
  600   1HB   PRO  82          2HB       PRO  82  10.010 -10.410 -11.329
  601   2HB   PRO  82          1HB       PRO  82   9.090 -10.647  -9.838
  602   1HG   PRO  82          2HG       PRO  82  10.032  -8.100 -11.098
  603   2HG   PRO  82          1HG       PRO  82   8.459  -8.471 -10.365
  604   1HD   PRO  82          2HD       PRO  82  10.443  -7.104  -9.074
  605   2HD   PRO  82          1HD       PRO  82   9.224  -8.085  -8.237
  606    H    GLU  83           H        GLU  83  12.879  -8.294  -9.662
  607    HA   GLU  83           HA       GLU  83  14.164  -9.333 -12.069
  608   1HB   GLU  83          2HB       GLU  83  13.477  -6.989 -12.116
  609   2HB   GLU  83          1HB       GLU  83  14.449  -6.663 -10.688
  610   1HG   GLU  83          2HG       GLU  83  15.586  -5.881 -12.660
  611   2HG   GLU  83          1HG       GLU  83  16.473  -7.228 -11.949
  612    H    GLU  84           H        GLU  84  14.756  -8.709  -8.710
  613    HA   GLU  84           HA       GLU  84  17.545  -9.581  -9.019
  614   1HB   GLU  84          2HB       GLU  84  16.214  -8.123  -6.731
  615   2HB   GLU  84          1HB       GLU  84  17.897  -8.630  -6.757
  616   1HG   GLU  84          2HG       GLU  84  18.292  -7.189  -8.697
  617   2HG   GLU  84          1HG       GLU  84  16.612  -6.661  -8.634
  618    H    ARG  85           H        ARG  85  14.778 -11.068  -8.612
  619    HA   ARG  85           HA       ARG  85  14.121 -13.046  -7.705
  620   1HB   ARG  85          2HB       ARG  85  16.311 -13.837  -8.495
  621   2HB   ARG  85          1HB       ARG  85  17.045 -13.312  -6.985
  622   1HG   ARG  85          2HG       ARG  85  16.684 -15.700  -6.965
  623   2HG   ARG  85          1HG       ARG  85  15.660 -14.918  -5.759
  624   1HD   ARG  85          2HD       ARG  85  13.764 -15.028  -7.305
  625   2HD   ARG  85          1HD       ARG  85  14.789 -15.813  -8.506
  626    HE   ARG  85           HE       ARG  85  14.888 -17.308  -6.142
  627   1HH1  ARG  85          1HH1      ARG  85  12.616 -16.466  -8.653
  628   2HH1  ARG  85          2HH1      ARG  85  11.697 -17.923  -8.486
  629   1HH2  ARG  85          1HH2      ARG  85  13.682 -19.227  -5.919
  630   2HH2  ARG  85          2HH2      ARG  85  12.302 -19.492  -6.932
  631    H    ILE  86           H        ILE  86  13.333 -13.838  -5.769
  632    HA   ILE  86           HA       ILE  86  13.441 -12.025  -3.550
  633    HB   ILE  86           HB       ILE  86  12.128 -14.744  -3.724
  634   1HG1  ILE  86          2HG1      ILE  86  10.984 -11.978  -4.185
  635   2HG1  ILE  86          1HG1      ILE  86  11.296 -13.178  -5.434
  636   1HG2  ILE  86          1HG2      ILE  86  10.847 -14.103  -1.812
  637   2HG2  ILE  86          2HG2      ILE  86  11.525 -12.474  -1.835
  638   3HG2  ILE  86          3HG2      ILE  86  12.549 -13.851  -1.424
  639   1HD1  ILE  86          1HD1      ILE  86   9.067 -13.490  -5.111
  640   2HD1  ILE  86          2HD1      ILE  86   9.140 -13.072  -3.399
  641   3HD1  ILE  86          3HD1      ILE  86   9.706 -14.650  -3.947
  Start of MODEL    9
    1    H    ARG   9           H        ARG   9  -7.451 -15.819  -9.239
    2    HA   ARG   9           HA       ARG   9  -8.994 -13.525 -10.145
    3   1HB   ARG   9          2HB       ARG   9  -9.877 -16.086  -8.806
    4   2HB   ARG   9          1HB       ARG   9 -10.951 -14.852  -9.450
    5   1HG   ARG   9          2HG       ARG   9 -10.087 -15.260 -11.693
    6   2HG   ARG   9          1HG       ARG   9  -8.994 -16.487 -11.052
    7   1HD   ARG   9          2HD       ARG   9 -10.985 -17.503 -12.032
    8   2HD   ARG   9          1HD       ARG   9 -10.902 -17.807 -10.298
    9    HE   ARG   9           HE       ARG   9 -12.435 -15.505 -10.722
   10   1HH1  ARG   9          1HH1      ARG   9 -12.597 -18.941 -11.309
   11   2HH1  ARG   9          2HH1      ARG   9 -14.326 -18.998 -11.234
   12   1HH2  ARG   9          1HH2      ARG   9 -14.710 -15.579 -10.622
   13   2HH2  ARG   9          2HH2      ARG   9 -15.525 -17.091 -10.846
   14    H    HIS  10           H        HIS  10  -8.408 -11.867  -8.760
   15    HA   HIS  10           HA       HIS  10  -9.850 -11.601  -6.380
   16   1HB   HIS  10          2HB       HIS  10  -8.234 -13.219  -5.478
   17   2HB   HIS  10          1HB       HIS  10  -6.907 -12.168  -5.958
   18    HD1  HIS  10           1HD      HIS  10  -7.272  -9.589  -4.807
   19    HD2  HIS  10           2HD      HIS  10  -8.809 -12.928  -2.867
   20    HE1  HIS  10           1HE      HIS  10  -7.600  -8.886  -2.415
   21    HE2  HIS  10           2HE      HIS  10  -8.605 -10.897  -1.279
   22    H    GLU  11           H        GLU  11  -9.838  -9.500  -5.644
   23    HA   GLU  11           HA       GLU  11  -7.924  -7.664  -6.920
   24   1HB   GLU  11          2HB       GLU  11 -10.890  -7.198  -6.557
   25   2HB   GLU  11          1HB       GLU  11  -9.744  -6.020  -7.181
   26   1HG   GLU  11          2HG       GLU  11 -10.402  -8.663  -8.463
   27   2HG   GLU  11          1HG       GLU  11 -11.040  -7.095  -8.954
   28    H    LEU  12           H        LEU  12  -7.467  -5.733  -5.764
   29    HA   LEU  12           HA       LEU  12  -8.238  -5.807  -2.920
   30   1HB   LEU  12          2HB       LEU  12  -5.908  -6.574  -3.301
   31   2HB   LEU  12          1HB       LEU  12  -5.543  -5.024  -4.033
   32    HG   LEU  12           HG       LEU  12  -5.961  -3.897  -1.899
   33   1HD1  LEU  12          1HD1      LEU  12  -6.401  -6.665  -0.792
   34   2HD1  LEU  12          2HD1      LEU  12  -7.657  -5.455  -1.042
   35   3HD1  LEU  12          3HD1      LEU  12  -6.369  -5.162   0.127
   36   1HD2  LEU  12          1HD2      LEU  12  -3.741  -5.122  -2.576
   37   2HD2  LEU  12          2HD2      LEU  12  -4.142  -6.148  -1.197
   38   3HD2  LEU  12          3HD2      LEU  12  -3.930  -4.411  -0.974
   39    H    ILE  13           H        ILE  13  -9.089  -4.237  -5.432
   40    HA   ILE  13           HA       ILE  13  -8.408  -1.516  -4.652
   41    HB   ILE  13           HB       ILE  13 -10.143  -2.488  -6.928
   42   1HG1  ILE  13          2HG1      ILE  13  -7.261  -1.559  -6.910
   43   2HG1  ILE  13          1HG1      ILE  13  -7.802  -3.218  -7.141
   44   1HG2  ILE  13          1HG2      ILE  13  -9.343   0.198  -5.965
   45   2HG2  ILE  13          2HG2      ILE  13 -10.826  -0.328  -6.761
   46   3HG2  ILE  13          3HG2      ILE  13  -9.361  -0.065  -7.708
   47   1HD1  ILE  13          1HD1      ILE  13  -8.844  -1.142  -8.984
   48   2HD1  ILE  13          2HD1      ILE  13  -8.485  -2.844  -9.277
   49   3HD1  ILE  13          3HD1      ILE  13  -7.171  -1.671  -9.169
   50    H    GLY  14           H        GLY  14  -9.940   0.052  -4.062
   51   1HA   GLY  14          2HA       GLY  14 -12.107   0.809  -3.493
   52   2HA   GLY  14          1HA       GLY  14 -12.664  -0.858  -3.499
   53    H    LEU  15           H        LEU  15  -9.748  -0.585  -1.835
   54    HA   LEU  15           HA       LEU  15 -11.196  -0.549   0.728
   55   1HB   LEU  15          2HB       LEU  15  -8.534  -1.804   0.053
   56   2HB   LEU  15          1HB       LEU  15  -9.301  -1.835   1.629
   57    HG   LEU  15           HG       LEU  15 -10.352  -3.146  -0.878
   58   1HD1  LEU  15          1HD1      LEU  15  -9.642  -4.647   1.578
   59   2HD1  LEU  15          2HD1      LEU  15  -8.323  -4.062   0.564
   60   3HD1  LEU  15          3HD1      LEU  15  -9.551  -5.132  -0.115
   61   1HD2  LEU  15          1HD2      LEU  15 -11.513  -2.738   1.843
   62   2HD2  LEU  15          2HD2      LEU  15 -11.889  -4.208   0.942
   63   3HD2  LEU  15          3HD2      LEU  15 -12.287  -2.629   0.262
   64    H    SER  16           H        SER  16  -9.872   0.242   2.605
   65    HA   SER  16           HA       SER  16  -8.490   2.709   1.808
   66   1HB   SER  16          2HB       SER  16 -10.429   3.013   3.285
   67   2HB   SER  16          1HB       SER  16  -9.711   1.924   4.473
   68    HG   SER  16           HG       SER  16  -8.402   4.267   3.584
   69    H    VAL  17           H        VAL  17  -6.598   3.377   3.083
   70    HA   VAL  17           HA       VAL  17  -5.131   1.135   4.287
   71    HB   VAL  17           HB       VAL  17  -3.844   3.051   2.354
   72   1HG1  VAL  17          1HG1      VAL  17  -2.380   2.012   4.033
   73   2HG1  VAL  17          2HG1      VAL  17  -1.996   1.489   2.394
   74   3HG1  VAL  17          3HG1      VAL  17  -2.892   0.420   3.472
   75   1HG2  VAL  17          1HG2      VAL  17  -3.780   0.731   1.022
   76   2HG2  VAL  17          2HG2      VAL  17  -5.053   1.937   0.810
   77   3HG2  VAL  17          3HG2      VAL  17  -5.321   0.545   1.862
   78    H    ARG  18           H        ARG  18  -3.553   1.686   5.785
   79    HA   ARG  18           HA       ARG  18  -3.347   4.521   6.521
   80   1HB   ARG  18          2HB       ARG  18  -3.460   3.935   8.904
   81   2HB   ARG  18          1HB       ARG  18  -4.945   3.511   8.067
   82   1HG   ARG  18          2HG       ARG  18  -4.191   1.170   7.966
   83   2HG   ARG  18          1HG       ARG  18  -2.750   1.619   8.878
   84   1HD   ARG  18          2HD       ARG  18  -5.609   1.848   9.804
   85   2HD   ARG  18          1HD       ARG  18  -4.419   0.673  10.360
   86    HE   ARG  18           HE       ARG  18  -4.752   3.312  11.314
   87   1HH1  ARG  18          1HH1      ARG  18  -2.274   0.966  10.581
   88   2HH1  ARG  18          2HH1      ARG  18  -1.122   1.659  11.670
   89   1HH2  ARG  18          1HH2      ARG  18  -3.240   4.219  12.750
   90   2HH2  ARG  18          2HH2      ARG  18  -1.671   3.503  12.904
   91    H    ILE  19           H        ILE  19  -1.295   4.969   6.050
   92    HA   ILE  19           HA       ILE  19   0.772   2.963   6.398
   93    HB   ILE  19           HB       ILE  19   0.981   5.784   5.339
   94   1HG1  ILE  19          2HG1      ILE  19   1.242   4.649   3.129
   95   2HG1  ILE  19          1HG1      ILE  19   0.849   3.119   3.907
   96   1HG2  ILE  19          1HG2      ILE  19   3.124   4.481   4.336
   97   2HG2  ILE  19          2HG2      ILE  19   2.981   3.710   5.915
   98   3HG2  ILE  19          3HG2      ILE  19   3.157   5.461   5.803
   99   1HD1  ILE  19          1HD1      ILE  19  -1.043   5.439   4.059
  100   2HD1  ILE  19          2HD1      ILE  19  -1.382   3.718   4.233
  101   3HD1  ILE  19          3HD1      ILE  19  -1.010   4.388   2.643
  102    H    ALA  20           H        ALA  20   2.454   3.043   7.801
  103    HA   ALA  20           HA       ALA  20   2.291   5.059   9.932
  104   1HB   ALA  20          1HB       ALA  20   3.549   3.328  11.290
  105   2HB   ALA  20          2HB       ALA  20   3.188   2.197   9.985
  106   3HB   ALA  20          3HB       ALA  20   1.873   2.947  10.891
  107    H    ARG  21           H        ARG  21   4.752   2.879   8.667
  108    HA   ARG  21           HA       ARG  21   6.661   5.088   8.706
  109   1HB   ARG  21          2HB       ARG  21   7.077   2.122   9.032
  110   2HB   ARG  21          1HB       ARG  21   8.404   3.231   8.720
  111   1HG   ARG  21          2HG       ARG  21   8.320   2.794  11.059
  112   2HG   ARG  21          1HG       ARG  21   7.796   4.456  10.791
  113   1HD   ARG  21          2HD       ARG  21   6.391   3.319  12.444
  114   2HD   ARG  21          1HD       ARG  21   5.468   3.780  11.019
  115    HE   ARG  21           HE       ARG  21   4.984   1.580  10.719
  116   1HH1  ARG  21          1HH1      ARG  21   7.904   1.788  12.623
  117   2HH1  ARG  21          2HH1      ARG  21   8.052   0.075  12.810
  118   1HH2  ARG  21          1HH2      ARG  21   5.173  -0.675  10.977
  119   2HH2  ARG  21          2HH2      ARG  21   6.502  -1.324  11.878
  120    H    SER  22           H        SER  22   7.623   5.697   6.844
  121    HA   SER  22           HA       SER  22   7.465   3.909   4.529
  122   1HB   SER  22          2HB       SER  22   6.572   6.799   4.516
  123   2HB   SER  22          1HB       SER  22   6.708   5.770   3.091
  124    HG   SER  22           HG       SER  22   4.573   5.821   3.889
  125    H    VAL  23           H        VAL  23   8.821   4.669   2.697
  126    HA   VAL  23           HA       VAL  23  11.456   5.105   3.501
  127    HB   VAL  23           HB       VAL  23  10.866   4.069   1.356
  128   1HG1  VAL  23          1HG1      VAL  23  10.074   5.332  -0.517
  129   2HG1  VAL  23          2HG1      VAL  23  10.174   6.840   0.393
  130   3HG1  VAL  23          3HG1      VAL  23   8.980   5.619   0.837
  131   1HG2  VAL  23          1HG2      VAL  23  13.107   5.028   1.689
  132   2HG2  VAL  23          2HG2      VAL  23  12.543   6.554   1.008
  133   3HG2  VAL  23          3HG2      VAL  23  12.599   5.108   0.002
  134    H    HIS  24           H        HIS  24   9.113   7.402   2.108
  135    HA   HIS  24           HA       HIS  24  10.992   9.590   2.484
  136   1HB   HIS  24          2HB       HIS  24   9.527   9.397   0.442
  137   2HB   HIS  24          1HB       HIS  24   8.145   9.733   1.476
  138    HD1  HIS  24           1HD      HIS  24   8.118  11.766  -0.443
  139    HD2  HIS  24           2HD      HIS  24  10.902  11.991   2.633
  140    HE1  HIS  24           1HE      HIS  24   8.843  14.172  -0.366
  141    HE2  HIS  24           2HE      HIS  24  10.475  14.299   1.550
  142    H    ARG  25           H        ARG  25  11.018  10.885   4.185
  143    HA   ARG  25           HA       ARG  25   9.508  10.407   6.491
  144   1HB   ARG  25          2HB       ARG  25  11.738  11.461   6.468
  145   2HB   ARG  25          1HB       ARG  25  11.045  12.893   5.723
  146   1HG   ARG  25          2HG       ARG  25  11.330  13.350   8.032
  147   2HG   ARG  25          1HG       ARG  25   9.601  13.151   7.744
  148   1HD   ARG  25          2HD       ARG  25  10.295  12.015   9.790
  149   2HD   ARG  25          1HD       ARG  25   9.717  10.863   8.586
  150    HE   ARG  25           HE       ARG  25  12.459  11.031   8.259
  151   1HH1  ARG  25          1HH1      ARG  25  10.256  10.107  10.801
  152   2HH1  ARG  25          2HH1      ARG  25  11.328   8.924  11.472
  153   1HH2  ARG  25          1HH2      ARG  25  13.872   9.480   9.141
  154   2HH2  ARG  25          2HH2      ARG  25  13.383   8.570  10.530
  155    H    ASP  26           H        ASP  26   8.656  12.152   3.687
  156    HA   ASP  26           HA       ASP  26   6.772  13.847   5.075
  157   1HB   ASP  26          2HB       ASP  26   7.450  13.669   2.143
  158   2HB   ASP  26          1HB       ASP  26   6.362  14.852   2.861
  159    H    ILE  27           H        ILE  27   6.742  10.797   3.549
  160    HA   ILE  27           HA       ILE  27   3.881  10.991   3.047
  161    HB   ILE  27           HB       ILE  27   4.032   8.995   1.718
  162   1HG1  ILE  27          2HG1      ILE  27   6.933   8.918   2.578
  163   2HG1  ILE  27          1HG1      ILE  27   5.681   7.766   3.017
  164   1HG2  ILE  27          1HG2      ILE  27   5.782   9.782   0.025
  165   2HG2  ILE  27          2HG2      ILE  27   6.077  11.112   1.145
  166   3HG2  ILE  27          3HG2      ILE  27   4.477  10.894   0.436
  167   1HD1  ILE  27          1HD1      ILE  27   6.681   8.243   0.218
  168   2HD1  ILE  27          2HD1      ILE  27   5.504   7.031   0.722
  169   3HD1  ILE  27          3HD1      ILE  27   7.176   6.915   1.269
  170    H    GLN  28           H        GLN  28   6.175   9.518   5.145
  171    HA   GLN  28           HA       GLN  28   4.652   7.320   6.022
  172   1HB   GLN  28          2HB       GLN  28   6.149   7.229   7.924
  173   2HB   GLN  28          1HB       GLN  28   7.068   7.570   6.463
  174   1HG   GLN  28          2HG       GLN  28   7.247   9.892   7.058
  175   2HG   GLN  28          1HG       GLN  28   6.199   9.650   8.455
  176   1HE2  GLN  28          1HE2      GLN  28   7.204   9.455  10.311
  177   2HE2  GLN  28          2HE2      GLN  28   8.812   8.869  10.548
  178    H    GLY  29           H        GLY  29   3.432   7.027   7.932
  179   1HA   GLY  29          2HA       GLY  29   1.994   7.619   9.631
  180   2HA   GLY  29          1HA       GLY  29   2.710   9.222   9.613
  181    H    ILE  30           H        ILE  30   1.730   8.510   6.513
  182    HA   ILE  30           HA       ILE  30  -0.723  10.033   6.893
  183    HB   ILE  30           HB       ILE  30   0.852   9.595   4.358
  184   1HG1  ILE  30          2HG1      ILE  30   2.079  10.968   5.969
  185   2HG1  ILE  30          1HG1      ILE  30   1.523  11.947   4.612
  186   1HG2  ILE  30          1HG2      ILE  30  -0.839  11.859   4.210
  187   2HG2  ILE  30          2HG2      ILE  30  -1.812  10.508   4.788
  188   3HG2  ILE  30          3HG2      ILE  30  -0.921  10.368   3.272
  189   1HD1  ILE  30          1HD1      ILE  30   1.232  13.117   6.729
  190   2HD1  ILE  30          2HD1      ILE  30   0.221  11.800   7.327
  191   3HD1  ILE  30          3HD1      ILE  30  -0.326  12.786   5.971
  192    H    SER  31           H        SER  31  -2.666   9.146   6.491
  193    HA   SER  31           HA       SER  31  -2.739   6.392   5.523
  194   1HB   SER  31          2HB       SER  31  -5.086   6.413   6.296
  195   2HB   SER  31          1HB       SER  31  -3.982   6.910   7.578
  196    HG   SER  31           HG       SER  31  -5.065   8.693   7.678
  197    H    GLY  32           H        GLY  32  -4.250   5.742   3.846
  198   1HA   GLY  32          2HA       GLY  32  -5.515   7.759   2.237
  199   2HA   GLY  32          1HA       GLY  32  -4.055   7.121   1.498
  200    H    ARG  33           H        ARG  33  -6.086   6.770   0.009
  201    HA   ARG  33           HA       ARG  33  -7.271   4.169   0.560
  202   1HB   ARG  33          2HB       ARG  33  -8.084   6.366  -1.298
  203   2HB   ARG  33          1HB       ARG  33  -8.709   4.739  -1.469
  204   1HG   ARG  33          2HG       ARG  33 -10.132   6.341  -0.153
  205   2HG   ARG  33          1HG       ARG  33  -9.774   4.790   0.604
  206   1HD   ARG  33          2HD       ARG  33  -8.077   5.808   1.984
  207   2HD   ARG  33          1HD       ARG  33  -8.278   7.352   1.160
  208    HE   ARG  33           HE       ARG  33 -10.751   6.591   2.226
  209   1HH1  ARG  33          1HH1      ARG  33  -7.587   7.577   3.323
  210   2HH1  ARG  33          2HH1      ARG  33  -8.179   8.282   4.790
  211   1HH2  ARG  33          1HH2      ARG  33 -11.530   7.519   4.153
  212   2HH2  ARG  33          2HH2      ARG  33 -10.417   8.249   5.262
  213    H    VAL  34           H        VAL  34  -7.674   2.866  -1.556
  214    HA   VAL  34           HA       VAL  34  -4.973   2.351  -2.592
  215    HB   VAL  34           HB       VAL  34  -7.370   0.538  -2.766
  216   1HG1  VAL  34          1HG1      VAL  34  -5.758  -0.134  -4.349
  217   2HG1  VAL  34          2HG1      VAL  34  -5.539  -1.201  -2.961
  218   3HG1  VAL  34          3HG1      VAL  34  -4.426   0.142  -3.225
  219   1HG2  VAL  34          1HG2      VAL  34  -6.683   1.176  -0.420
  220   2HG2  VAL  34          2HG2      VAL  34  -5.162   0.344  -0.745
  221   3HG2  VAL  34          3HG2      VAL  34  -6.680  -0.548  -0.795
  222    H    VAL  35           H        VAL  35  -4.540   1.722  -4.745
  223    HA   VAL  35           HA       VAL  35  -6.602   2.265  -6.746
  224    HB   VAL  35           HB       VAL  35  -3.974   2.954  -7.755
  225   1HG1  VAL  35          1HG1      VAL  35  -5.544   3.462  -9.272
  226   2HG1  VAL  35          2HG1      VAL  35  -5.498   5.017  -8.439
  227   3HG1  VAL  35          3HG1      VAL  35  -6.760   3.845  -8.053
  228   1HG2  VAL  35          1HG2      VAL  35  -4.429   4.035  -5.292
  229   2HG2  VAL  35          2HG2      VAL  35  -4.951   5.304  -6.394
  230   3HG2  VAL  35          3HG2      VAL  35  -3.328   4.654  -6.508
  231    H    ASP  36           H        ASP  36  -3.301   1.187  -6.152
  232    HA   ASP  36           HA       ASP  36  -3.780  -1.378  -7.330
  233   1HB   ASP  36          2HB       ASP  36  -1.841   0.515  -8.675
  234   2HB   ASP  36          1HB       ASP  36  -2.002  -1.199  -9.044
  235    H    GLU  37           H        GLU  37  -1.744  -2.729  -7.286
  236    HA   GLU  37           HA       GLU  37   0.054  -1.850  -5.124
  237   1HB   GLU  37          2HB       GLU  37  -1.046  -4.637  -5.549
  238   2HB   GLU  37          1HB       GLU  37   0.148  -4.193  -4.339
  239   1HG   GLU  37          2HG       GLU  37  -1.896  -4.320  -3.202
  240   2HG   GLU  37          1HG       GLU  37  -1.571  -2.601  -3.405
  241    H    THR  38           H        THR  38   2.106  -1.735  -5.794
  242    HA   THR  38           HA       THR  38   2.930  -3.499  -8.011
  243    HB   THR  38           HB       THR  38   3.923  -0.720  -7.381
  244    HG1  THR  38           1HG      THR  38   2.312  -0.154  -8.575
  245   1HG2  THR  38          1HG2      THR  38   4.597  -2.480  -9.722
  246   2HG2  THR  38          2HG2      THR  38   5.677  -2.098  -8.383
  247   3HG2  THR  38          3HG2      THR  38   5.132  -0.818  -9.467
  248    H    ARG  39           H        ARG  39   5.116  -4.200  -8.053
  249    HA   ARG  39           HA       ARG  39   6.082  -5.475  -5.885
  250   1HB   ARG  39          2HB       ARG  39   8.291  -5.491  -6.966
  251   2HB   ARG  39          1HB       ARG  39   6.997  -5.792  -8.118
  252   1HG   ARG  39          2HG       ARG  39   7.120  -3.461  -8.859
  253   2HG   ARG  39          1HG       ARG  39   8.427  -3.173  -7.713
  254   1HD   ARG  39          2HD       ARG  39   9.797  -4.849  -8.859
  255   2HD   ARG  39          1HD       ARG  39   8.489  -5.128 -10.007
  256    HE   ARG  39           HE       ARG  39   9.089  -2.407 -10.049
  257   1HH1  ARG  39          1HH1      ARG  39  10.630  -5.431 -10.858
  258   2HH1  ARG  39          2HH1      ARG  39  11.602  -4.743 -12.115
  259   1HH2  ARG  39          1HH2      ARG  39  10.366  -1.501 -11.701
  260   2HH2  ARG  39          2HH2      ARG  39  11.453  -2.514 -12.593
  261    H    ASN  40           H        ASN  40   6.972  -2.158  -6.802
  262    HA   ASN  40           HA       ASN  40   7.819  -1.724  -4.030
  263   1HB   ASN  40          2HB       ASN  40   9.792  -0.460  -4.767
  264   2HB   ASN  40          1HB       ASN  40   9.867  -2.143  -5.262
  265   1HD2  ASN  40          1HD2      ASN  40   7.659  -0.599  -7.254
  266   2HD2  ASN  40          2HD2      ASN  40   8.715  -0.218  -8.556
  267    H    THR  41           H        THR  41   5.420  -0.965  -5.556
  268    HA   THR  41           HA       THR  41   5.490   1.858  -4.870
  269    HB   THR  41           HB       THR  41   4.695   0.919  -7.633
  270    HG1  THR  41           1HG      THR  41   6.772   2.659  -6.805
  271   1HG2  THR  41          1HG2      THR  41   4.288   3.218  -8.187
  272   2HG2  THR  41          2HG2      THR  41   4.705   3.723  -6.549
  273   3HG2  THR  41          3HG2      THR  41   3.260   2.754  -6.830
  274    H    LEU  42           H        LEU  42   3.669   2.483  -3.923
  275    HA   LEU  42           HA       LEU  42   1.350   0.675  -4.089
  276   1HB   LEU  42          2HB       LEU  42   2.552   0.933  -1.876
  277   2HB   LEU  42          1HB       LEU  42   1.999   2.592  -1.854
  278    HG   LEU  42           HG       LEU  42   0.604   1.167  -0.449
  279   1HD1  LEU  42          1HD1      LEU  42  -1.016   1.913  -2.870
  280   2HD1  LEU  42          2HD1      LEU  42  -0.332   3.123  -1.785
  281   3HD1  LEU  42          3HD1      LEU  42  -1.495   1.947  -1.174
  282   1HD2  LEU  42          1HD2      LEU  42   0.826  -0.961  -1.506
  283   2HD2  LEU  42          2HD2      LEU  42   0.136  -0.355  -3.013
  284   3HD2  LEU  42          3HD2      LEU  42  -0.879  -0.517  -1.580
  285    H    ARG  43           H        ARG  43  -0.075   1.517  -5.485
  286    HA   ARG  43           HA       ARG  43  -0.345   4.384  -5.789
  287   1HB   ARG  43          2HB       ARG  43  -0.618   2.349  -7.539
  288   2HB   ARG  43          1HB       ARG  43  -2.297   2.553  -7.065
  289   1HG   ARG  43          2HG       ARG  43  -2.187   4.916  -7.719
  290   2HG   ARG  43          1HG       ARG  43  -0.508   4.690  -8.206
  291   1HD   ARG  43          2HD       ARG  43  -1.216   3.030  -9.863
  292   2HD   ARG  43          1HD       ARG  43  -2.895   3.263  -9.378
  293    HE   ARG  43           HE       ARG  43  -1.826   5.747 -10.098
  294   1HH1  ARG  43          1HH1      ARG  43  -2.691   2.705 -11.574
  295   2HH1  ARG  43          2HH1      ARG  43  -3.046   3.410 -13.115
  296   1HH2  ARG  43          1HH2      ARG  43  -2.292   6.676 -12.126
  297   2HH2  ARG  43          2HH2      ARG  43  -2.819   5.664 -13.429
  298    H    ILE  44           H        ILE  44  -1.647   5.588  -4.599
  299    HA   ILE  44           HA       ILE  44  -3.757   4.307  -3.012
  300    HB   ILE  44           HB       ILE  44  -2.327   6.951  -2.675
  301   1HG1  ILE  44          2HG1      ILE  44  -2.284   4.411  -1.034
  302   2HG1  ILE  44          1HG1      ILE  44  -0.991   4.997  -2.077
  303   1HG2  ILE  44          1HG2      ILE  44  -3.966   6.048  -0.431
  304   2HG2  ILE  44          2HG2      ILE  44  -4.886   6.551  -1.848
  305   3HG2  ILE  44          3HG2      ILE  44  -3.738   7.661  -1.104
  306   1HD1  ILE  44          1HD1      ILE  44  -0.245   5.663  -0.023
  307   2HD1  ILE  44          2HD1      ILE  44  -1.868   5.974   0.590
  308   3HD1  ILE  44          3HD1      ILE  44  -1.120   7.107  -0.536
  309    H    GLU  45           H        GLU  45  -5.763   4.432  -3.800
  310    HA   GLU  45           HA       GLU  45  -6.615   6.990  -4.946
  311   1HB   GLU  45          2HB       GLU  45  -6.529   5.602  -6.842
  312   2HB   GLU  45          1HB       GLU  45  -7.197   4.225  -5.986
  313   1HG   GLU  45          2HG       GLU  45  -9.356   5.380  -5.856
  314   2HG   GLU  45          1HG       GLU  45  -8.666   6.747  -6.727
  315    H    MET  46           H        MET  46  -8.379   7.803  -4.275
  316    HA   MET  46           HA       MET  46  -9.876   6.521  -2.115
  317   1HB   MET  46          2HB       MET  46  -9.545   9.400  -2.971
  318   2HB   MET  46          1HB       MET  46 -10.698   8.895  -1.748
  319   1HG   MET  46          2HG       MET  46  -8.695   9.779  -0.738
  320   2HG   MET  46          1HG       MET  46  -8.877   8.073  -0.360
  321   1HE   MET  46          1HE       MET  46  -6.399   9.800  -3.623
  322   2HE   MET  46          2HE       MET  46  -5.869  10.545  -2.120
  323   3HE   MET  46          3HE       MET  46  -7.563  10.631  -2.599
  324    H    ASP  47           H        ASP  47 -11.954   5.972  -2.374
  325    HA   ASP  47           HA       ASP  47 -13.214   5.625  -4.748
  326   1HB   ASP  47          2HB       ASP  47 -14.546   6.264  -2.114
  327   2HB   ASP  47          1HB       ASP  47 -15.343   5.524  -3.499
  328    H    ASP  48           H        ASP  48 -12.992   8.591  -2.975
  329    HA   ASP  48           HA       ASP  48 -15.095  10.005  -4.186
  330   1HB   ASP  48          2HB       ASP  48 -12.488  11.030  -3.050
  331   2HB   ASP  48          1HB       ASP  48 -13.873  12.038  -3.458
  332    H    GLY  49           H        GLY  49 -12.212   8.849  -5.523
  333   1HA   GLY  49          2HA       GLY  49 -11.846   8.936  -7.874
  334   2HA   GLY  49          1HA       GLY  49 -12.645  10.500  -7.908
  335    H    ARG  50           H        ARG  50 -10.369   9.889  -5.400
  336    HA   ARG  50           HA       ARG  50  -8.489  11.747  -6.707
  337   1HB   ARG  50          2HB       ARG  50  -8.991  11.101  -3.808
  338   2HB   ARG  50          1HB       ARG  50  -7.563  11.977  -4.336
  339   1HG   ARG  50          2HG       ARG  50  -9.258  13.512  -3.562
  340   2HG   ARG  50          1HG       ARG  50  -8.997  13.718  -5.295
  341   1HD   ARG  50          2HD       ARG  50 -10.995  12.474  -5.794
  342   2HD   ARG  50          1HD       ARG  50 -11.221  12.078  -4.091
  343    HE   ARG  50           HE       ARG  50 -12.072  14.432  -5.399
  344   1HH1  ARG  50          1HH1      ARG  50 -10.738  13.314  -2.372
  345   2HH1  ARG  50          2HH1      ARG  50 -11.371  14.643  -1.461
  346   1HH2  ARG  50          1HH2      ARG  50 -12.910  16.175  -4.198
  347   2HH2  ARG  50          2HH2      ARG  50 -12.607  16.265  -2.495
  348    H    GLU  51           H        GLU  51  -6.557  11.012  -7.379
  349    HA   GLU  51           HA       GLU  51  -5.668   8.406  -6.333
  350   1HB   GLU  51          2HB       GLU  51  -4.662   7.970  -8.498
  351   2HB   GLU  51          1HB       GLU  51  -6.365   8.358  -8.694
  352   1HG   GLU  51          2HG       GLU  51  -5.780  10.627  -9.365
  353   2HG   GLU  51          1HG       GLU  51  -4.071  10.246  -9.166
  354    H    ILE  52           H        ILE  52  -3.547   8.133  -5.760
  355    HA   ILE  52           HA       ILE  52  -1.535  10.117  -6.292
  356    HB   ILE  52           HB       ILE  52  -2.698  11.158  -4.393
  357   1HG1  ILE  52          2HG1      ILE  52  -0.730  11.452  -2.936
  358   2HG1  ILE  52          1HG1      ILE  52   0.022  10.038  -3.674
  359   1HG2  ILE  52          1HG2      ILE  52  -1.802   9.176  -2.428
  360   2HG2  ILE  52          2HG2      ILE  52  -3.106   8.633  -3.482
  361   3HG2  ILE  52          3HG2      ILE  52  -3.306  10.093  -2.515
  362   1HD1  ILE  52          1HD1      ILE  52   0.934  12.109  -4.593
  363   2HD1  ILE  52          2HD1      ILE  52  -0.684  12.605  -5.100
  364   3HD1  ILE  52          3HD1      ILE  52   0.075  11.191  -5.834
  365    H    THR  53           H        THR  53   0.418   9.142  -6.375
  366    HA   THR  53           HA       THR  53   0.574   6.336  -5.695
  367    HB   THR  53           HB       THR  53   1.504   7.079  -7.812
  368    HG1  THR  53           1HG      THR  53   3.550   6.313  -6.005
  369   1HG2  THR  53          1HG2      THR  53   2.719   8.899  -8.085
  370   2HG2  THR  53          2HG2      THR  53   3.910   8.331  -6.915
  371   3HG2  THR  53          3HG2      THR  53   2.510   9.254  -6.370
  372    H    VAL  54           H        VAL  54   2.192   5.384  -4.385
  373    HA   VAL  54           HA       VAL  54   3.768   7.075  -2.635
  374    HB   VAL  54           HB       VAL  54   1.704   5.193  -1.474
  375   1HG1  VAL  54          1HG1      VAL  54   3.799   5.276  -0.188
  376   2HG1  VAL  54          2HG1      VAL  54   2.459   6.010   0.694
  377   3HG1  VAL  54          3HG1      VAL  54   3.662   7.032  -0.092
  378   1HG2  VAL  54          1HG2      VAL  54   0.874   7.390  -0.443
  379   2HG2  VAL  54          2HG2      VAL  54   0.503   7.091  -2.143
  380   3HG2  VAL  54          3HG2      VAL  54   1.816   8.186  -1.703
  381    HA   PRO  55           HA       PRO  55   6.460   3.596  -3.600
  382   1HB   PRO  55          2HB       PRO  55   8.028   4.841  -1.396
  383   2HB   PRO  55          1HB       PRO  55   8.546   4.365  -3.017
  384   1HG   PRO  55          2HG       PRO  55   8.164   6.926  -2.427
  385   2HG   PRO  55          1HG       PRO  55   7.665   6.278  -4.001
  386   1HD   PRO  55          2HD       PRO  55   5.999   6.953  -1.613
  387   2HD   PRO  55          1HD       PRO  55   5.644   7.179  -3.338
  388    H    LYS  56           H        LYS  56   6.072   1.605  -2.871
  389    HA   LYS  56           HA       LYS  56   5.556   1.191  -0.018
  390   1HB   LYS  56          2HB       LYS  56   3.849   0.006  -0.846
  391   2HB   LYS  56          1HB       LYS  56   4.515   0.040  -2.472
  392   1HG   LYS  56          2HG       LYS  56   5.935  -1.871  -1.922
  393   2HG   LYS  56          1HG       LYS  56   5.247  -1.910  -0.297
  394   1HD   LYS  56          2HD       LYS  56   3.023  -2.314  -1.266
  395   2HD   LYS  56          1HD       LYS  56   3.736  -2.306  -2.881
  396   1HE   LYS  56          2HE       LYS  56   4.398  -4.239  -0.661
  397   2HE   LYS  56          1HE       LYS  56   3.389  -4.586  -2.065
  398   1HZ   LYS  56          1HZ       LYS  56   6.288  -4.340  -1.874
  399   2HZ   LYS  56          2HZ       LYS  56   5.570  -3.748  -3.285
  400   3HZ   LYS  56          3HZ       LYS  56   5.349  -5.366  -2.840
  401    H    GLY  57           H        GLY  57   8.068   0.886  -2.232
  402   1HA   GLY  57          2HA       GLY  57   9.281  -1.525  -1.731
  403   2HA   GLY  57          1HA       GLY  57  10.163  -0.038  -2.029
  404    H    ILE  58           H        ILE  58   9.014   1.168   0.457
  405    HA   ILE  58           HA       ILE  58  10.134  -0.454   2.556
  406    HB   ILE  58           HB       ILE  58  11.220   2.324   2.111
  407   1HG1  ILE  58          2HG1      ILE  58  13.411   1.013   1.715
  408   2HG1  ILE  58          1HG1      ILE  58  12.368  -0.373   1.405
  409   1HG2  ILE  58          1HG2      ILE  58  11.013   1.242   4.457
  410   2HG2  ILE  58          2HG2      ILE  58  12.525   2.024   3.995
  411   3HG2  ILE  58          3HG2      ILE  58  12.387   0.266   3.941
  412   1HD1  ILE  58          1HD1      ILE  58  11.350   1.739  -0.133
  413   2HD1  ILE  58          2HD1      ILE  58  12.198   0.297  -0.690
  414   3HD1  ILE  58          3HD1      ILE  58  13.102   1.768  -0.332
  415    H    ALA  59           H        ALA  59   7.596  -0.096   2.548
  416    HA   ALA  59           HA       ALA  59   7.131   1.873   4.630
  417   1HB   ALA  59          1HB       ALA  59   6.616   2.717   2.175
  418   2HB   ALA  59          2HB       ALA  59   5.622   3.183   3.555
  419   3HB   ALA  59          3HB       ALA  59   5.092   1.884   2.484
  420    H    VAL  60           H        VAL  60   6.124   0.887   6.253
  421    HA   VAL  60           HA       VAL  60   4.561  -1.517   5.759
  422    HB   VAL  60           HB       VAL  60   6.075  -1.497   7.689
  423   1HG1  VAL  60          1HG1      VAL  60   5.313   1.091   8.037
  424   2HG1  VAL  60          2HG1      VAL  60   6.163   0.123   9.242
  425   3HG1  VAL  60          3HG1      VAL  60   4.409   0.283   9.316
  426   1HG2  VAL  60          1HG2      VAL  60   4.371  -2.138   9.444
  427   2HG2  VAL  60          2HG2      VAL  60   4.234  -2.973   7.897
  428   3HG2  VAL  60          3HG2      VAL  60   3.128  -1.656   8.288
  429    H    PHE  61           H        PHE  61   2.365  -1.622   5.758
  430    HA   PHE  61           HA       PHE  61   0.814   0.448   7.020
  431   1HB   PHE  61          2HB       PHE  61  -0.440   0.901   4.822
  432   2HB   PHE  61          1HB       PHE  61   1.121   1.674   5.059
  433    HD1  PHE  61           1HD      PHE  61  -0.015  -1.658   3.786
  434    HD2  PHE  61           2HD      PHE  61   2.335   1.831   3.147
  435    HE1  PHE  61           1HE      PHE  61   0.794  -2.593   1.659
  436    HE2  PHE  61           2HE      PHE  61   3.146   0.903   1.020
  437    HZ   PHE  61           HZ       PHE  61   2.374  -1.313   0.275
  438    H    HIS  62           H        HIS  62  -1.456   0.015   7.031
  439    HA   HIS  62           HA       HIS  62  -2.089  -2.805   6.453
  440   1HB   HIS  62          2HB       HIS  62  -3.268  -1.270   8.763
  441   2HB   HIS  62          1HB       HIS  62  -3.254  -3.011   8.500
  442    HD1  HIS  62           1HD      HIS  62  -0.339  -3.613   8.122
  443    HD2  HIS  62           2HD      HIS  62  -1.714  -0.883  10.933
  444    HE1  HIS  62           1HE      HIS  62   1.477  -3.462   9.855
  445    HE2  HIS  62           2HE      HIS  62   0.576  -1.882  11.599
  446    H    PHE  63           H        PHE  63  -4.007  -3.198   5.447
  447    HA   PHE  63           HA       PHE  63  -5.493  -0.853   4.548
  448   1HB   PHE  63          2HB       PHE  63  -5.607  -3.752   3.686
  449   2HB   PHE  63          1HB       PHE  63  -6.633  -2.487   3.021
  450    HD1  PHE  63           1HD      PHE  63  -2.976  -2.741   3.774
  451    HD2  PHE  63           2HD      PHE  63  -6.009  -1.943   0.897
  452    HE1  PHE  63           1HE      PHE  63  -1.251  -2.217   2.105
  453    HE2  PHE  63           2HE      PHE  63  -4.285  -1.421  -0.778
  454    HZ   PHE  63           HZ       PHE  63  -1.903  -1.557  -0.175
  455    H    ARG  64           H        ARG  64  -7.736  -0.638   4.795
  456    HA   ARG  64           HA       ARG  64  -8.998  -2.454   6.730
  457   1HB   ARG  64          2HB       ARG  64  -8.140  -0.259   7.741
  458   2HB   ARG  64          1HB       ARG  64  -9.391   0.537   6.801
  459   1HG   ARG  64          2HG       ARG  64  -9.863  -1.584   8.886
  460   2HG   ARG  64          1HG       ARG  64 -10.059   0.151   9.126
  461   1HD   ARG  64          2HD       ARG  64 -11.754   0.125   7.282
  462   2HD   ARG  64          1HD       ARG  64 -11.634  -1.635   7.280
  463    HE   ARG  64           HE       ARG  64 -13.022  -1.651   9.074
  464   1HH1  ARG  64          1HH1      ARG  64 -11.450   1.464   8.967
  465   2HH1  ARG  64          2HH1      ARG  64 -12.282   2.071  10.359
  466   1HH2  ARG  64          1HH2      ARG  64 -14.122  -0.850  10.901
  467   2HH2  ARG  64          2HH2      ARG  64 -13.801   0.758  11.455
  468    H    THR  65           H        THR  65 -10.751  -3.302   5.835
  469    HA   THR  65           HA       THR  65 -12.033  -1.955   3.591
  470    HB   THR  65           HB       THR  65 -12.533  -4.697   4.763
  471    HG1  THR  65           1HG      THR  65 -11.210  -5.444   3.177
  472   1HG2  THR  65          1HG2      THR  65 -14.419  -4.433   3.532
  473   2HG2  THR  65          2HG2      THR  65 -13.320  -4.995   2.272
  474   3HG2  THR  65          3HG2      THR  65 -13.676  -3.274   2.430
  475    HA   PRO  66           HA       PRO  66 -15.215  -0.041   6.050
  476   1HB   PRO  66          2HB       PRO  66 -16.838  -0.734   3.635
  477   2HB   PRO  66          1HB       PRO  66 -16.735   0.792   4.519
  478   1HG   PRO  66          2HG       PRO  66 -15.458   0.481   2.207
  479   2HG   PRO  66          1HG       PRO  66 -14.710   1.372   3.545
  480   1HD   PRO  66          2HD       PRO  66 -14.112  -1.354   2.514
  481   2HD   PRO  66          1HD       PRO  66 -13.029  -0.164   3.261
  482    H    GLN  67           H        GLN  67 -15.610  -3.153   4.481
  483    HA   GLN  67           HA       GLN  67 -18.020  -3.893   5.777
  484   1HB   GLN  67          2HB       GLN  67 -15.850  -5.494   4.431
  485   2HB   GLN  67          1HB       GLN  67 -17.276  -6.245   5.138
  486   1HG   GLN  67          2HG       GLN  67 -17.500  -5.909   2.727
  487   2HG   GLN  67          1HG       GLN  67 -18.716  -5.019   3.639
  488   1HE2  GLN  67          1HE2      GLN  67 -19.067  -3.047   2.951
  489   2HE2  GLN  67          2HE2      GLN  67 -17.931  -2.024   2.147
  490    H    GLY  68           H        GLY  68 -14.885  -3.525   6.980
  491   1HA   GLY  68          2HA       GLY  68 -14.512  -3.666   9.339
  492   2HA   GLY  68          1HA       GLY  68 -15.655  -4.998   9.403
  493    H    GLU  69           H        GLU  69 -12.794  -4.418   7.353
  494    HA   GLU  69           HA       GLU  69 -11.641  -6.890   8.472
  495   1HB   GLU  69          2HB       GLU  69 -11.492  -6.012   5.583
  496   2HB   GLU  69          1HB       GLU  69 -10.753  -7.452   6.264
  497   1HG   GLU  69          2HG       GLU  69 -12.962  -8.344   6.791
  498   2HG   GLU  69          1HG       GLU  69 -13.707  -6.898   6.110
  499    H    LEU  70           H        LEU  70  -9.414  -6.946   8.741
  500    HA   LEU  70           HA       LEU  70  -7.991  -4.416   8.245
  501   1HB   LEU  70          2HB       LEU  70  -8.628  -4.669  10.628
  502   2HB   LEU  70          1HB       LEU  70  -7.725  -6.169  10.692
  503    HG   LEU  70           HG       LEU  70  -6.526  -4.247  11.699
  504   1HD1  LEU  70          1HD1      LEU  70  -4.446  -4.895  10.945
  505   2HD1  LEU  70          2HD1      LEU  70  -4.982  -5.039   9.270
  506   3HD1  LEU  70          3HD1      LEU  70  -5.445  -6.265  10.450
  507   1HD2  LEU  70          1HD2      LEU  70  -6.436  -3.205   8.869
  508   2HD2  LEU  70          2HD2      LEU  70  -5.610  -2.509  10.265
  509   3HD2  LEU  70          3HD2      LEU  70  -7.374  -2.506  10.191
  510    H    VAL  71           H        VAL  71  -6.513  -4.824   6.741
  511    HA   VAL  71           HA       VAL  71  -5.089  -7.404   6.821
  512    HB   VAL  71           HB       VAL  71  -5.315  -5.509   4.478
  513   1HG1  VAL  71          1HG1      VAL  71  -4.721  -8.310   3.953
  514   2HG1  VAL  71          2HG1      VAL  71  -3.487  -7.517   4.928
  515   3HG1  VAL  71          3HG1      VAL  71  -3.930  -6.852   3.355
  516   1HG2  VAL  71          1HG2      VAL  71  -7.204  -6.512   3.791
  517   2HG2  VAL  71          2HG2      VAL  71  -7.377  -6.963   5.488
  518   3HG2  VAL  71          3HG2      VAL  71  -6.679  -8.104   4.340
  519    H    GLU  72           H        GLU  72  -2.871  -7.469   6.819
  520    HA   GLU  72           HA       GLU  72  -1.505  -4.896   7.258
  521   1HB   GLU  72          2HB       GLU  72  -1.453  -6.269   9.238
  522   2HB   GLU  72          1HB       GLU  72  -0.899  -7.660   8.318
  523   1HG   GLU  72          2HG       GLU  72   1.215  -6.539   7.873
  524   2HG   GLU  72          1HG       GLU  72   0.662  -5.126   8.768
  525    H    ILE  73           H        ILE  73   0.135  -4.311   5.934
  526    HA   ILE  73           HA       ILE  73   1.392  -6.382   4.277
  527    HB   ILE  73           HB       ILE  73   0.407  -3.730   3.208
  528   1HG1  ILE  73          2HG1      ILE  73  -0.943  -5.236   1.679
  529   2HG1  ILE  73          1HG1      ILE  73  -0.510  -6.573   2.740
  530   1HG2  ILE  73          1HG2      ILE  73   2.340  -5.713   2.210
  531   2HG2  ILE  73          2HG2      ILE  73   2.193  -3.991   1.860
  532   3HG2  ILE  73          3HG2      ILE  73   1.151  -5.150   1.034
  533   1HD1  ILE  73          1HD1      ILE  73  -1.577  -4.384   4.268
  534   2HD1  ILE  73          2HD1      ILE  73  -2.139  -6.050   4.149
  535   3HD1  ILE  73          3HD1      ILE  73  -2.688  -4.849   2.981
  536    H    ASP  74           H        ASP  74   3.447  -6.345   4.911
  537    HA   ASP  74           HA       ASP  74   4.658  -3.909   5.876
  538   1HB   ASP  74          2HB       ASP  74   5.769  -6.699   5.543
  539   2HB   ASP  74          1HB       ASP  74   6.643  -5.359   6.279
  540    H    GLY  75           H        GLY  75   5.026  -2.490   4.280
  541   1HA   GLY  75          2HA       GLY  75   6.069  -3.252   1.716
  542   2HA   GLY  75          1HA       GLY  75   5.801  -1.614   2.286
  543    H    ARG  76           H        ARG  76   7.484  -2.679   4.744
  544    HA   ARG  76           HA       ARG  76   9.978  -1.751   3.629
  545   1HB   ARG  76          2HB       ARG  76   9.174  -0.673   5.661
  546   2HB   ARG  76          1HB       ARG  76   9.162  -2.224   6.487
  547   1HG   ARG  76          2HG       ARG  76  11.598  -2.366   6.226
  548   2HG   ARG  76          1HG       ARG  76  11.592  -0.786   5.439
  549   1HD   ARG  76          2HD       ARG  76  12.204  -0.586   7.788
  550   2HD   ARG  76          1HD       ARG  76  10.670   0.221   7.466
  551    HE   ARG  76           HE       ARG  76  10.129  -2.392   8.302
  552   1HH1  ARG  76          1HH1      ARG  76  11.441   0.578   9.586
  553   2HH1  ARG  76          2HH1      ARG  76  10.931   0.249  11.207
  554   1HH2  ARG  76          1HH2      ARG  76   9.459  -2.826  10.436
  555   2HH2  ARG  76          2HH2      ARG  76   9.806  -1.684  11.690
  556    H    ALA  77           H        ALA  77   9.186  -4.215   6.013
  557    HA   ALA  77           HA       ALA  77  11.566  -5.688   5.434
  558   1HB   ALA  77          1HB       ALA  77   9.261  -6.304   7.265
  559   2HB   ALA  77          2HB       ALA  77  10.800  -5.562   7.704
  560   3HB   ALA  77          3HB       ALA  77  10.751  -7.241   7.168
  561    H    LEU  78           H        LEU  78   8.477  -5.698   4.031
  562    HA   LEU  78           HA       LEU  78   9.037  -8.344   2.873
  563   1HB   LEU  78          2HB       LEU  78   6.362  -7.311   3.798
  564   2HB   LEU  78          1HB       LEU  78   6.556  -8.715   2.772
  565    HG   LEU  78           HG       LEU  78   6.206  -9.411   5.059
  566   1HD1  LEU  78          1HD1      LEU  78   8.195 -10.801   5.379
  567   2HD1  LEU  78          2HD1      LEU  78   9.062  -9.827   4.191
  568   3HD1  LEU  78          3HD1      LEU  78   7.667 -10.786   3.695
  569   1HD2  LEU  78          1HD2      LEU  78   7.664  -7.159   5.740
  570   2HD2  LEU  78          2HD2      LEU  78   8.722  -8.499   6.178
  571   3HD2  LEU  78          3HD2      LEU  78   7.090  -8.410   6.840
  572    H    VAL  79           H        VAL  79   9.873  -6.066   1.620
  573    HA   VAL  79           HA       VAL  79   8.014  -4.954  -0.185
  574    HB   VAL  79           HB       VAL  79  10.161  -3.875   0.268
  575   1HG1  VAL  79          1HG1      VAL  79  11.362  -6.176   0.273
  576   2HG1  VAL  79          2HG1      VAL  79  12.231  -4.742  -0.272
  577   3HG1  VAL  79          3HG1      VAL  79  11.567  -5.873  -1.452
  578   1HG2  VAL  79          1HG2      VAL  79   8.889  -3.606  -1.932
  579   2HG2  VAL  79          2HG2      VAL  79  10.151  -4.614  -2.642
  580   3HG2  VAL  79          3HG2      VAL  79  10.570  -3.073  -1.896
  581    H    ALA  80           H        ALA  80   6.811  -6.340  -1.368
  582    HA   ALA  80           HA       ALA  80   7.493  -8.814  -2.364
  583   1HB   ALA  80          1HB       ALA  80   5.700  -7.028  -3.950
  584   2HB   ALA  80          2HB       ALA  80   5.225  -7.558  -2.338
  585   3HB   ALA  80          3HB       ALA  80   5.542  -8.748  -3.599
  586    H    ARG  81           H        ARG  81   8.679  -9.576  -4.000
  587    HA   ARG  81           HA       ARG  81   9.732  -7.652  -5.956
  588   1HB   ARG  81          2HB       ARG  81  11.742  -9.069  -6.115
  589   2HB   ARG  81          1HB       ARG  81  11.514  -8.430  -4.497
  590   1HG   ARG  81          2HG       ARG  81  10.464 -11.141  -5.147
  591   2HG   ARG  81          1HG       ARG  81  12.189 -10.923  -4.866
  592   1HD   ARG  81          2HD       ARG  81  11.722  -9.953  -2.676
  593   2HD   ARG  81          1HD       ARG  81   9.994 -10.138  -2.950
  594    HE   ARG  81           HE       ARG  81  11.246 -12.634  -3.249
  595   1HH1  ARG  81          1HH1      ARG  81  10.431 -10.313  -0.774
  596   2HH1  ARG  81          2HH1      ARG  81  10.332 -11.500   0.483
  597   1HH2  ARG  81          1HH2      ARG  81  11.117 -14.196  -1.598
  598   2HH2  ARG  81          2HH2      ARG  81  10.722 -13.705   0.016
  599    HA   PRO  82           HA       PRO  82   7.702 -10.231  -8.946
  600   1HB   PRO  82          2HB       PRO  82   8.835  -9.265 -11.196
  601   2HB   PRO  82          1HB       PRO  82   7.650  -8.342 -10.265
  602   1HG   PRO  82          2HG       PRO  82  10.636  -8.126 -10.275
  603   2HG   PRO  82          1HG       PRO  82   9.420  -6.835 -10.285
  604   1HD   PRO  82          2HD       PRO  82  10.732  -7.625  -8.036
  605   2HD   PRO  82          1HD       PRO  82   9.085  -6.965  -8.015
  606    H    GLU  83           H        GLU  83   8.268 -11.675 -10.822
  607    HA   GLU  83           HA       GLU  83  10.339 -13.466 -10.046
  608   1HB   GLU  83          2HB       GLU  83   8.677 -13.402 -12.570
  609   2HB   GLU  83          1HB       GLU  83   9.686 -14.745 -12.051
  610   1HG   GLU  83          2HG       GLU  83   8.302 -15.012 -10.055
  611   2HG   GLU  83          1HG       GLU  83   7.288 -13.671 -10.584
  612    H    GLU  84           H        GLU  84  10.218 -10.745 -12.123
  613    HA   GLU  84           HA       GLU  84  12.470 -11.510 -13.752
  614   1HB   GLU  84          2HB       GLU  84  11.093  -8.837 -13.434
  615   2HB   GLU  84          1HB       GLU  84  12.301  -9.220 -14.652
  616   1HG   GLU  84          2HG       GLU  84   9.596 -10.513 -14.383
  617   2HG   GLU  84          1HG       GLU  84  10.050  -9.290 -15.569
  618    H    ARG  85           H        ARG  85  11.917  -9.691 -10.822
  619    HA   ARG  85           HA       ARG  85  14.806  -9.511 -10.432
  620   1HB   ARG  85          2HB       ARG  85  13.921  -7.351 -11.448
  621   2HB   ARG  85          1HB       ARG  85  13.027  -7.119  -9.954
  622   1HG   ARG  85          2HG       ARG  85  16.022  -7.385 -10.137
  623   2HG   ARG  85          1HG       ARG  85  15.146  -5.858 -10.046
  624   1HD   ARG  85          2HD       ARG  85  15.247  -8.033  -7.959
  625   2HD   ARG  85          1HD       ARG  85  15.959  -6.427  -7.859
  626    HE   ARG  85           HE       ARG  85  13.294  -7.125  -7.224
  627   1HH1  ARG  85          1HH1      ARG  85  15.201  -4.570  -8.650
  628   2HH1  ARG  85          2HH1      ARG  85  14.039  -3.336  -8.296
  629   1HH2  ARG  85          1HH2      ARG  85  11.769  -5.500  -6.755
  630   2HH2  ARG  85          2HH2      ARG  85  12.093  -3.864  -7.218
  631    H    ILE  86           H        ILE  86  14.824 -10.912  -8.747
  632    HA   ILE  86           HA       ILE  86  12.962 -10.496  -6.521
  633    HB   ILE  86           HB       ILE  86  14.929 -12.745  -6.993
  634   1HG1  ILE  86          2HG1      ILE  86  11.928 -12.648  -7.370
  635   2HG1  ILE  86          1HG1      ILE  86  13.125 -12.701  -8.662
  636   1HG2  ILE  86          1HG2      ILE  86  12.672 -13.175  -5.177
  637   2HG2  ILE  86          2HG2      ILE  86  13.849 -11.993  -4.606
  638   3HG2  ILE  86          3HG2      ILE  86  14.367 -13.629  -5.010
  639   1HD1  ILE  86          1HD1      ILE  86  12.061 -14.847  -6.988
  640   2HD1  ILE  86          2HD1      ILE  86  13.809 -14.889  -7.215
  641   3HD1  ILE  86          3HD1      ILE  86  12.736 -14.898  -8.615
  Start of MODEL   10
    1    H    ARG   9           H        ARG   9  -7.901 -15.420  -1.760
    2    HA   ARG   9           HA       ARG   9  -9.003 -12.883  -0.789
    3   1HB   ARG   9          2HB       ARG   9  -6.814 -13.135   0.280
    4   2HB   ARG   9          1HB       ARG   9  -6.068 -13.410  -1.287
    5   1HG   ARG   9          2HG       ARG   9  -6.670 -11.144  -1.976
    6   2HG   ARG   9          1HG       ARG   9  -7.418 -10.868  -0.401
    7   1HD   ARG   9          2HD       ARG   9  -5.260 -11.230   0.689
    8   2HD   ARG   9          1HD       ARG   9  -4.511 -11.511  -0.883
    9    HE   ARG   9           HE       ARG   9  -5.764  -9.011  -0.937
   10   1HH1  ARG   9          1HH1      ARG   9  -3.072 -10.591   0.625
   11   2HH1  ARG   9          2HH1      ARG   9  -2.155  -9.134   0.800
   12   1HH2  ARG   9          1HH2      ARG   9  -4.558  -7.092  -0.707
   13   2HH2  ARG   9          2HH2      ARG   9  -2.999  -7.146   0.043
   14    H    HIS  10           H        HIS  10  -9.053 -11.206  -2.339
   15    HA   HIS  10           HA       HIS  10  -8.024 -11.514  -4.970
   16   1HB   HIS  10          2HB       HIS  10  -9.840 -13.154  -5.134
   17   2HB   HIS  10          1HB       HIS  10 -11.000 -11.934  -4.619
   18    HD1  HIS  10           1HD      HIS  10 -11.868 -12.972  -7.124
   19    HD2  HIS  10           2HD      HIS  10  -8.834 -10.135  -7.025
   20    HE1  HIS  10           1HE      HIS  10 -11.819 -11.959  -9.426
   21    HE2  HIS  10           2HE      HIS  10 -10.030 -10.188  -9.318
   22    H    GLU  11           H        GLU  11 -10.905 -10.101  -3.404
   23    HA   GLU  11           HA       GLU  11 -10.851  -7.690  -4.836
   24   1HB   GLU  11          2HB       GLU  11 -12.825  -8.464  -3.610
   25   2HB   GLU  11          1HB       GLU  11 -11.977  -8.248  -2.086
   26   1HG   GLU  11          2HG       GLU  11 -11.844  -5.848  -2.492
   27   2HG   GLU  11          1HG       GLU  11 -12.680  -6.060  -4.029
   28    H    LEU  12           H        LEU  12 -10.359  -5.537  -4.033
   29    HA   LEU  12           HA       LEU  12  -8.826  -5.022  -1.746
   30   1HB   LEU  12          2HB       LEU  12  -7.124  -6.373  -2.860
   31   2HB   LEU  12          1HB       LEU  12  -7.222  -5.351  -4.281
   32    HG   LEU  12           HG       LEU  12  -6.359  -3.451  -2.972
   33   1HD1  LEU  12          1HD1      LEU  12  -5.249  -4.241  -0.733
   34   2HD1  LEU  12          2HD1      LEU  12  -6.538  -5.444  -0.768
   35   3HD1  LEU  12          3HD1      LEU  12  -6.935  -3.726  -0.773
   36   1HD2  LEU  12          1HD2      LEU  12  -4.368  -5.549  -2.402
   37   2HD2  LEU  12          2HD2      LEU  12  -4.211  -4.049  -3.316
   38   3HD2  LEU  12          3HD2      LEU  12  -4.952  -5.465  -4.064
   39    H    ILE  13           H        ILE  13  -9.435  -4.151  -5.110
   40    HA   ILE  13           HA       ILE  13  -8.780  -1.425  -4.937
   41    HB   ILE  13           HB       ILE  13 -10.862  -2.700  -6.719
   42   1HG1  ILE  13          2HG1      ILE  13  -8.701  -3.820  -6.945
   43   2HG1  ILE  13          1HG1      ILE  13  -9.044  -2.857  -8.379
   44   1HG2  ILE  13          1HG2      ILE  13 -11.112  -0.731  -7.734
   45   2HG2  ILE  13          2HG2      ILE  13  -9.372  -0.456  -7.797
   46   3HG2  ILE  13          3HG2      ILE  13 -10.283  -0.019  -6.352
   47   1HD1  ILE  13          1HD1      ILE  13  -7.067  -2.337  -6.196
   48   2HD1  ILE  13          2HD1      ILE  13  -7.624  -1.045  -7.261
   49   3HD1  ILE  13          3HD1      ILE  13  -6.801  -2.451  -7.937
   50    H    GLY  14           H        GLY  14  -9.892   0.358  -4.302
   51   1HA   GLY  14          2HA       GLY  14 -11.860   1.588  -3.789
   52   2HA   GLY  14          1HA       GLY  14 -12.710   0.071  -3.546
   53    H    LEU  15           H        LEU  15 -10.476  -0.987  -1.895
   54    HA   LEU  15           HA       LEU  15 -11.453  -0.201   0.637
   55   1HB   LEU  15          2HB       LEU  15  -8.868  -1.614  -0.018
   56   2HB   LEU  15          1HB       LEU  15  -9.650  -1.568   1.550
   57    HG   LEU  15           HG       LEU  15 -10.712  -2.921  -0.930
   58   1HD1  LEU  15          1HD1      LEU  15 -10.144  -4.387   1.571
   59   2HD1  LEU  15          2HD1      LEU  15  -8.749  -3.828   0.646
   60   3HD1  LEU  15          3HD1      LEU  15  -9.944  -4.883  -0.110
   61   1HD2  LEU  15          1HD2      LEU  15 -12.202  -3.822   1.164
   62   2HD2  LEU  15          2HD2      LEU  15 -12.702  -2.559   0.040
   63   3HD2  LEU  15          3HD2      LEU  15 -11.981  -2.125   1.589
   64    H    SER  16           H        SER  16 -10.193   0.746   2.395
   65    HA   SER  16           HA       SER  16  -8.538   2.957   1.411
   66   1HB   SER  16          2HB       SER  16 -10.443   3.580   2.833
   67   2HB   SER  16          1HB       SER  16  -9.834   2.538   4.118
   68    HG   SER  16           HG       SER  16  -9.063   5.061   3.397
   69    H    VAL  17           H        VAL  17  -6.551   3.479   2.522
   70    HA   VAL  17           HA       VAL  17  -5.414   1.393   4.202
   71    HB   VAL  17           HB       VAL  17  -4.853   0.605   1.986
   72   1HG1  VAL  17          1HG1      VAL  17  -3.487   1.932   0.448
   73   2HG1  VAL  17          2HG1      VAL  17  -3.599   3.310   1.545
   74   3HG1  VAL  17          3HG1      VAL  17  -5.051   2.687   0.758
   75   1HG2  VAL  17          1HG2      VAL  17  -2.765   0.022   2.554
   76   2HG2  VAL  17          2HG2      VAL  17  -3.083   0.946   4.021
   77   3HG2  VAL  17          3HG2      VAL  17  -2.222   1.696   2.676
   78    H    ARG  18           H        ARG  18  -4.389   2.308   5.834
   79    HA   ARG  18           HA       ARG  18  -3.402   5.059   5.511
   80   1HB   ARG  18          2HB       ARG  18  -3.542   5.215   7.967
   81   2HB   ARG  18          1HB       ARG  18  -5.094   4.826   7.239
   82   1HG   ARG  18          2HG       ARG  18  -4.758   2.465   7.829
   83   2HG   ARG  18          1HG       ARG  18  -3.233   2.894   8.606
   84   1HD   ARG  18          2HD       ARG  18  -4.438   4.365  10.150
   85   2HD   ARG  18          1HD       ARG  18  -5.959   3.937   9.371
   86    HE   ARG  18           HE       ARG  18  -6.001   2.064  10.656
   87   1HH1  ARG  18          1HH1      ARG  18  -2.684   3.133  10.429
   88   2HH1  ARG  18          2HH1      ARG  18  -2.083   1.890  11.473
   89   1HH2  ARG  18          1HH2      ARG  18  -5.211   0.434  12.032
   90   2HH2  ARG  18          2HH2      ARG  18  -3.517   0.359  12.387
   91    H    ILE  19           H        ILE  19  -1.310   5.572   5.921
   92    HA   ILE  19           HA       ILE  19   0.557   3.360   6.086
   93    HB   ILE  19           HB       ILE  19   1.138   6.311   5.824
   94   1HG1  ILE  19          2HG1      ILE  19  -0.208   5.505   3.942
   95   2HG1  ILE  19          1HG1      ILE  19   1.443   5.849   3.429
   96   1HG2  ILE  19          1HG2      ILE  19   3.067   4.423   4.737
   97   2HG2  ILE  19          2HG2      ILE  19   2.855   4.263   6.479
   98   3HG2  ILE  19          3HG2      ILE  19   3.314   5.818   5.786
   99   1HD1  ILE  19          1HD1      ILE  19   0.857   3.823   2.377
  100   2HD1  ILE  19          2HD1      ILE  19   0.146   3.168   3.855
  101   3HD1  ILE  19          3HD1      ILE  19   1.895   3.364   3.729
  102    H    ALA  20           H        ALA  20   1.497   2.689   7.887
  103    HA   ALA  20           HA       ALA  20   1.197   4.233  10.330
  104   1HB   ALA  20          1HB       ALA  20   2.531   2.012  11.105
  105   2HB   ALA  20          2HB       ALA  20   1.705   1.416   9.665
  106   3HB   ALA  20          3HB       ALA  20   0.773   2.120  10.987
  107    H    ARG  21           H        ARG  21   3.628   3.271   8.065
  108    HA   ARG  21           HA       ARG  21   5.464   5.218   8.999
  109   1HB   ARG  21          2HB       ARG  21   5.912   3.496  10.683
  110   2HB   ARG  21          1HB       ARG  21   6.211   2.324   9.410
  111   1HG   ARG  21          2HG       ARG  21   8.126   3.653   8.651
  112   2HG   ARG  21          1HG       ARG  21   7.839   4.791   9.971
  113   1HD   ARG  21          2HD       ARG  21   8.186   2.991  11.593
  114   2HD   ARG  21          1HD       ARG  21   8.471   1.856  10.275
  115    HE   ARG  21           HE       ARG  21  10.256   3.994  10.001
  116   1HH1  ARG  21          1HH1      ARG  21   9.631   1.322  12.159
  117   2HH1  ARG  21          2HH1      ARG  21  11.285   1.167  12.648
  118   1HH2  ARG  21          1HH2      ARG  21  12.432   3.791  10.643
  119   2HH2  ARG  21          2HH2      ARG  21  12.875   2.568  11.787
  120    H    SER  22           H        SER  22   7.136   5.586   7.553
  121    HA   SER  22           HA       SER  22   7.269   3.881   5.178
  122   1HB   SER  22          2HB       SER  22   6.832   6.873   5.092
  123   2HB   SER  22          1HB       SER  22   7.154   5.851   3.692
  124    HG   SER  22           HG       SER  22   4.995   5.942   3.743
  125    H    VAL  23           H        VAL  23   9.136   4.455   3.758
  126    HA   VAL  23           HA       VAL  23  11.517   4.470   5.175
  127    HB   VAL  23           HB       VAL  23  12.601   4.717   3.024
  128   1HG1  VAL  23          1HG1      VAL  23  11.050   2.954   1.772
  129   2HG1  VAL  23          2HG1      VAL  23  10.331   2.871   3.381
  130   3HG1  VAL  23          3HG1      VAL  23  12.048   2.533   3.165
  131   1HG2  VAL  23          1HG2      VAL  23  11.311   6.461   2.001
  132   2HG2  VAL  23          2HG2      VAL  23   9.861   5.459   2.019
  133   3HG2  VAL  23          3HG2      VAL  23  11.213   5.034   0.968
  134    H    HIS  24           H        HIS  24   9.876   7.105   3.445
  135    HA   HIS  24           HA       HIS  24  11.845   8.995   4.525
  136   1HB   HIS  24          2HB       HIS  24   9.839   9.274   2.283
  137   2HB   HIS  24          1HB       HIS  24  10.828  10.602   2.880
  138    HD1  HIS  24           1HD      HIS  24  11.336  10.179   0.078
  139    HD2  HIS  24           2HD      HIS  24  13.195   7.785   2.920
  140    HE1  HIS  24           1HE      HIS  24  13.361   9.225  -1.067
  141    HE2  HIS  24           2HE      HIS  24  14.416   7.705   0.641
  142    H    ARG  25           H        ARG  25  11.296  10.585   5.913
  143    HA   ARG  25           HA       ARG  25   8.972  10.310   7.474
  144   1HB   ARG  25          2HB       ARG  25  11.050  11.248   8.353
  145   2HB   ARG  25          1HB       ARG  25  10.895  12.631   7.280
  146   1HG   ARG  25          2HG       ARG  25   8.847  13.299   8.434
  147   2HG   ARG  25          1HG       ARG  25   9.007  11.911   9.511
  148   1HD   ARG  25          2HD       ARG  25  10.969  14.189   9.237
  149   2HD   ARG  25          1HD       ARG  25   9.839  13.946  10.571
  150    HE   ARG  25           HE       ARG  25  12.380  12.744  10.274
  151   1HH1  ARG  25          1HH1      ARG  25   9.144  12.067  11.401
  152   2HH1  ARG  25          2HH1      ARG  25   9.649  10.810  12.477
  153   1HH2  ARG  25          1HH2      ARG  25  13.042  11.094  11.695
  154   2HH2  ARG  25          2HH2      ARG  25  11.861  10.261  12.647
  155    H    ASP  26           H        ASP  26   9.489  11.934   4.514
  156    HA   ASP  26           HA       ASP  26   7.397  13.867   4.880
  157   1HB   ASP  26          2HB       ASP  26   9.351  14.419   3.514
  158   2HB   ASP  26          1HB       ASP  26   8.953  13.112   2.404
  159    H    ILE  27           H        ILE  27   7.286  10.625   4.355
  160    HA   ILE  27           HA       ILE  27   4.742  10.859   2.950
  161    HB   ILE  27           HB       ILE  27   5.197   8.684   1.833
  162   1HG1  ILE  27          2HG1      ILE  27   7.997   9.171   2.875
  163   2HG1  ILE  27          1HG1      ILE  27   6.925   7.860   3.350
  164   1HG2  ILE  27          1HG2      ILE  27   6.934   9.669   0.224
  165   2HG2  ILE  27          2HG2      ILE  27   6.889  11.094   1.262
  166   3HG2  ILE  27          3HG2      ILE  27   5.423  10.550   0.448
  167   1HD1  ILE  27          1HD1      ILE  27   7.960   8.268   0.555
  168   2HD1  ILE  27          2HD1      ILE  27   7.051   6.885   1.165
  169   3HD1  ILE  27          3HD1      ILE  27   8.688   7.191   1.745
  170    H    GLN  28           H        GLN  28   6.463   9.574   5.596
  171    HA   GLN  28           HA       GLN  28   4.802   7.328   6.118
  172   1HB   GLN  28          2HB       GLN  28   5.911   7.238   8.278
  173   2HB   GLN  28          1HB       GLN  28   7.091   7.518   7.005
  174   1HG   GLN  28          2HG       GLN  28   7.100   9.907   7.563
  175   2HG   GLN  28          1HG       GLN  28   5.953   9.596   8.860
  176   1HE2  GLN  28          1HE2      GLN  28   7.925   6.955   8.754
  177   2HE2  GLN  28          2HE2      GLN  28   9.104   7.436   9.916
  178    H    GLY  29           H        GLY  29   3.162   7.086   7.654
  179   1HA   GLY  29          2HA       GLY  29   1.517   7.753   9.150
  180   2HA   GLY  29          1HA       GLY  29   2.207   9.367   9.148
  181    H    ILE  30           H        ILE  30   1.871   8.691   5.979
  182    HA   ILE  30           HA       ILE  30  -0.442  10.345   5.731
  183    HB   ILE  30           HB       ILE  30   1.068   8.846   3.589
  184   1HG1  ILE  30          2HG1      ILE  30   2.503  10.419   4.797
  185   2HG1  ILE  30          1HG1      ILE  30   2.178  11.003   3.167
  186   1HG2  ILE  30          1HG2      ILE  30   0.022  10.951   2.313
  187   2HG2  ILE  30          2HG2      ILE  30  -1.226  10.711   3.536
  188   3HG2  ILE  30          3HG2      ILE  30  -0.804   9.397   2.438
  189   1HD1  ILE  30          1HD1      ILE  30   0.493  12.536   4.052
  190   2HD1  ILE  30          2HD1      ILE  30   2.072  12.812   4.790
  191   3HD1  ILE  30          3HD1      ILE  30   0.818  11.950   5.684
  192    H    SER  31           H        SER  31  -2.452   9.815   4.858
  193    HA   SER  31           HA       SER  31  -3.079   6.934   4.798
  194   1HB   SER  31          2HB       SER  31  -4.088   8.008   6.757
  195   2HB   SER  31          1HB       SER  31  -4.850   9.214   5.720
  196    HG   SER  31           HG       SER  31  -5.346   6.420   5.733
  197    H    GLY  32           H        GLY  32  -4.781   6.286   3.320
  198   1HA   GLY  32          2HA       GLY  32  -5.976   8.054   1.478
  199   2HA   GLY  32          1HA       GLY  32  -4.508   7.403   0.768
  200    H    ARG  33           H        ARG  33  -5.975   6.527  -0.832
  201    HA   ARG  33           HA       ARG  33  -7.224   4.053   0.097
  202   1HB   ARG  33          2HB       ARG  33  -8.171   5.896  -2.056
  203   2HB   ARG  33          1HB       ARG  33  -8.723   4.234  -1.928
  204   1HG   ARG  33          2HG       ARG  33  -9.520   4.633   0.314
  205   2HG   ARG  33          1HG       ARG  33  -8.953   6.300   0.242
  206   1HD   ARG  33          2HD       ARG  33 -10.526   6.778  -1.543
  207   2HD   ARG  33          1HD       ARG  33 -11.047   5.095  -1.565
  208    HE   ARG  33           HE       ARG  33 -11.415   6.054   1.020
  209   1HH1  ARG  33          1HH1      ARG  33 -12.659   6.675  -2.180
  210   2HH1  ARG  33          2HH1      ARG  33 -14.214   7.178  -1.612
  211   1HH2  ARG  33          1HH2      ARG  33 -13.460   6.718   1.768
  212   2HH2  ARG  33          2HH2      ARG  33 -14.670   7.205   0.629
  213    H    VAL  34           H        VAL  34  -7.534   2.490  -1.826
  214    HA   VAL  34           HA       VAL  34  -4.798   2.024  -2.773
  215    HB   VAL  34           HB       VAL  34  -7.053   0.038  -2.554
  216   1HG1  VAL  34          1HG1      VAL  34  -5.212  -1.625  -2.702
  217   2HG1  VAL  34          2HG1      VAL  34  -4.101  -0.304  -3.072
  218   3HG1  VAL  34          3HG1      VAL  34  -5.427  -0.679  -4.174
  219   1HG2  VAL  34          1HG2      VAL  34  -6.239  -0.614  -0.474
  220   2HG2  VAL  34          2HG2      VAL  34  -6.153   1.146  -0.410
  221   3HG2  VAL  34          3HG2      VAL  34  -4.695   0.203  -0.714
  222    H    VAL  35           H        VAL  35  -4.312   1.151  -4.821
  223    HA   VAL  35           HA       VAL  35  -6.427   1.229  -6.820
  224    HB   VAL  35           HB       VAL  35  -5.196   3.444  -6.856
  225   1HG1  VAL  35          1HG1      VAL  35  -3.086   3.668  -7.688
  226   2HG1  VAL  35          2HG1      VAL  35  -3.054   2.027  -8.335
  227   3HG1  VAL  35          3HG1      VAL  35  -2.956   2.299  -6.602
  228   1HG2  VAL  35          1HG2      VAL  35  -6.552   2.316  -8.723
  229   2HG2  VAL  35          2HG2      VAL  35  -4.983   2.008  -9.468
  230   3HG2  VAL  35          3HG2      VAL  35  -5.498   3.665  -9.152
  231    H    ASP  36           H        ASP  36  -2.987   0.515  -6.210
  232    HA   ASP  36           HA       ASP  36  -3.283  -2.130  -7.259
  233   1HB   ASP  36          2HB       ASP  36  -2.948  -0.709  -9.314
  234   2HB   ASP  36          1HB       ASP  36  -1.366  -0.271  -8.678
  235    H    GLU  37           H        GLU  37  -1.186  -3.360  -7.074
  236    HA   GLU  37           HA       GLU  37   0.613  -2.166  -5.070
  237   1HB   GLU  37          2HB       GLU  37  -0.471  -4.990  -5.043
  238   2HB   GLU  37          1HB       GLU  37   0.742  -4.358  -3.937
  239   1HG   GLU  37          2HG       GLU  37  -0.881  -2.749  -3.076
  240   2HG   GLU  37          1HG       GLU  37  -2.096  -3.383  -4.186
  241    H    THR  38           H        THR  38   2.767  -2.438  -5.463
  242    HA   THR  38           HA       THR  38   3.504  -4.335  -7.597
  243    HB   THR  38           HB       THR  38   4.775  -1.646  -7.069
  244    HG1  THR  38           1HG      THR  38   2.881  -2.495  -8.986
  245   1HG2  THR  38          1HG2      THR  38   6.147  -3.534  -8.163
  246   2HG2  THR  38          2HG2      THR  38   6.108  -1.947  -8.927
  247   3HG2  THR  38          3HG2      THR  38   5.110  -3.255  -9.560
  248    H    ARG  39           H        ARG  39   5.483  -5.396  -7.411
  249    HA   ARG  39           HA       ARG  39   6.254  -6.248  -4.898
  250   1HB   ARG  39          2HB       ARG  39   6.738  -7.307  -7.156
  251   2HB   ARG  39          1HB       ARG  39   8.103  -6.208  -7.257
  252   1HG   ARG  39          2HG       ARG  39   8.991  -8.225  -6.465
  253   2HG   ARG  39          1HG       ARG  39   8.873  -7.188  -5.044
  254   1HD   ARG  39          2HD       ARG  39   6.780  -9.211  -5.819
  255   2HD   ARG  39          1HD       ARG  39   8.111  -9.560  -4.719
  256    HE   ARG  39           HE       ARG  39   6.893  -7.335  -3.685
  257   1HH1  ARG  39          1HH1      ARG  39   5.902 -10.582  -4.490
  258   2HH1  ARG  39          2HH1      ARG  39   4.681 -10.646  -3.264
  259   1HH2  ARG  39          1HH2      ARG  39   5.284  -7.415  -2.076
  260   2HH2  ARG  39          2HH2      ARG  39   4.328  -8.848  -1.897
  261    H    ASN  40           H        ASN  40   7.124  -3.312  -6.479
  262    HA   ASN  40           HA       ASN  40   9.028  -2.793  -4.308
  263   1HB   ASN  40          2HB       ASN  40  10.549  -1.645  -5.787
  264   2HB   ASN  40          1HB       ASN  40  10.293  -3.283  -6.359
  265   1HD2  ASN  40          1HD2      ASN  40   7.510  -1.792  -7.208
  266   2HD2  ASN  40          2HD2      ASN  40   7.946  -1.230  -8.773
  267    H    THR  41           H        THR  41   6.141  -1.840  -5.484
  268    HA   THR  41           HA       THR  41   6.400   0.722  -4.198
  269    HB   THR  41           HB       THR  41   7.197   1.249  -6.474
  270    HG1  THR  41           1HG      THR  41   4.637   2.353  -5.968
  271   1HG2  THR  41          1HG2      THR  41   4.459   0.346  -7.313
  272   2HG2  THR  41          2HG2      THR  41   6.016  -0.285  -7.856
  273   3HG2  THR  41          3HG2      THR  41   5.522   1.348  -8.302
  274    H    LEU  42           H        LEU  42   4.383   1.844  -3.966
  275    HA   LEU  42           HA       LEU  42   2.073   0.023  -4.079
  276   1HB   LEU  42          2HB       LEU  42   2.957   0.656  -1.789
  277   2HB   LEU  42          1HB       LEU  42   2.486   2.298  -2.141
  278    HG   LEU  42           HG       LEU  42   0.869   1.064  -0.712
  279   1HD1  LEU  42          1HD1      LEU  42  -0.830   2.281  -1.542
  280   2HD1  LEU  42          2HD1      LEU  42  -0.722   1.528  -3.132
  281   3HD1  LEU  42          3HD1      LEU  42   0.363   2.850  -2.708
  282   1HD2  LEU  42          1HD2      LEU  42   1.302  -1.038  -2.369
  283   2HD2  LEU  42          2HD2      LEU  42  -0.223  -0.422  -3.005
  284   3HD2  LEU  42          3HD2      LEU  42  -0.099  -0.884  -1.308
  285    H    ARG  43           H        ARG  43   0.176   0.770  -4.908
  286    HA   ARG  43           HA       ARG  43   0.216   3.518  -5.957
  287   1HB   ARG  43          2HB       ARG  43   0.216   1.273  -7.454
  288   2HB   ARG  43          1HB       ARG  43  -1.511   1.480  -7.255
  289   1HG   ARG  43          2HG       ARG  43  -1.345   3.738  -8.196
  290   2HG   ARG  43          1HG       ARG  43   0.395   3.534  -8.360
  291   1HD   ARG  43          2HD       ARG  43  -0.027   1.587  -9.849
  292   2HD   ARG  43          1HD       ARG  43  -1.749   1.950  -9.771
  293    HE   ARG  43           HE       ARG  43   0.174   3.223 -11.410
  294   1HH1  ARG  43          1HH1      ARG  43  -2.721   3.857  -9.571
  295   2HH1  ARG  43          2HH1      ARG  43  -3.150   5.259 -10.490
  296   1HH2  ARG  43          1HH2      ARG  43  -0.390   5.062 -12.625
  297   2HH2  ARG  43          2HH2      ARG  43  -1.828   5.941 -12.226
  298    H    ILE  44           H        ILE  44  -1.320   4.810  -5.179
  299    HA   ILE  44           HA       ILE  44  -3.482   3.631  -3.567
  300    HB   ILE  44           HB       ILE  44  -2.022   6.259  -3.397
  301   1HG1  ILE  44          2HG1      ILE  44  -2.364   3.956  -1.474
  302   2HG1  ILE  44          1HG1      ILE  44  -0.908   4.359  -2.378
  303   1HG2  ILE  44          1HG2      ILE  44  -4.711   6.049  -2.811
  304   2HG2  ILE  44          2HG2      ILE  44  -3.601   7.284  -2.231
  305   3HG2  ILE  44          3HG2      ILE  44  -3.918   5.859  -1.250
  306   1HD1  ILE  44          1HD1      ILE  44  -0.553   5.129  -0.192
  307   2HD1  ILE  44          2HD1      ILE  44  -2.155   5.859  -0.102
  308   3HD1  ILE  44          3HD1      ILE  44  -0.921   6.565  -1.146
  309    H    GLU  45           H        GLU  45  -5.538   3.764  -4.321
  310    HA   GLU  45           HA       GLU  45  -6.243   6.197  -5.793
  311   1HB   GLU  45          2HB       GLU  45  -6.235   4.575  -7.530
  312   2HB   GLU  45          1HB       GLU  45  -7.070   3.386  -6.538
  313   1HG   GLU  45          2HG       GLU  45  -9.078   4.788  -6.585
  314   2HG   GLU  45          1HG       GLU  45  -8.227   5.960  -7.589
  315    H    MET  46           H        MET  46  -8.149   7.047  -5.380
  316    HA   MET  46           HA       MET  46  -9.689   5.982  -3.115
  317   1HB   MET  46          2HB       MET  46  -9.137   8.827  -3.977
  318   2HB   MET  46          1HB       MET  46 -10.295   8.400  -2.727
  319   1HG   MET  46          2HG       MET  46  -8.619   7.643  -1.276
  320   2HG   MET  46          1HG       MET  46  -7.420   7.569  -2.565
  321   1HE   MET  46          1HE       MET  46  -6.207   9.090  -3.473
  322   2HE   MET  46          2HE       MET  46  -5.485  10.314  -2.427
  323   3HE   MET  46          3HE       MET  46  -6.668  10.785  -3.644
  324    H    ASP  47           H        ASP  47 -11.754   5.503  -3.463
  325    HA   ASP  47           HA       ASP  47 -12.974   5.292  -5.873
  326   1HB   ASP  47          2HB       ASP  47 -13.866   4.308  -3.812
  327   2HB   ASP  47          1HB       ASP  47 -14.356   5.905  -3.257
  328    H    ASP  48           H        ASP  48 -12.650   8.189  -4.007
  329    HA   ASP  48           HA       ASP  48 -14.669   9.740  -5.183
  330   1HB   ASP  48          2HB       ASP  48 -11.998  10.619  -4.069
  331   2HB   ASP  48          1HB       ASP  48 -13.354  11.688  -4.415
  332    H    GLY  49           H        GLY  49 -11.866   8.451  -6.565
  333   1HA   GLY  49          2HA       GLY  49 -11.508   8.567  -8.916
  334   2HA   GLY  49          1HA       GLY  49 -12.212  10.176  -8.913
  335    H    ARG  50           H        ARG  50  -9.978   9.383  -6.424
  336    HA   ARG  50           HA       ARG  50  -7.991  11.147  -7.687
  337   1HB   ARG  50          2HB       ARG  50  -8.295  10.385  -4.780
  338   2HB   ARG  50          1HB       ARG  50  -7.114  11.514  -5.428
  339   1HG   ARG  50          2HG       ARG  50 -10.105  11.856  -5.465
  340   2HG   ARG  50          1HG       ARG  50  -8.967  12.696  -4.410
  341   1HD   ARG  50          2HD       ARG  50  -7.913  13.723  -6.360
  342   2HD   ARG  50          1HD       ARG  50  -9.032  12.871  -7.422
  343    HE   ARG  50           HE       ARG  50 -10.516  14.357  -5.572
  344   1HH1  ARG  50          1HH1      ARG  50  -8.377  14.866  -8.280
  345   2HH1  ARG  50          2HH1      ARG  50  -9.102  16.372  -8.731
  346   1HH2  ARG  50          1HH2      ARG  50 -11.473  16.339  -6.161
  347   2HH2  ARG  50          2HH2      ARG  50 -10.859  17.210  -7.527
  348    H    GLU  51           H        GLU  51  -5.691  10.625  -7.326
  349    HA   GLU  51           HA       GLU  51  -5.084   7.865  -6.682
  350   1HB   GLU  51          2HB       GLU  51  -4.569   8.996  -9.435
  351   2HB   GLU  51          1HB       GLU  51  -3.934   7.467  -8.844
  352   1HG   GLU  51          2HG       GLU  51  -6.215   6.626  -8.583
  353   2HG   GLU  51          1HG       GLU  51  -6.843   8.157  -9.189
  354    H    ILE  52           H        ILE  52  -3.028   7.549  -6.016
  355    HA   ILE  52           HA       ILE  52  -0.920   9.458  -6.523
  356    HB   ILE  52           HB       ILE  52  -2.085  10.530  -4.644
  357   1HG1  ILE  52          2HG1      ILE  52  -0.154  10.701  -3.102
  358   2HG1  ILE  52          1HG1      ILE  52   0.572   9.295  -3.879
  359   1HG2  ILE  52          1HG2      ILE  52  -2.938   8.304  -3.749
  360   2HG2  ILE  52          2HG2      ILE  52  -2.446   9.516  -2.567
  361   3HG2  ILE  52          3HG2      ILE  52  -1.377   8.164  -2.944
  362   1HD1  ILE  52          1HD1      ILE  52   0.662  10.551  -6.005
  363   2HD1  ILE  52          2HD1      ILE  52   1.591  11.325  -4.719
  364   3HD1  ILE  52          3HD1      ILE  52   0.010  11.962  -5.175
  365    H    THR  53           H        THR  53   1.179   8.658  -5.831
  366    HA   THR  53           HA       THR  53   1.163   5.743  -5.474
  367    HB   THR  53           HB       THR  53   2.225   6.610  -7.513
  368    HG1  THR  53           1HG      THR  53   4.083   5.513  -5.672
  369   1HG2  THR  53          1HG2      THR  53   4.629   7.586  -6.202
  370   2HG2  THR  53          2HG2      THR  53   3.226   8.628  -5.971
  371   3HG2  THR  53          3HG2      THR  53   3.758   8.215  -7.600
  372    H    VAL  54           H        VAL  54   2.723   4.728  -4.117
  373    HA   VAL  54           HA       VAL  54   4.123   6.380  -2.167
  374    HB   VAL  54           HB       VAL  54   2.171   4.235  -1.315
  375   1HG1  VAL  54          1HG1      VAL  54   4.143   4.323   0.117
  376   2HG1  VAL  54          2HG1      VAL  54   2.730   4.948   0.968
  377   3HG1  VAL  54          3HG1      VAL  54   3.935   6.062   0.320
  378   1HG2  VAL  54          1HG2      VAL  54   2.042   7.236  -1.248
  379   2HG2  VAL  54          2HG2      VAL  54   1.091   6.240  -0.146
  380   3HG2  VAL  54          3HG2      VAL  54   0.860   6.095  -1.889
  381    HA   PRO  55           HA       PRO  55   7.191   3.234  -2.901
  382   1HB   PRO  55          2HB       PRO  55   8.335   4.017  -0.295
  383   2HB   PRO  55          1HB       PRO  55   9.052   4.088  -1.907
  384   1HG   PRO  55          2HG       PRO  55   8.292   6.308  -0.621
  385   2HG   PRO  55          1HG       PRO  55   8.111   6.147  -2.379
  386   1HD   PRO  55          2HD       PRO  55   6.044   5.864  -0.226
  387   2HD   PRO  55          1HD       PRO  55   5.925   6.665  -1.809
  388    H    LYS  56           H        LYS  56   7.353   1.124  -2.498
  389    HA   LYS  56           HA       LYS  56   6.088   0.032  -0.085
  390   1HB   LYS  56          2HB       LYS  56   6.657  -1.095  -2.805
  391   2HB   LYS  56          1HB       LYS  56   6.371  -2.168  -1.446
  392   1HG   LYS  56          2HG       LYS  56   4.475  -0.017  -2.320
  393   2HG   LYS  56          1HG       LYS  56   4.370  -1.695  -2.842
  394   1HD   LYS  56          2HD       LYS  56   4.306  -0.825   0.044
  395   2HD   LYS  56          1HD       LYS  56   2.860  -1.069  -0.935
  396   1HE   LYS  56          2HE       LYS  56   3.145  -3.075   0.252
  397   2HE   LYS  56          1HE       LYS  56   3.735  -3.413  -1.373
  398   1HZ   LYS  56          1HZ       LYS  56   5.788  -2.454   0.383
  399   2HZ   LYS  56          2HZ       LYS  56   5.767  -3.828  -0.604
  400   3HZ   LYS  56          3HZ       LYS  56   5.074  -3.884   0.937
  401    H    GLY  57           H        GLY  57   9.143   0.827  -1.089
  402   1HA   GLY  57          2HA       GLY  57  10.767  -1.340  -0.653
  403   2HA   GLY  57          1HA       GLY  57  11.214   0.304  -0.233
  404    H    ILE  58           H        ILE  58   9.569   0.863   1.881
  405    HA   ILE  58           HA       ILE  58   9.679  -1.255   3.818
  406    HB   ILE  58           HB       ILE  58  11.271   1.252   4.371
  407   1HG1  ILE  58          2HG1      ILE  58  13.243  -0.393   4.431
  408   2HG1  ILE  58          1HG1      ILE  58  12.206  -1.491   3.531
  409   1HG2  ILE  58          1HG2      ILE  58  10.096  -0.027   6.243
  410   2HG2  ILE  58          2HG2      ILE  58  11.810   0.332   6.446
  411   3HG2  ILE  58          3HG2      ILE  58  11.298  -1.286   5.966
  412   1HD1  ILE  58          1HD1      ILE  58  13.034  -0.542   1.709
  413   2HD1  ILE  58          2HD1      ILE  58  13.742   0.785   2.630
  414   3HD1  ILE  58          3HD1      ILE  58  12.061   0.870   2.111
  415    H    ALA  59           H        ALA  59   7.393  -0.406   3.172
  416    HA   ALA  59           HA       ALA  59   6.692   1.706   5.091
  417   1HB   ALA  59          1HB       ALA  59   4.736   2.154   3.470
  418   2HB   ALA  59          2HB       ALA  59   5.744   1.302   2.299
  419   3HB   ALA  59          3HB       ALA  59   6.345   2.764   3.079
  420    H    VAL  60           H        VAL  60   5.644   0.852   6.779
  421    HA   VAL  60           HA       VAL  60   3.949  -1.483   6.441
  422    HB   VAL  60           HB       VAL  60   5.357  -1.315   8.452
  423   1HG1  VAL  60          1HG1      VAL  60   5.404   0.443   9.852
  424   2HG1  VAL  60          2HG1      VAL  60   3.662   0.701   9.752
  425   3HG1  VAL  60          3HG1      VAL  60   4.719   1.318   8.482
  426   1HG2  VAL  60          1HG2      VAL  60   2.383  -1.250   8.938
  427   2HG2  VAL  60          2HG2      VAL  60   3.571  -1.773  10.132
  428   3HG2  VAL  60          3HG2      VAL  60   3.385  -2.666   8.623
  429    H    PHE  61           H        PHE  61   1.781  -1.413   6.147
  430    HA   PHE  61           HA       PHE  61   0.262   0.836   7.135
  431   1HB   PHE  61          2HB       PHE  61  -0.753   1.267   4.856
  432   2HB   PHE  61          1HB       PHE  61   0.897   1.827   5.084
  433    HD1  PHE  61           1HD      PHE  61   2.365   1.467   3.388
  434    HD2  PHE  61           2HD      PHE  61  -0.882  -1.239   3.888
  435    HE1  PHE  61           1HE      PHE  61   3.066   0.263   1.363
  436    HE2  PHE  61           2HE      PHE  61  -0.179  -2.451   1.861
  437    HZ   PHE  61           HZ       PHE  61   1.793  -1.700   0.599
  438    H    HIS  62           H        HIS  62  -1.932   0.466   7.296
  439    HA   HIS  62           HA       HIS  62  -2.750  -2.319   6.784
  440   1HB   HIS  62          2HB       HIS  62  -3.870  -0.503   8.919
  441   2HB   HIS  62          1HB       HIS  62  -4.084  -2.241   8.763
  442    HD1  HIS  62           1HD      HIS  62  -1.405  -3.407   8.695
  443    HD2  HIS  62           2HD      HIS  62  -2.203  -0.029  10.973
  444    HE1  HIS  62           1HE      HIS  62   0.391  -3.345  10.451
  445    HE2  HIS  62           2HE      HIS  62  -0.167  -1.342  11.876
  446    H    PHE  63           H        PHE  63  -4.795  -2.714   5.949
  447    HA   PHE  63           HA       PHE  63  -6.041  -0.418   4.635
  448   1HB   PHE  63          2HB       PHE  63  -6.433  -3.389   4.231
  449   2HB   PHE  63          1HB       PHE  63  -7.296  -2.143   3.341
  450    HD1  PHE  63           1HD      PHE  63  -3.705  -2.634   4.262
  451    HD2  PHE  63           2HD      PHE  63  -6.576  -2.042   1.178
  452    HE1  PHE  63           1HE      PHE  63  -1.902  -2.565   2.602
  453    HE2  PHE  63           2HE      PHE  63  -4.770  -1.977  -0.492
  454    HZ   PHE  63           HZ       PHE  63  -2.428  -2.238   0.219
  455    H    ARG  64           H        ARG  64  -8.314  -0.078   4.712
  456    HA   ARG  64           HA       ARG  64  -9.779  -1.458   6.829
  457   1HB   ARG  64          2HB       ARG  64  -8.642   0.657   7.712
  458   2HB   ARG  64          1HB       ARG  64  -9.736   1.557   6.674
  459   1HG   ARG  64          2HG       ARG  64 -10.614  -0.334   8.847
  460   2HG   ARG  64          1HG       ARG  64 -10.474   1.413   9.030
  461   1HD   ARG  64          2HD       ARG  64 -12.103   1.654   7.143
  462   2HD   ARG  64          1HD       ARG  64 -12.327  -0.092   7.192
  463    HE   ARG  64           HE       ARG  64 -13.730   0.215   8.947
  464   1HH1  ARG  64          1HH1      ARG  64 -11.577   2.960   8.808
  465   2HH1  ARG  64          2HH1      ARG  64 -12.302   3.753  10.166
  466   1HH2  ARG  64          1HH2      ARG  64 -14.688   1.261  10.727
  467   2HH2  ARG  64          2HH2      ARG  64 -14.069   2.791  11.255
  468    H    THR  65           H        THR  65 -11.694  -2.048   6.060
  469    HA   THR  65           HA       THR  65 -12.745  -0.696   3.685
  470    HB   THR  65           HB       THR  65 -13.591  -3.312   4.949
  471    HG1  THR  65           1HG      THR  65 -12.125  -4.233   3.759
  472   1HG2  THR  65          1HG2      THR  65 -15.039  -1.836   3.178
  473   2HG2  THR  65          2HG2      THR  65 -15.135  -3.586   3.370
  474   3HG2  THR  65          3HG2      THR  65 -14.112  -2.892   2.112
  475    HA   PRO  66           HA       PRO  66 -15.752   1.591   6.020
  476   1HB   PRO  66          2HB       PRO  66 -17.762   1.442   4.061
  477   2HB   PRO  66          1HB       PRO  66 -16.554   2.717   4.227
  478   1HG   PRO  66          2HG       PRO  66 -16.571   0.346   2.427
  479   2HG   PRO  66          1HG       PRO  66 -15.942   1.977   2.136
  480   1HD   PRO  66          2HD       PRO  66 -14.300  -0.074   2.640
  481   2HD   PRO  66          1HD       PRO  66 -13.963   1.550   3.278
  482    H    GLN  67           H        GLN  67 -16.407  -1.524   4.580
  483    HA   GLN  67           HA       GLN  67 -18.916  -1.990   5.806
  484   1HB   GLN  67          2HB       GLN  67 -16.848  -3.974   4.843
  485   2HB   GLN  67          1HB       GLN  67 -18.517  -4.357   5.243
  486   1HG   GLN  67          2HG       GLN  67 -17.601  -2.530   3.033
  487   2HG   GLN  67          1HG       GLN  67 -18.205  -4.176   2.844
  488   1HE2  GLN  67          1HE2      GLN  67 -19.033  -1.049   2.538
  489   2HE2  GLN  67          2HE2      GLN  67 -20.742  -1.160   2.759
  490    H    GLY  68           H        GLY  68 -15.786  -1.832   7.092
  491   1HA   GLY  68          2HA       GLY  68 -15.485  -1.850   9.468
  492   2HA   GLY  68          1HA       GLY  68 -16.757  -3.057   9.583
  493    H    GLU  69           H        GLU  69 -13.861  -2.928   7.517
  494    HA   GLU  69           HA       GLU  69 -12.948  -5.405   8.834
  495   1HB   GLU  69          2HB       GLU  69 -12.726  -4.748   5.892
  496   2HB   GLU  69          1HB       GLU  69 -12.094  -6.190   6.674
  497   1HG   GLU  69          2HG       GLU  69 -14.996  -5.423   6.454
  498   2HG   GLU  69          1HG       GLU  69 -14.168  -6.663   5.511
  499    H    LEU  70           H        LEU  70 -10.765  -5.638   9.183
  500    HA   LEU  70           HA       LEU  70  -9.074  -3.329   8.489
  501   1HB   LEU  70          2HB       LEU  70  -9.709  -3.183  10.834
  502   2HB   LEU  70          1HB       LEU  70  -9.147  -4.821  11.109
  503    HG   LEU  70           HG       LEU  70  -6.840  -4.106  10.602
  504   1HD1  LEU  70          1HD1      LEU  70  -8.054  -1.347  10.447
  505   2HD1  LEU  70          2HD1      LEU  70  -7.349  -2.249   9.107
  506   3HD1  LEU  70          3HD1      LEU  70  -6.329  -1.716  10.443
  507   1HD2  LEU  70          1HD2      LEU  70  -6.493  -2.797  12.649
  508   2HD2  LEU  70          2HD2      LEU  70  -7.615  -4.133  12.911
  509   3HD2  LEU  70          3HD2      LEU  70  -8.228  -2.489  12.741
  510    H    VAL  71           H        VAL  71  -7.472  -3.945   7.209
  511    HA   VAL  71           HA       VAL  71  -6.286  -6.616   7.621
  512    HB   VAL  71           HB       VAL  71  -6.440  -5.098   5.012
  513   1HG1  VAL  71          1HG1      VAL  71  -5.696  -7.306   4.072
  514   2HG1  VAL  71          2HG1      VAL  71  -5.349  -7.810   5.726
  515   3HG1  VAL  71          3HG1      VAL  71  -4.484  -6.445   5.019
  516   1HG2  VAL  71          1HG2      VAL  71  -8.637  -5.846   5.535
  517   2HG2  VAL  71          2HG2      VAL  71  -8.044  -7.423   6.052
  518   3HG2  VAL  71          3HG2      VAL  71  -7.977  -6.972   4.349
  519    H    GLU  72           H        GLU  72  -3.978  -6.779   7.074
  520    HA   GLU  72           HA       GLU  72  -2.577  -4.208   7.412
  521   1HB   GLU  72          2HB       GLU  72  -0.907  -5.379   8.787
  522   2HB   GLU  72          1HB       GLU  72  -2.511  -5.456   9.500
  523   1HG   GLU  72          2HG       GLU  72  -2.779  -7.730   8.649
  524   2HG   GLU  72          1HG       GLU  72  -1.168  -7.651   7.938
  525    H    ILE  73           H        ILE  73  -0.583  -3.948   6.392
  526    HA   ILE  73           HA       ILE  73   0.443  -6.085   4.708
  527    HB   ILE  73           HB       ILE  73  -0.437  -3.440   3.543
  528   1HG1  ILE  73          2HG1      ILE  73  -2.281  -5.047   3.900
  529   2HG1  ILE  73          1HG1      ILE  73  -1.979  -4.754   2.190
  530   1HG2  ILE  73          1HG2      ILE  73   1.230  -5.671   2.451
  531   2HG2  ILE  73          2HG2      ILE  73   1.512  -3.931   2.386
  532   3HG2  ILE  73          3HG2      ILE  73   0.265  -4.662   1.374
  533   1HD1  ILE  73          1HD1      ILE  73  -0.997  -6.861   1.892
  534   2HD1  ILE  73          2HD1      ILE  73  -2.410  -7.153   2.909
  535   3HD1  ILE  73          3HD1      ILE  73  -0.799  -7.110   3.626
  536    H    ASP  74           H        ASP  74   2.484  -6.116   5.410
  537    HA   ASP  74           HA       ASP  74   3.806  -3.755   6.357
  538   1HB   ASP  74          2HB       ASP  74   4.142  -6.063   7.297
  539   2HB   ASP  74          1HB       ASP  74   5.030  -6.465   5.830
  540    H    GLY  75           H        GLY  75   5.212  -2.462   5.349
  541   1HA   GLY  75          2HA       GLY  75   5.646  -2.885   2.505
  542   2HA   GLY  75          1HA       GLY  75   5.929  -1.405   3.380
  543    H    ARG  76           H        ARG  76   7.440  -3.416   5.358
  544    HA   ARG  76           HA       ARG  76   9.984  -2.936   4.075
  545   1HB   ARG  76          2HB       ARG  76  11.004  -3.467   6.190
  546   2HB   ARG  76          1HB       ARG  76   9.669  -2.360   6.462
  547   1HG   ARG  76          2HG       ARG  76   8.267  -4.221   7.171
  548   2HG   ARG  76          1HG       ARG  76   9.599  -5.338   6.889
  549   1HD   ARG  76          2HD       ARG  76  10.927  -4.181   8.581
  550   2HD   ARG  76          1HD       ARG  76   9.604  -3.047   8.852
  551    HE   ARG  76           HE       ARG  76   8.641  -5.650   9.228
  552   1HH1  ARG  76          1HH1      ARG  76  10.834  -3.387  10.728
  553   2HH1  ARG  76          2HH1      ARG  76  10.602  -4.026  12.320
  554   1HH2  ARG  76          1HH2      ARG  76   8.333  -6.490  11.321
  555   2HH2  ARG  76          2HH2      ARG  76   9.181  -5.788  12.657
  556    H    ALA  77           H        ALA  77   8.015  -5.590   5.123
  557    HA   ALA  77           HA       ALA  77   9.930  -7.617   4.501
  558   1HB   ALA  77          1HB       ALA  77   7.662  -9.014   4.700
  559   2HB   ALA  77          2HB       ALA  77   7.167  -7.541   5.532
  560   3HB   ALA  77          3HB       ALA  77   8.568  -8.447   6.103
  561    H    LEU  78           H        LEU  78   8.254  -5.660   2.497
  562    HA   LEU  78           HA       LEU  78   8.037  -7.722   0.418
  563   1HB   LEU  78          2HB       LEU  78   6.300  -5.306   0.879
  564   2HB   LEU  78          1HB       LEU  78   6.289  -6.223  -0.613
  565    HG   LEU  78           HG       LEU  78   4.426  -6.869   0.824
  566   1HD1  LEU  78          1HD1      LEU  78   5.884  -9.327   1.170
  567   2HD1  LEU  78          2HD1      LEU  78   6.257  -8.594  -0.389
  568   3HD1  LEU  78          3HD1      LEU  78   4.582  -8.942   0.046
  569   1HD2  LEU  78          1HD2      LEU  78   4.584  -7.310   3.016
  570   2HD2  LEU  78          2HD2      LEU  78   6.139  -6.486   2.913
  571   3HD2  LEU  78          3HD2      LEU  78   6.066  -8.245   2.821
  572    H    VAL  79           H        VAL  79  10.381  -6.601   0.837
  573    HA   VAL  79           HA       VAL  79  11.149  -4.230  -0.279
  574    HB   VAL  79           HB       VAL  79  12.626  -6.850  -0.585
  575   1HG1  VAL  79          1HG1      VAL  79  14.634  -5.302  -0.462
  576   2HG1  VAL  79          2HG1      VAL  79  13.504  -3.981  -0.765
  577   3HG1  VAL  79          3HG1      VAL  79  13.699  -5.266  -1.957
  578   1HG2  VAL  79          1HG2      VAL  79  13.801  -5.664   1.515
  579   2HG2  VAL  79          2HG2      VAL  79  12.471  -6.812   1.669
  580   3HG2  VAL  79          3HG2      VAL  79  12.152  -5.079   1.728
  581    H    ALA  80           H        ALA  80  12.252  -3.801  -2.356
  582    HA   ALA  80           HA       ALA  80  10.630  -3.947  -4.535
  583   1HB   ALA  80          1HB       ALA  80  12.706  -2.552  -4.228
  584   2HB   ALA  80          2HB       ALA  80  12.448  -3.203  -5.844
  585   3HB   ALA  80          3HB       ALA  80  13.624  -3.954  -4.771
  586    H    ARG  81           H        ARG  81  11.004  -5.087  -6.675
  587    HA   ARG  81           HA       ARG  81  10.864  -7.876  -6.183
  588   1HB   ARG  81          2HB       ARG  81  10.850  -8.010  -8.743
  589   2HB   ARG  81          1HB       ARG  81   9.510  -7.219  -7.940
  590   1HG   ARG  81          2HG       ARG  81  11.712  -5.450  -8.710
  591   2HG   ARG  81          1HG       ARG  81  10.847  -6.202 -10.053
  592   1HD   ARG  81          2HD       ARG  81   8.717  -5.435  -8.843
  593   2HD   ARG  81          1HD       ARG  81   9.781  -4.394  -7.900
  594    HE   ARG  81           HE       ARG  81   9.853  -2.988  -9.687
  595   1HH1  ARG  81          1HH1      ARG  81   9.029  -6.175 -10.847
  596   2HH1  ARG  81          2HH1      ARG  81   8.796  -5.656 -12.482
  597   1HH2  ARG  81          1HH2      ARG  81   9.535  -2.303 -11.835
  598   2HH2  ARG  81          2HH2      ARG  81   9.082  -3.459 -13.043
  599    HA   PRO  82           HA       PRO  82  15.276  -8.632  -6.169
  600   1HB   PRO  82          2HB       PRO  82  14.320 -11.420  -6.486
  601   2HB   PRO  82          1HB       PRO  82  15.454 -10.744  -5.312
  602   1HG   PRO  82          2HG       PRO  82  12.975 -11.370  -4.586
  603   2HG   PRO  82          1HG       PRO  82  13.762  -9.907  -3.961
  604   1HD   PRO  82          2HD       PRO  82  11.682 -10.180  -6.091
  605   2HD   PRO  82          1HD       PRO  82  11.860  -8.933  -4.839
  606    H    GLU  83           H        GLU  83  13.566 -10.952  -8.224
  607    HA   GLU  83           HA       GLU  83  15.610 -10.490 -10.275
  608   1HB   GLU  83          2HB       GLU  83  13.729 -12.823  -9.941
  609   2HB   GLU  83          1HB       GLU  83  14.980 -12.685 -11.170
  610   1HG   GLU  83          2HG       GLU  83  15.444 -12.777  -8.197
  611   2HG   GLU  83          1HG       GLU  83  15.664 -14.119  -9.319
  612    H    GLU  84           H        GLU  84  12.257  -9.966  -9.743
  613    HA   GLU  84           HA       GLU  84  11.254 -10.220 -12.336
  614   1HB   GLU  84          2HB       GLU  84  10.408  -8.083 -10.385
  615   2HB   GLU  84          1HB       GLU  84   9.457  -8.770 -11.688
  616   1HG   GLU  84          2HG       GLU  84   9.444 -10.929 -10.548
  617   2HG   GLU  84          1HG       GLU  84  10.385 -10.234  -9.228
  618    H    ARG  85           H        ARG  85  12.874  -7.472 -10.794
  619    HA   ARG  85           HA       ARG  85  13.945  -6.552 -13.249
  620   1HB   ARG  85          2HB       ARG  85  11.643  -5.772 -13.603
  621   2HB   ARG  85          1HB       ARG  85  11.705  -4.888 -12.083
  622   1HG   ARG  85          2HG       ARG  85  13.515  -3.497 -12.980
  623   2HG   ARG  85          1HG       ARG  85  13.408  -4.365 -14.512
  624   1HD   ARG  85          2HD       ARG  85  11.087  -3.620 -14.765
  625   2HD   ARG  85          1HD       ARG  85  11.205  -2.749 -13.237
  626    HE   ARG  85           HE       ARG  85  12.085  -1.840 -15.765
  627   1HH1  ARG  85          1HH1      ARG  85  12.938  -1.786 -12.378
  628   2HH1  ARG  85          2HH1      ARG  85  13.853  -0.322 -12.505
  629   1HH2  ARG  85          1HH2      ARG  85  13.282   0.089 -15.929
  630   2HH2  ARG  85          2HH2      ARG  85  14.046   0.744 -14.519
  631    H    ILE  86           H        ILE  86  12.846  -5.304 -10.095
  632    HA   ILE  86           HA       ILE  86  14.882  -3.450  -9.746
  633    HB   ILE  86           HB       ILE  86  13.359  -4.922  -7.613
  634   1HG1  ILE  86          2HG1      ILE  86  11.966  -3.621  -9.190
  635   2HG1  ILE  86          1HG1      ILE  86  11.953  -2.916  -7.580
  636   1HG2  ILE  86          1HG2      ILE  86  14.865  -4.012  -6.228
  637   2HG2  ILE  86          2HG2      ILE  86  14.091  -2.471  -6.602
  638   3HG2  ILE  86          3HG2      ILE  86  15.526  -2.975  -7.491
  639   1HD1  ILE  86          1HD1      ILE  86  12.540  -1.658 -10.005
  640   2HD1  ILE  86          2HD1      ILE  86  14.064  -1.759  -9.125
  641   3HD1  ILE  86          3HD1      ILE  86  12.664  -0.985  -8.380
  Start of MODEL   11
    1    H    ARG   9           H        ARG   9 -16.406  -7.059  -5.888
    2    HA   ARG   9           HA       ARG   9 -14.460  -5.035  -5.318
    3   1HB   ARG   9          2HB       ARG   9 -13.351  -6.252  -3.472
    4   2HB   ARG   9          1HB       ARG   9 -14.951  -5.674  -3.031
    5   1HG   ARG   9          2HG       ARG   9 -15.862  -7.913  -3.382
    6   2HG   ARG   9          1HG       ARG   9 -14.257  -8.494  -3.828
    7   1HD   ARG   9          2HD       ARG   9 -14.795  -9.035  -1.506
    8   2HD   ARG   9          1HD       ARG   9 -13.420  -7.937  -1.614
    9    HE   ARG   9           HE       ARG   9 -15.733  -6.403  -1.308
   10   1HH1  ARG   9          1HH1      ARG   9 -13.838  -8.701   0.512
   11   2HH1  ARG   9          2HH1      ARG   9 -14.266  -8.025   2.047
   12   1HH2  ARG   9          1HH2      ARG   9 -16.294  -5.515   0.709
   13   2HH2  ARG   9          2HH2      ARG   9 -15.663  -6.218   2.160
   14    H    HIS  10           H        HIS  10 -13.045  -5.354  -6.903
   15    HA   HIS  10           HA       HIS  10 -12.367  -8.129  -7.640
   16   1HB   HIS  10          2HB       HIS  10 -12.447  -5.662  -9.387
   17   2HB   HIS  10          1HB       HIS  10 -11.847  -7.231  -9.907
   18    HD1  HIS  10           1HD      HIS  10 -13.990  -6.394 -11.627
   19    HD2  HIS  10           2HD      HIS  10 -14.837  -8.140  -7.953
   20    HE1  HIS  10           1HE      HIS  10 -16.341  -7.262 -11.821
   21    HE2  HIS  10           2HE      HIS  10 -16.860  -8.242  -9.559
   22    H    GLU  11           H        GLU  11 -10.248  -8.682  -7.917
   23    HA   GLU  11           HA       GLU  11  -7.991  -8.624  -7.682
   24   1HB   GLU  11          2HB       GLU  11  -8.352  -5.672  -8.229
   25   2HB   GLU  11          1HB       GLU  11  -6.811  -6.520  -8.229
   26   1HG   GLU  11          2HG       GLU  11  -9.119  -7.038 -10.091
   27   2HG   GLU  11          1HG       GLU  11  -7.630  -6.178 -10.487
   28    H    LEU  12           H        LEU  12  -8.729  -5.419  -6.328
   29    HA   LEU  12           HA       LEU  12  -8.645  -6.162  -3.627
   30   1HB   LEU  12          2HB       LEU  12  -6.331  -6.752  -4.067
   31   2HB   LEU  12          1HB       LEU  12  -6.026  -5.162  -4.742
   32    HG   LEU  12           HG       LEU  12  -6.443  -4.155  -2.524
   33   1HD1  LEU  12          1HD1      LEU  12  -7.951  -5.814  -1.610
   34   2HD1  LEU  12          2HD1      LEU  12  -6.551  -5.619  -0.556
   35   3HD1  LEU  12          3HD1      LEU  12  -6.665  -7.022  -1.619
   36   1HD2  LEU  12          1HD2      LEU  12  -4.170  -4.975  -3.350
   37   2HD2  LEU  12          2HD2      LEU  12  -4.390  -6.324  -2.237
   38   3HD2  LEU  12          3HD2      LEU  12  -4.346  -4.673  -1.621
   39    H    ILE  13           H        ILE  13  -8.321  -3.753  -6.103
   40    HA   ILE  13           HA       ILE  13  -8.207  -1.431  -4.574
   41    HB   ILE  13           HB       ILE  13  -9.545  -1.879  -7.246
   42   1HG1  ILE  13          2HG1      ILE  13  -7.514  -0.668  -8.082
   43   2HG1  ILE  13          1HG1      ILE  13  -6.855  -0.741  -6.453
   44   1HG2  ILE  13          1HG2      ILE  13  -9.017   0.678  -5.746
   45   2HG2  ILE  13          2HG2      ILE  13 -10.567   0.060  -6.318
   46   3HG2  ILE  13          3HG2      ILE  13  -9.358   0.615  -7.476
   47   1HD1  ILE  13          1HD1      ILE  13  -6.540  -3.038  -6.557
   48   2HD1  ILE  13          2HD1      ILE  13  -6.090  -2.476  -8.168
   49   3HD1  ILE  13          3HD1      ILE  13  -7.664  -3.228  -7.904
   50    H    GLY  14           H        GLY  14  -9.892   0.106  -4.049
   51   1HA   GLY  14          2HA       GLY  14 -12.204   0.639  -3.689
   52   2HA   GLY  14          1HA       GLY  14 -12.561  -1.082  -3.699
   53    H    LEU  15           H        LEU  15  -9.797  -0.755  -1.956
   54    HA   LEU  15           HA       LEU  15 -11.283  -0.655   0.584
   55   1HB   LEU  15          2HB       LEU  15  -8.607  -1.919  -0.015
   56   2HB   LEU  15          1HB       LEU  15  -9.443  -1.964   1.525
   57    HG   LEU  15           HG       LEU  15 -10.439  -3.239  -1.024
   58   1HD1  LEU  15          1HD1      LEU  15  -9.660  -4.848   1.325
   59   2HD1  LEU  15          2HD1      LEU  15  -8.347  -4.113   0.406
   60   3HD1  LEU  15          3HD1      LEU  15  -9.490  -5.190  -0.397
   61   1HD2  LEU  15          1HD2      LEU  15 -11.804  -4.418   0.964
   62   2HD2  LEU  15          2HD2      LEU  15 -12.392  -3.002   0.092
   63   3HD2  LEU  15          3HD2      LEU  15 -11.601  -2.808   1.657
   64    H    SER  16           H        SER  16  -9.960   0.143   2.464
   65    HA   SER  16           HA       SER  16  -8.475   2.537   1.624
   66   1HB   SER  16          2HB       SER  16  -8.896   3.364   3.924
   67   2HB   SER  16          1HB       SER  16 -10.398   2.970   3.088
   68    HG   SER  16           HG       SER  16 -10.586   2.035   5.052
   69    H    VAL  17           H        VAL  17  -6.505   3.092   2.806
   70    HA   VAL  17           HA       VAL  17  -5.249   0.909   4.270
   71    HB   VAL  17           HB       VAL  17  -4.646   0.373   2.010
   72   1HG1  VAL  17          1HG1      VAL  17  -4.045   3.288   1.809
   73   2HG1  VAL  17          2HG1      VAL  17  -4.956   2.247   0.712
   74   3HG1  VAL  17          3HG1      VAL  17  -3.195   2.144   0.770
   75   1HG2  VAL  17          1HG2      VAL  17  -2.060   1.495   2.504
   76   2HG2  VAL  17          2HG2      VAL  17  -2.604  -0.171   2.687
   77   3HG2  VAL  17          3HG2      VAL  17  -2.773   0.962   4.027
   78    H    ARG  18           H        ARG  18  -3.914   1.595   5.835
   79    HA   ARG  18           HA       ARG  18  -3.225   4.462   5.877
   80   1HB   ARG  18          2HB       ARG  18  -3.294   4.333   8.325
   81   2HB   ARG  18          1HB       ARG  18  -4.839   3.880   7.615
   82   1HG   ARG  18          2HG       ARG  18  -4.303   1.522   7.946
   83   2HG   ARG  18          1HG       ARG  18  -2.749   1.971   8.648
   84   1HD   ARG  18          2HD       ARG  18  -3.910   3.174  10.438
   85   2HD   ARG  18          1HD       ARG  18  -5.462   2.721   9.737
   86    HE   ARG  18           HE       ARG  18  -3.858   1.136  11.441
   87   1HH1  ARG  18          1HH1      ARG  18  -5.959   0.908   8.662
   88   2HH1  ARG  18          2HH1      ARG  18  -6.359  -0.752   8.946
   89   1HH2  ARG  18          1HH2      ARG  18  -4.390  -1.044  11.818
   90   2HH2  ARG  18          2HH2      ARG  18  -5.473  -1.859  10.739
   91    H    ILE  19           H        ILE  19  -1.148   5.011   6.038
   92    HA   ILE  19           HA       ILE  19   0.835   2.879   6.244
   93    HB   ILE  19           HB       ILE  19   1.101   5.765   5.396
   94   1HG1  ILE  19          2HG1      ILE  19   1.604   4.758   3.178
   95   2HG1  ILE  19          1HG1      ILE  19   1.238   3.170   3.847
   96   1HG2  ILE  19          1HG2      ILE  19   3.276   5.607   5.834
   97   2HG2  ILE  19          2HG2      ILE  19   3.378   4.355   4.594
   98   3HG2  ILE  19          3HG2      ILE  19   3.114   3.906   6.279
   99   1HD1  ILE  19          1HD1      ILE  19  -0.793   5.374   3.935
  100   2HD1  ILE  19          2HD1      ILE  19  -1.041   3.631   4.017
  101   3HD1  ILE  19          3HD1      ILE  19  -0.583   4.385   2.488
  102    H    ALA  20           H        ALA  20   1.757   2.473   8.135
  103    HA   ALA  20           HA       ALA  20   1.655   4.408  10.285
  104   1HB   ALA  20          1HB       ALA  20   2.937   1.686  10.322
  105   2HB   ALA  20          2HB       ALA  20   1.222   1.963  10.630
  106   3HB   ALA  20          3HB       ALA  20   2.435   2.658  11.706
  107    H    ARG  21           H        ARG  21   4.223   2.433   8.911
  108    HA   ARG  21           HA       ARG  21   6.111   4.592   9.436
  109   1HB   ARG  21          2HB       ARG  21   6.565   1.617   9.274
  110   2HB   ARG  21          1HB       ARG  21   7.875   2.785   9.291
  111   1HG   ARG  21          2HG       ARG  21   7.611   1.927  11.495
  112   2HG   ARG  21          1HG       ARG  21   7.045   3.596  11.488
  113   1HD   ARG  21          2HD       ARG  21   4.740   2.839  11.389
  114   2HD   ARG  21          1HD       ARG  21   5.270   1.163  11.289
  115    HE   ARG  21           HE       ARG  21   5.432   1.171  13.555
  116   1HH1  ARG  21          1HH1      ARG  21   5.664   4.476  12.453
  117   2HH1  ARG  21          2HH1      ARG  21   5.798   5.128  14.051
  118   1HH2  ARG  21          1HH2      ARG  21   5.601   2.032  15.657
  119   2HH2  ARG  21          2HH2      ARG  21   5.760   3.743  15.868
  120    H    SER  22           H        SER  22   7.401   5.358   7.793
  121    HA   SER  22           HA       SER  22   7.187   4.055   5.174
  122   1HB   SER  22          2HB       SER  22   5.501   5.822   5.178
  123   2HB   SER  22          1HB       SER  22   6.713   7.001   5.678
  124    HG   SER  22           HG       SER  22   6.275   5.836   3.194
  125    H    VAL  23           H        VAL  23   8.774   4.913   3.594
  126    HA   VAL  23           HA       VAL  23  11.369   5.024   4.793
  127    HB   VAL  23           HB       VAL  23  11.085   3.801   2.732
  128   1HG1  VAL  23          1HG1      VAL  23   9.463   4.640   1.402
  129   2HG1  VAL  23          2HG1      VAL  23  10.816   5.479   0.642
  130   3HG1  VAL  23          3HG1      VAL  23   9.822   6.312   1.837
  131   1HG2  VAL  23          1HG2      VAL  23  12.773   6.280   2.382
  132   2HG2  VAL  23          2HG2      VAL  23  12.870   4.851   1.350
  133   3HG2  VAL  23          3HG2      VAL  23  13.279   4.734   3.063
  134    H    HIS  24           H        HIS  24   9.166   7.355   3.402
  135    HA   HIS  24           HA       HIS  24  11.143   9.474   3.946
  136   1HB   HIS  24          2HB       HIS  24   9.113   9.240   1.737
  137   2HB   HIS  24          1HB       HIS  24   9.753  10.805   2.225
  138    HD1  HIS  24           1HD      HIS  24  11.428   7.455   1.503
  139    HD2  HIS  24           2HD      HIS  24  11.696  11.471   0.484
  140    HE1  HIS  24           1HE      HIS  24  13.381   7.619  -0.069
  141    HE2  HIS  24           2HE      HIS  24  13.475  10.047  -0.735
  142    H    ARG  25           H        ARG  25  10.536  11.158   5.195
  143    HA   ARG  25           HA       ARG  25   8.319  10.879   6.898
  144   1HB   ARG  25          2HB       ARG  25   8.908  13.123   7.718
  145   2HB   ARG  25          1HB       ARG  25  10.315  12.079   7.591
  146   1HG   ARG  25          2HG       ARG  25  10.893  13.154   5.455
  147   2HG   ARG  25          1HG       ARG  25   9.511  14.235   5.649
  148   1HD   ARG  25          2HD       ARG  25  11.871  14.010   7.517
  149   2HD   ARG  25          1HD       ARG  25  11.581  15.314   6.365
  150    HE   ARG  25           HE       ARG  25   9.354  15.123   8.041
  151   1HH1  ARG  25          1HH1      ARG  25  12.733  15.975   8.232
  152   2HH1  ARG  25          2HH1      ARG  25  12.509  17.077   9.551
  153   1HH2  ARG  25          1HH2      ARG  25   9.057  16.569   9.774
  154   2HH2  ARG  25          2HH2      ARG  25  10.422  17.413  10.426
  155    H    ASP  26           H        ASP  26   8.672  12.394   3.821
  156    HA   ASP  26           HA       ASP  26   6.494  14.178   3.968
  157   1HB   ASP  26          2HB       ASP  26   7.722  12.853   1.544
  158   2HB   ASP  26          1HB       ASP  26   6.624  14.229   1.503
  159    H    ILE  27           H        ILE  27   6.732  10.796   3.415
  160    HA   ILE  27           HA       ILE  27   3.918  10.626   2.670
  161    HB   ILE  27           HB       ILE  27   5.987   8.441   2.550
  162   1HG1  ILE  27          2HG1      ILE  27   6.485  10.391   1.047
  163   2HG1  ILE  27          1HG1      ILE  27   6.212   8.877   0.195
  164   1HG2  ILE  27          1HG2      ILE  27   4.309   7.076   2.069
  165   2HG2  ILE  27          2HG2      ILE  27   3.806   8.114   0.734
  166   3HG2  ILE  27          3HG2      ILE  27   3.174   8.394   2.356
  167   1HD1  ILE  27          1HD1      ILE  27   3.922   9.597  -0.312
  168   2HD1  ILE  27          2HD1      ILE  27   5.132  10.707  -0.954
  169   3HD1  ILE  27          3HD1      ILE  27   4.236  11.127   0.507
  170    H    GLN  28           H        GLN  28   6.204   9.916   5.124
  171    HA   GLN  28           HA       GLN  28   5.038   7.841   6.533
  172   1HB   GLN  28          2HB       GLN  28   7.240   8.716   7.071
  173   2HB   GLN  28          1HB       GLN  28   6.550  10.261   7.544
  174   1HG   GLN  28          2HG       GLN  28   7.059   9.138   9.538
  175   2HG   GLN  28          1HG       GLN  28   5.310   9.018   9.351
  176   1HE2  GLN  28          1HE2      GLN  28   7.966   7.362  10.217
  177   2HE2  GLN  28          2HE2      GLN  28   7.448   5.750   9.887
  178    H    GLY  29           H        GLY  29   3.558   7.699   8.200
  179   1HA   GLY  29          2HA       GLY  29   1.709   8.220   9.446
  180   2HA   GLY  29          1HA       GLY  29   2.290   9.876   9.453
  181    H    ILE  30           H        ILE  30   1.861   8.782   6.285
  182    HA   ILE  30           HA       ILE  30  -0.671  10.211   6.151
  183    HB   ILE  30           HB       ILE  30   1.310   9.636   3.950
  184   1HG1  ILE  30          2HG1      ILE  30   0.587  12.163   5.449
  185   2HG1  ILE  30          1HG1      ILE  30   2.134  11.318   5.481
  186   1HG2  ILE  30          1HG2      ILE  30  -0.554  11.648   3.226
  187   2HG2  ILE  30          2HG2      ILE  30  -1.467  10.255   3.806
  188   3HG2  ILE  30          3HG2      ILE  30  -0.310  10.064   2.490
  189   1HD1  ILE  30          1HD1      ILE  30   2.318  13.272   4.091
  190   2HD1  ILE  30          2HD1      ILE  30   0.918  12.770   3.140
  191   3HD1  ILE  30          3HD1      ILE  30   2.409  11.832   3.075
  192    H    SER  31           H        SER  31  -2.461   9.119   5.843
  193    HA   SER  31           HA       SER  31  -2.296   6.373   4.807
  194   1HB   SER  31          2HB       SER  31  -4.516   6.046   5.838
  195   2HB   SER  31          1HB       SER  31  -3.329   6.588   7.024
  196    HG   SER  31           HG       SER  31  -5.150   8.298   5.678
  197    H    GLY  32           H        GLY  32  -4.559   5.772   3.692
  198   1HA   GLY  32          2HA       GLY  32  -6.025   7.652   2.295
  199   2HA   GLY  32          1HA       GLY  32  -4.610   7.332   1.309
  200    H    ARG  33           H        ARG  33  -6.407   6.700  -0.153
  201    HA   ARG  33           HA       ARG  33  -7.405   4.014   0.374
  202   1HB   ARG  33          2HB       ARG  33  -8.292   6.165  -1.499
  203   2HB   ARG  33          1HB       ARG  33  -8.783   4.500  -1.740
  204   1HG   ARG  33          2HG       ARG  33 -10.469   5.764  -0.518
  205   2HG   ARG  33          1HG       ARG  33  -9.822   4.429   0.431
  206   1HD   ARG  33          2HD       ARG  33  -8.276   6.099   1.512
  207   2HD   ARG  33          1HD       ARG  33  -9.202   7.364   0.713
  208    HE   ARG  33           HE       ARG  33  -9.905   5.994   3.078
  209   1HH1  ARG  33          1HH1      ARG  33 -11.327   7.297   0.175
  210   2HH1  ARG  33          2HH1      ARG  33 -12.893   7.496   0.879
  211   1HH2  ARG  33          1HH2      ARG  33 -11.960   6.261   4.011
  212   2HH2  ARG  33          2HH2      ARG  33 -13.253   6.911   3.059
  213    H    VAL  34           H        VAL  34  -7.595   2.651  -1.719
  214    HA   VAL  34           HA       VAL  34  -4.846   2.444  -2.729
  215    HB   VAL  34           HB       VAL  34  -5.786   0.514  -1.508
  216   1HG1  VAL  34          1HG1      VAL  34  -7.646   0.289  -3.866
  217   2HG1  VAL  34          2HG1      VAL  34  -8.107   0.730  -2.223
  218   3HG1  VAL  34          3HG1      VAL  34  -7.482  -0.884  -2.559
  219   1HG2  VAL  34          1HG2      VAL  34  -3.995   0.260  -3.203
  220   2HG2  VAL  34          2HG2      VAL  34  -5.232  -0.096  -4.410
  221   3HG2  VAL  34          3HG2      VAL  34  -5.003  -1.178  -3.036
  222    H    VAL  35           H        VAL  35  -4.378   1.852  -4.941
  223    HA   VAL  35           HA       VAL  35  -6.613   2.123  -6.790
  224    HB   VAL  35           HB       VAL  35  -5.218   4.341  -6.577
  225   1HG1  VAL  35          1HG1      VAL  35  -3.461   4.510  -8.240
  226   2HG1  VAL  35          2HG1      VAL  35  -3.578   2.783  -8.547
  227   3HG1  VAL  35          3HG1      VAL  35  -3.040   3.362  -6.978
  228   1HG2  VAL  35          1HG2      VAL  35  -7.074   3.646  -8.204
  229   2HG2  VAL  35          2HG2      VAL  35  -5.767   3.345  -9.348
  230   3HG2  VAL  35          3HG2      VAL  35  -6.003   4.962  -8.686
  231    H    ASP  36           H        ASP  36  -3.120   1.482  -6.540
  232    HA   ASP  36           HA       ASP  36  -3.430  -1.087  -7.724
  233   1HB   ASP  36          2HB       ASP  36  -2.195  -0.840  -9.737
  234   2HB   ASP  36          1HB       ASP  36  -3.407   0.433  -9.745
  235    H    GLU  37           H        GLU  37  -1.252  -2.191  -8.001
  236    HA   GLU  37           HA       GLU  37   0.612  -1.203  -5.938
  237   1HB   GLU  37          2HB       GLU  37  -0.553  -3.242  -5.225
  238   2HB   GLU  37          1HB       GLU  37  -0.019  -4.066  -6.684
  239   1HG   GLU  37          2HG       GLU  37   2.303  -3.841  -5.967
  240   2HG   GLU  37          1HG       GLU  37   1.770  -3.010  -4.507
  241    H    THR  38           H        THR  38   2.787  -1.140  -6.433
  242    HA   THR  38           HA       THR  38   3.520  -2.023  -9.149
  243    HB   THR  38           HB       THR  38   4.579   0.385  -7.666
  244    HG1  THR  38           1HG      THR  38   3.354   1.572  -9.073
  245   1HG2  THR  38          1HG2      THR  38   5.032  -0.436 -10.522
  246   2HG2  THR  38          2HG2      THR  38   6.215  -0.581  -9.225
  247   3HG2  THR  38          3HG2      THR  38   5.650   1.012  -9.728
  248    H    ARG  39           H        ARG  39   5.614  -2.802  -9.479
  249    HA   ARG  39           HA       ARG  39   6.637  -4.612  -7.741
  250   1HB   ARG  39          2HB       ARG  39   7.342  -4.494 -10.053
  251   2HB   ARG  39          1HB       ARG  39   8.157  -2.963  -9.763
  252   1HG   ARG  39          2HG       ARG  39   9.734  -4.087  -8.267
  253   2HG   ARG  39          1HG       ARG  39   8.916  -5.622  -8.567
  254   1HD   ARG  39          2HD       ARG  39  10.942  -5.372  -9.933
  255   2HD   ARG  39          1HD       ARG  39   9.486  -5.502 -10.920
  256    HE   ARG  39           HE       ARG  39  10.033  -2.790 -10.477
  257   1HH1  ARG  39          1HH1      ARG  39  11.363  -5.529 -12.182
  258   2HH1  ARG  39          2HH1      ARG  39  12.098  -4.562 -13.415
  259   1HH2  ARG  39          1HH2      ARG  39  11.000  -1.517 -12.098
  260   2HH2  ARG  39          2HH2      ARG  39  11.894  -2.284 -13.367
  261    H    ASN  40           H        ASN  40   7.378  -1.163  -7.773
  262    HA   ASN  40           HA       ASN  40   8.698  -1.527  -5.188
  263   1HB   ASN  40          2HB       ASN  40  10.531  -0.017  -5.809
  264   2HB   ASN  40          1HB       ASN  40  10.517  -1.477  -6.785
  265   1HD2  ASN  40          1HD2      ASN  40   8.029   0.479  -7.871
  266   2HD2  ASN  40          2HD2      ASN  40   8.866   1.270  -9.148
  267    H    THR  41           H        THR  41   6.101  -0.338  -6.215
  268    HA   THR  41           HA       THR  41   6.181   1.955  -4.481
  269    HB   THR  41           HB       THR  41   5.198   3.483  -6.252
  270    HG1  THR  41           1HG      THR  41   6.429   1.656  -8.026
  271   1HG2  THR  41          1HG2      THR  41   7.543   3.653  -5.425
  272   2HG2  THR  41          2HG2      THR  41   7.276   4.261  -7.059
  273   3HG2  THR  41          3HG2      THR  41   8.035   2.688  -6.816
  274    H    LEU  42           H        LEU  42   4.003   3.060  -4.415
  275    HA   LEU  42           HA       LEU  42   1.806   1.228  -5.059
  276   1HB   LEU  42          2HB       LEU  42   2.298   2.452  -2.347
  277   2HB   LEU  42          1HB       LEU  42   0.824   1.628  -2.814
  278    HG   LEU  42           HG       LEU  42   3.559   0.379  -2.631
  279   1HD1  LEU  42          1HD1      LEU  42   2.267   1.032  -0.498
  280   2HD1  LEU  42          2HD1      LEU  42   2.891  -0.611  -0.637
  281   3HD1  LEU  42          3HD1      LEU  42   1.184  -0.288  -0.937
  282   1HD2  LEU  42          1HD2      LEU  42   2.447  -1.725  -3.079
  283   2HD2  LEU  42          2HD2      LEU  42   2.137  -0.604  -4.403
  284   3HD2  LEU  42          3HD2      LEU  42   0.889  -0.910  -3.195
  285    H    ARG  43           H        ARG  43  -0.012   2.221  -5.711
  286    HA   ARG  43           HA       ARG  43  -0.055   5.152  -5.470
  287   1HB   ARG  43          2HB       ARG  43   0.206   4.240  -7.793
  288   2HB   ARG  43          1HB       ARG  43  -1.379   3.516  -7.625
  289   1HG   ARG  43          2HG       ARG  43  -2.374   5.726  -7.336
  290   2HG   ARG  43          1HG       ARG  43  -0.775   6.458  -7.469
  291   1HD   ARG  43          2HD       ARG  43  -2.158   4.841  -9.613
  292   2HD   ARG  43          1HD       ARG  43  -2.003   6.597  -9.585
  293    HE   ARG  43           HE       ARG  43   0.557   5.498  -9.405
  294   1HH1  ARG  43          1HH1      ARG  43  -2.066   5.697 -11.700
  295   2HH1  ARG  43          2HH1      ARG  43  -1.029   5.606 -13.083
  296   1HH2  ARG  43          1HH2      ARG  43   1.922   5.377 -11.224
  297   2HH2  ARG  43          2HH2      ARG  43   1.236   5.423 -12.813
  298    H    ILE  44           H        ILE  44  -1.582   5.963  -4.317
  299    HA   ILE  44           HA       ILE  44  -3.694   4.280  -3.238
  300    HB   ILE  44           HB       ILE  44  -2.425   6.886  -2.466
  301   1HG1  ILE  44          2HG1      ILE  44  -2.797   4.264  -1.021
  302   2HG1  ILE  44          1HG1      ILE  44  -1.315   4.838  -1.778
  303   1HG2  ILE  44          1HG2      ILE  44  -5.144   6.466  -2.043
  304   2HG2  ILE  44          2HG2      ILE  44  -4.110   7.663  -1.274
  305   3HG2  ILE  44          3HG2      ILE  44  -4.365   6.103  -0.503
  306   1HD1  ILE  44          1HD1      ILE  44  -2.662   5.850   0.695
  307   2HD1  ILE  44          2HD1      ILE  44  -1.457   6.805  -0.167
  308   3HD1  ILE  44          3HD1      ILE  44  -1.022   5.231   0.501
  309    H    GLU  45           H        GLU  45  -5.772   4.388  -3.929
  310    HA   GLU  45           HA       GLU  45  -6.696   6.986  -4.906
  311   1HB   GLU  45          2HB       GLU  45  -6.417   5.730  -6.923
  312   2HB   GLU  45          1HB       GLU  45  -7.225   4.325  -6.237
  313   1HG   GLU  45          2HG       GLU  45  -9.316   5.622  -6.121
  314   2HG   GLU  45          1HG       GLU  45  -8.490   6.984  -6.877
  315    H    MET  46           H        MET  46  -8.670   7.556  -4.343
  316    HA   MET  46           HA       MET  46 -10.212   5.763  -2.588
  317   1HB   MET  46          2HB       MET  46 -11.000   7.841  -1.445
  318   2HB   MET  46          1HB       MET  46  -9.288   7.522  -1.233
  319   1HG   MET  46          2HG       MET  46  -9.166   9.113  -3.369
  320   2HG   MET  46          1HG       MET  46 -10.658   9.712  -2.649
  321   1HE   MET  46          1HE       MET  46  -6.794   9.406  -2.367
  322   2HE   MET  46          2HE       MET  46  -7.320   8.271  -1.119
  323   3HE   MET  46          3HE       MET  46  -6.500   9.764  -0.663
  324    H    ASP  47           H        ASP  47 -12.270   5.436  -3.056
  325    HA   ASP  47           HA       ASP  47 -13.410   5.777  -5.474
  326   1HB   ASP  47          2HB       ASP  47 -14.351   4.353  -3.719
  327   2HB   ASP  47          1HB       ASP  47 -14.885   5.781  -2.838
  328    H    ASP  48           H        ASP  48 -13.159   8.230  -3.044
  329    HA   ASP  48           HA       ASP  48 -15.200   9.952  -3.881
  330   1HB   ASP  48          2HB       ASP  48 -13.899  10.250  -1.790
  331   2HB   ASP  48          1HB       ASP  48 -12.499  10.723  -2.750
  332    H    GLY  49           H        GLY  49 -12.372   8.979  -5.488
  333   1HA   GLY  49          2HA       GLY  49 -12.057   9.453  -7.793
  334   2HA   GLY  49          1HA       GLY  49 -12.828  11.013  -7.549
  335    H    ARG  50           H        ARG  50 -10.590  10.095  -5.150
  336    HA   ARG  50           HA       ARG  50  -8.646  12.000  -6.281
  337   1HB   ARG  50          2HB       ARG  50  -9.292  11.242  -3.460
  338   2HB   ARG  50          1HB       ARG  50  -7.765  12.010  -3.857
  339   1HG   ARG  50          2HG       ARG  50  -9.391  13.635  -3.088
  340   2HG   ARG  50          1HG       ARG  50  -8.973  13.921  -4.779
  341   1HD   ARG  50          2HD       ARG  50 -11.021  12.846  -5.497
  342   2HD   ARG  50          1HD       ARG  50 -11.421  12.437  -3.830
  343    HE   ARG  50           HE       ARG  50 -12.301  14.524  -3.619
  344   1HH1  ARG  50          1HH1      ARG  50  -9.999  14.591  -6.243
  345   2HH1  ARG  50          2HH1      ARG  50 -10.288  16.257  -6.618
  346   1HH2  ARG  50          1HH2      ARG  50 -12.685  16.712  -4.116
  347   2HH2  ARG  50          2HH2      ARG  50 -11.813  17.460  -5.412
  348    H    GLU  51           H        GLU  51  -6.353  11.577  -5.956
  349    HA   GLU  51           HA       GLU  51  -5.622   8.819  -5.421
  350   1HB   GLU  51          2HB       GLU  51  -5.055  10.117  -8.092
  351   2HB   GLU  51          1HB       GLU  51  -4.475   8.540  -7.575
  352   1HG   GLU  51          2HG       GLU  51  -6.760   7.717  -7.480
  353   2HG   GLU  51          1HG       GLU  51  -7.362   9.304  -7.957
  354    H    ILE  52           H        ILE  52  -3.636   8.653  -4.567
  355    HA   ILE  52           HA       ILE  52  -1.650  10.762  -4.980
  356    HB   ILE  52           HB       ILE  52  -2.797  11.422  -2.922
  357   1HG1  ILE  52          2HG1      ILE  52  -0.833  11.463  -1.408
  358   2HG1  ILE  52          1HG1      ILE  52  -0.044  10.263  -2.428
  359   1HG2  ILE  52          1HG2      ILE  52  -2.762  10.004  -0.941
  360   2HG2  ILE  52          2HG2      ILE  52  -1.998   8.714  -1.869
  361   3HG2  ILE  52          3HG2      ILE  52  -3.637   9.233  -2.263
  362   1HD1  ILE  52          1HD1      ILE  52  -0.158  11.884  -4.319
  363   2HD1  ILE  52          2HD1      ILE  52   0.836  12.433  -2.967
  364   3HD1  ILE  52          3HD1      ILE  52  -0.788  13.085  -3.192
  365    H    THR  53           H        THR  53   0.548  10.052  -4.482
  366    HA   THR  53           HA       THR  53   0.796   7.142  -4.738
  367    HB   THR  53           HB       THR  53   2.804   9.334  -5.273
  368    HG1  THR  53           1HG      THR  53   1.373   7.669  -7.067
  369   1HG2  THR  53          1HG2      THR  53   4.035   7.364  -4.740
  370   2HG2  THR  53          2HG2      THR  53   4.052   7.569  -6.491
  371   3HG2  THR  53          3HG2      THR  53   2.988   6.372  -5.754
  372    H    VAL  54           H        VAL  54   2.406   5.954  -3.600
  373    HA   VAL  54           HA       VAL  54   3.646   7.174  -1.269
  374    HB   VAL  54           HB       VAL  54   1.821   4.788  -0.941
  375   1HG1  VAL  54          1HG1      VAL  54   2.802   4.475   1.035
  376   2HG1  VAL  54          2HG1      VAL  54   2.510   6.154   1.491
  377   3HG1  VAL  54          3HG1      VAL  54   3.978   5.721   0.617
  378   1HG2  VAL  54          1HG2      VAL  54   1.398   7.711  -0.406
  379   2HG2  VAL  54          2HG2      VAL  54   0.542   6.485   0.528
  380   3HG2  VAL  54          3HG2      VAL  54   0.334   6.566  -1.222
  381    HA   PRO  55           HA       PRO  55   6.693   4.180  -2.651
  382   1HB   PRO  55          2HB       PRO  55   8.302   4.908  -0.341
  383   2HB   PRO  55          1HB       PRO  55   8.584   5.265  -2.044
  384   1HG   PRO  55          2HG       PRO  55   7.943   7.167  -0.214
  385   2HG   PRO  55          1HG       PRO  55   7.523   7.289  -1.930
  386   1HD   PRO  55          2HD       PRO  55   5.811   6.470   0.388
  387   2HD   PRO  55          1HD       PRO  55   5.413   7.505  -1.002
  388    H    LYS  56           H        LYS  56   6.743   2.048  -2.296
  389    HA   LYS  56           HA       LYS  56   6.028   1.039   0.361
  390   1HB   LYS  56          2HB       LYS  56   5.566  -1.086  -0.755
  391   2HB   LYS  56          1HB       LYS  56   4.661   0.236  -1.470
  392   1HG   LYS  56          2HG       LYS  56   6.225   0.343  -3.321
  393   2HG   LYS  56          1HG       LYS  56   7.201  -0.930  -2.585
  394   1HD   LYS  56          2HD       LYS  56   4.353  -1.201  -3.546
  395   2HD   LYS  56          1HD       LYS  56   5.788  -1.823  -4.360
  396   1HE   LYS  56          2HE       LYS  56   4.785  -2.650  -1.640
  397   2HE   LYS  56          1HE       LYS  56   4.655  -3.589  -3.125
  398   1HZ   LYS  56          1HZ       LYS  56   6.947  -3.169  -1.393
  399   2HZ   LYS  56          2HZ       LYS  56   7.274  -3.148  -3.052
  400   3HZ   LYS  56          3HZ       LYS  56   6.543  -4.502  -2.352
  401    H    GLY  57           H        GLY  57   8.835   1.630  -1.314
  402   1HA   GLY  57          2HA       GLY  57  10.370  -0.648  -1.186
  403   2HA   GLY  57          1HA       GLY  57  11.008   0.965  -0.895
  404    H    ILE  58           H        ILE  58   9.373   1.401   1.455
  405    HA   ILE  58           HA       ILE  58  10.027  -0.623   3.371
  406    HB   ILE  58           HB       ILE  58  11.303   2.103   3.675
  407   1HG1  ILE  58          2HG1      ILE  58  13.458   0.654   3.683
  408   2HG1  ILE  58          1HG1      ILE  58  12.466  -0.555   2.874
  409   1HG2  ILE  58          1HG2      ILE  58  10.448   0.503   5.664
  410   2HG2  ILE  58          2HG2      ILE  58  11.827   1.594   5.802
  411   3HG2  ILE  58          3HG2      ILE  58  12.085  -0.114   5.448
  412   1HD1  ILE  58          1HD1      ILE  58  12.999   0.434   0.970
  413   2HD1  ILE  58          2HD1      ILE  58  13.739   1.794   1.814
  414   3HD1  ILE  58          3HD1      ILE  58  12.009   1.802   1.474
  415    H    ALA  59           H        ALA  59   7.576  -0.165   2.975
  416    HA   ALA  59           HA       ALA  59   6.769   1.755   5.034
  417   1HB   ALA  59          1HB       ALA  59   4.899   2.521   3.636
  418   2HB   ALA  59          2HB       ALA  59   5.515   1.534   2.309
  419   3HB   ALA  59          3HB       ALA  59   6.472   2.882   2.928
  420    H    VAL  60           H        VAL  60   5.833   0.609   6.598
  421    HA   VAL  60           HA       VAL  60   4.271  -1.766   6.003
  422    HB   VAL  60           HB       VAL  60   5.686  -1.745   8.019
  423   1HG1  VAL  60          1HG1      VAL  60   5.039   0.802   8.361
  424   2HG1  VAL  60          2HG1      VAL  60   5.545  -0.222   9.705
  425   3HG1  VAL  60          3HG1      VAL  60   3.830   0.091   9.430
  426   1HG2  VAL  60          1HG2      VAL  60   3.890  -3.260   8.132
  427   2HG2  VAL  60          2HG2      VAL  60   2.712  -1.974   8.390
  428   3HG2  VAL  60          3HG2      VAL  60   3.854  -2.391   9.667
  429    H    PHE  61           H        PHE  61   2.070  -1.870   5.929
  430    HA   PHE  61           HA       PHE  61   0.480   0.271   7.041
  431   1HB   PHE  61          2HB       PHE  61  -0.638   0.701   4.797
  432   2HB   PHE  61          1HB       PHE  61   0.978   1.367   5.010
  433    HD1  PHE  61           1HD      PHE  61   2.573   0.996   3.402
  434    HD2  PHE  61           2HD      PHE  61  -0.753  -1.644   3.656
  435    HE1  PHE  61           1HE      PHE  61   3.325  -0.140   1.356
  436    HE2  PHE  61           2HE      PHE  61  -0.004  -2.788   1.605
  437    HZ   PHE  61           HZ       PHE  61   2.037  -2.035   0.456
  438    H    HIS  62           H        HIS  62  -1.734  -0.158   7.129
  439    HA   HIS  62           HA       HIS  62  -2.456  -2.961   6.566
  440   1HB   HIS  62          2HB       HIS  62  -3.595  -1.261   8.786
  441   2HB   HIS  62          1HB       HIS  62  -3.775  -2.996   8.561
  442    HD1  HIS  62           1HD      HIS  62  -1.102  -4.130   8.455
  443    HD2  HIS  62           2HD      HIS  62  -1.898  -0.810  10.819
  444    HE1  HIS  62           1HE      HIS  62   0.719  -4.088  10.186
  445    HE2  HIS  62           2HE      HIS  62   0.167  -2.119  11.659
  446    H    PHE  63           H        PHE  63  -4.483  -3.352   5.672
  447    HA   PHE  63           HA       PHE  63  -5.848  -0.959   4.653
  448   1HB   PHE  63          2HB       PHE  63  -6.123  -3.810   3.679
  449   2HB   PHE  63          1HB       PHE  63  -6.803  -2.376   2.927
  450    HD1  PHE  63           1HD      PHE  63  -5.745  -1.657   1.040
  451    HD2  PHE  63           2HD      PHE  63  -3.445  -3.546   4.080
  452    HE1  PHE  63           1HE      PHE  63  -3.728  -1.433  -0.350
  453    HE2  PHE  63           2HE      PHE  63  -1.428  -3.320   2.704
  454    HZ   PHE  63           HZ       PHE  63  -1.564  -2.263   0.482
  455    H    ARG  64           H        ARG  64  -8.138  -0.845   4.695
  456    HA   ARG  64           HA       ARG  64  -9.395  -2.610   6.692
  457   1HB   ARG  64          2HB       ARG  64  -9.803   0.369   6.339
  458   2HB   ARG  64          1HB       ARG  64 -10.746  -0.649   7.417
  459   1HG   ARG  64          2HG       ARG  64  -7.766  -0.296   7.623
  460   2HG   ARG  64          1HG       ARG  64  -8.942   0.662   8.525
  461   1HD   ARG  64          2HD       ARG  64  -8.634  -2.337   8.649
  462   2HD   ARG  64          1HD       ARG  64  -8.074  -1.189   9.867
  463    HE   ARG  64           HE       ARG  64 -10.831  -0.824   9.419
  464   1HH1  ARG  64          1HH1      ARG  64  -8.607  -3.075  10.887
  465   2HH1  ARG  64          2HH1      ARG  64  -9.764  -3.664  12.031
  466   1HH2  ARG  64          1HH2      ARG  64 -12.354  -1.598  10.922
  467   2HH2  ARG  64          2HH2      ARG  64 -11.892  -2.827  12.051
  468    H    THR  65           H        THR  65 -11.414  -3.357   6.233
  469    HA   THR  65           HA       THR  65 -12.584  -2.518   3.662
  470    HB   THR  65           HB       THR  65 -12.729  -5.237   4.977
  471    HG1  THR  65           1HG      THR  65 -11.087  -5.758   3.782
  472   1HG2  THR  65          1HG2      THR  65 -14.585  -4.268   3.291
  473   2HG2  THR  65          2HG2      THR  65 -14.127  -5.967   3.391
  474   3HG2  THR  65          3HG2      THR  65 -13.425  -4.937   2.145
  475    HA   PRO  66           HA       PRO  66 -16.095  -0.899   5.837
  476   1HB   PRO  66          2HB       PRO  66 -17.526  -2.201   3.553
  477   2HB   PRO  66          1HB       PRO  66 -17.728  -0.579   4.227
  478   1HG   PRO  66          2HG       PRO  66 -16.360  -0.943   1.976
  479   2HG   PRO  66          1HG       PRO  66 -15.821   0.236   3.186
  480   1HD   PRO  66          2HD       PRO  66 -14.695  -2.427   2.506
  481   2HD   PRO  66          1HD       PRO  66 -13.879  -0.978   3.125
  482    H    GLN  67           H        GLN  67 -16.206  -4.214   4.563
  483    HA   GLN  67           HA       GLN  67 -18.400  -5.103   6.066
  484   1HB   GLN  67          2HB       GLN  67 -16.016  -6.667   5.063
  485   2HB   GLN  67          1HB       GLN  67 -17.504  -7.381   5.669
  486   1HG   GLN  67          2HG       GLN  67 -18.745  -6.274   3.858
  487   2HG   GLN  67          1HG       GLN  67 -17.225  -5.632   3.236
  488   1HE2  GLN  67          1HE2      GLN  67 -19.436  -7.950   2.765
  489   2HE2  GLN  67          2HE2      GLN  67 -18.459  -9.171   2.031
  490    H    GLY  68           H        GLY  68 -15.245  -4.278   7.056
  491   1HA   GLY  68          2HA       GLY  68 -14.770  -4.001   9.387
  492   2HA   GLY  68          1HA       GLY  68 -15.822  -5.368   9.724
  493    H    GLU  69           H        GLU  69 -13.192  -5.056   7.357
  494    HA   GLU  69           HA       GLU  69 -11.871  -7.320   8.719
  495   1HB   GLU  69          2HB       GLU  69 -11.716  -6.570   5.795
  496   2HB   GLU  69          1HB       GLU  69 -10.927  -7.944   6.550
  497   1HG   GLU  69          2HG       GLU  69 -13.898  -7.521   6.321
  498   2HG   GLU  69          1HG       GLU  69 -12.923  -8.623   5.348
  499    H    LEU  70           H        LEU  70  -9.582  -7.353   8.802
  500    HA   LEU  70           HA       LEU  70  -8.301  -4.735   8.385
  501   1HB   LEU  70          2HB       LEU  70  -8.823  -5.203  10.787
  502   2HB   LEU  70          1HB       LEU  70  -7.779  -6.606  10.696
  503    HG   LEU  70           HG       LEU  70  -6.854  -3.764  10.245
  504   1HD1  LEU  70          1HD1      LEU  70  -6.563  -5.537  12.670
  505   2HD1  LEU  70          2HD1      LEU  70  -7.582  -4.101  12.553
  506   3HD1  LEU  70          3HD1      LEU  70  -5.827  -3.948  12.455
  507   1HD2  LEU  70          1HD2      LEU  70  -5.306  -5.082   9.138
  508   2HD2  LEU  70          2HD2      LEU  70  -5.499  -6.431  10.259
  509   3HD2  LEU  70          3HD2      LEU  70  -4.616  -4.990  10.760
  510    H    VAL  71           H        VAL  71  -6.937  -5.035   6.734
  511    HA   VAL  71           HA       VAL  71  -5.500  -7.582   6.507
  512    HB   VAL  71           HB       VAL  71  -5.553  -5.282   4.553
  513   1HG1  VAL  71          1HG1      VAL  71  -4.899  -7.284   3.011
  514   2HG1  VAL  71          2HG1      VAL  71  -4.347  -8.009   4.520
  515   3HG1  VAL  71          3HG1      VAL  71  -3.670  -6.472   3.980
  516   1HG2  VAL  71          1HG2      VAL  71  -7.195  -6.484   3.300
  517   2HG2  VAL  71          2HG2      VAL  71  -7.783  -6.337   4.956
  518   3HG2  VAL  71          3HG2      VAL  71  -7.099  -7.863   4.396
  519    H    GLU  72           H        GLU  72  -3.188  -7.588   6.087
  520    HA   GLU  72           HA       GLU  72  -1.790  -5.217   7.120
  521   1HB   GLU  72          2HB       GLU  72  -1.952  -6.834   8.938
  522   2HB   GLU  72          1HB       GLU  72  -1.266  -8.085   7.911
  523   1HG   GLU  72          2HG       GLU  72   0.831  -6.840   7.791
  524   2HG   GLU  72          1HG       GLU  72   0.145  -5.587   8.822
  525    H    ILE  73           H        ILE  73   0.140  -4.716   6.186
  526    HA   ILE  73           HA       ILE  73   1.407  -6.588   4.353
  527    HB   ILE  73           HB       ILE  73   0.410  -3.884   3.442
  528   1HG1  ILE  73          2HG1      ILE  73  -1.316  -5.651   3.479
  529   2HG1  ILE  73          1HG1      ILE  73  -0.936  -5.131   1.840
  530   1HG2  ILE  73          1HG2      ILE  73   2.208  -5.892   2.105
  531   2HG2  ILE  73          2HG2      ILE  73   2.545  -4.198   2.463
  532   3HG2  ILE  73          3HG2      ILE  73   1.363  -4.620   1.224
  533   1HD1  ILE  73          1HD1      ILE  73  -1.219  -7.612   2.191
  534   2HD1  ILE  73          2HD1      ILE  73   0.296  -7.568   3.093
  535   3HD1  ILE  73          3HD1      ILE  73   0.271  -7.109   1.391
  536    H    ASP  74           H        ASP  74   3.547  -6.461   4.615
  537    HA   ASP  74           HA       ASP  74   4.621  -4.147   6.038
  538   1HB   ASP  74          2HB       ASP  74   6.641  -5.628   6.339
  539   2HB   ASP  74          1HB       ASP  74   5.161  -6.212   7.093
  540    H    GLY  75           H        GLY  75   5.052  -2.587   4.614
  541   1HA   GLY  75          2HA       GLY  75   6.086  -2.959   2.008
  542   2HA   GLY  75          1HA       GLY  75   6.031  -1.442   2.884
  543    H    ARG  76           H        ARG  76   7.629  -3.152   5.023
  544    HA   ARG  76           HA       ARG  76  10.194  -2.365   3.930
  545   1HB   ARG  76          2HB       ARG  76   9.665  -1.439   6.102
  546   2HB   ARG  76          1HB       ARG  76   9.362  -3.048   6.744
  547   1HG   ARG  76          2HG       ARG  76  11.710  -3.621   6.457
  548   2HG   ARG  76          1HG       ARG  76  12.025  -2.025   5.774
  549   1HD   ARG  76          2HD       ARG  76  12.679  -2.113   8.119
  550   2HD   ARG  76          1HD       ARG  76  11.342  -0.989   7.880
  551    HE   ARG  76           HE       ARG  76  10.281  -3.486   8.558
  552   1HH1  ARG  76          1HH1      ARG  76  12.183  -0.942  10.003
  553   2HH1  ARG  76          2HH1      ARG  76  11.627  -1.269  11.610
  554   1HH2  ARG  76          1HH2      ARG  76   9.549  -3.917  10.671
  555   2HH2  ARG  76          2HH2      ARG  76  10.132  -2.958  11.990
  556    H    ALA  77           H        ALA  77   8.546  -5.152   5.230
  557    HA   ALA  77           HA       ALA  77  10.878  -6.807   4.709
  558   1HB   ALA  77          1HB       ALA  77   9.238  -8.537   5.881
  559   2HB   ALA  77          2HB       ALA  77   8.556  -7.040   6.515
  560   3HB   ALA  77          3HB       ALA  77  10.254  -7.421   6.793
  561    H    LEU  78           H        LEU  78   7.915  -5.999   3.262
  562    HA   LEU  78           HA       LEU  78   7.813  -8.544   1.798
  563   1HB   LEU  78          2HB       LEU  78   5.776  -7.292   2.958
  564   2HB   LEU  78          1HB       LEU  78   5.746  -6.429   1.435
  565    HG   LEU  78           HG       LEU  78   4.166  -8.257   1.374
  566   1HD1  LEU  78          1HD1      LEU  78   5.300  -7.720  -0.710
  567   2HD1  LEU  78          2HD1      LEU  78   4.945  -9.444  -0.611
  568   3HD1  LEU  78          3HD1      LEU  78   6.583  -8.864  -0.318
  569   1HD2  LEU  78          1HD2      LEU  78   4.688  -9.960   2.746
  570   2HD2  LEU  78          2HD2      LEU  78   6.426  -9.749   2.522
  571   3HD2  LEU  78          3HD2      LEU  78   5.479 -10.614   1.311
  572    H    VAL  79           H        VAL  79   9.853  -6.549   1.302
  573    HA   VAL  79           HA       VAL  79   9.149  -5.190  -1.122
  574    HB   VAL  79           HB       VAL  79  11.886  -5.611   0.079
  575   1HG1  VAL  79          1HG1      VAL  79  11.236  -4.705  -2.440
  576   2HG1  VAL  79          2HG1      VAL  79  12.748  -4.400  -1.587
  577   3HG1  VAL  79          3HG1      VAL  79  11.442  -3.217  -1.516
  578   1HG2  VAL  79          1HG2      VAL  79  11.638  -3.388   1.034
  579   2HG2  VAL  79          2HG2      VAL  79  10.363  -4.458   1.620
  580   3HG2  VAL  79          3HG2      VAL  79  10.009  -3.268   0.367
  581    H    ALA  80           H        ALA  80   8.666  -6.548  -2.777
  582    HA   ALA  80           HA       ALA  80  10.564  -8.706  -3.393
  583   1HB   ALA  80          1HB       ALA  80   8.237  -9.401  -3.084
  584   2HB   ALA  80          2HB       ALA  80   8.786  -9.691  -4.735
  585   3HB   ALA  80          3HB       ALA  80   7.742  -8.316  -4.383
  586    H    ARG  81           H        ARG  81  12.129  -7.839  -4.637
  587    HA   ARG  81           HA       ARG  81  11.285  -6.335  -7.030
  588   1HB   ARG  81          2HB       ARG  81  13.950  -6.186  -5.614
  589   2HB   ARG  81          1HB       ARG  81  13.431  -5.201  -6.975
  590   1HG   ARG  81          2HG       ARG  81  12.209  -5.181  -4.223
  591   2HG   ARG  81          1HG       ARG  81  13.324  -3.977  -4.868
  592   1HD   ARG  81          2HD       ARG  81  11.707  -3.406  -6.611
  593   2HD   ARG  81          1HD       ARG  81  10.600  -4.633  -5.995
  594    HE   ARG  81           HE       ARG  81   9.898  -3.108  -4.464
  595   1HH1  ARG  81          1HH1      ARG  81  13.115  -2.202  -5.473
  596   2HH1  ARG  81          2HH1      ARG  81  13.170  -0.797  -4.463
  597   1HH2  ARG  81          1HH2      ARG  81   9.968  -1.256  -3.143
  598   2HH2  ARG  81          2HH2      ARG  81  11.383  -0.258  -3.142
  599    HA   PRO  82           HA       PRO  82  12.953 -10.256  -8.715
  600   1HB   PRO  82          2HB       PRO  82  11.481  -9.365 -11.105
  601   2HB   PRO  82          1HB       PRO  82  11.354 -10.880 -10.209
  602   1HG   PRO  82          2HG       PRO  82   9.419  -9.023 -10.115
  603   2HG   PRO  82          1HG       PRO  82   9.829 -10.017  -8.705
  604   1HD   PRO  82          2HD       PRO  82  10.595  -7.186  -9.315
  605   2HD   PRO  82          1HD       PRO  82  10.076  -7.905  -7.775
  606    H    GLU  83           H        GLU  83  13.314  -6.979  -9.612
  607    HA   GLU  83           HA       GLU  83  15.313  -7.670 -11.649
  608   1HB   GLU  83          2HB       GLU  83  13.556  -6.149 -12.411
  609   2HB   GLU  83          1HB       GLU  83  13.941  -5.036 -11.105
  610   1HG   GLU  83          2HG       GLU  83  14.881  -4.266 -13.205
  611   2HG   GLU  83          1HG       GLU  83  16.158  -4.668 -12.056
  612    H    GLU  84           H        GLU  84  14.907  -6.329  -8.508
  613    HA   GLU  84           HA       GLU  84  17.597  -5.194  -8.495
  614   1HB   GLU  84          2HB       GLU  84  15.483  -5.190  -6.338
  615   2HB   GLU  84          1HB       GLU  84  17.015  -4.334  -6.273
  616   1HG   GLU  84          2HG       GLU  84  14.797  -3.832  -8.246
  617   2HG   GLU  84          1HG       GLU  84  15.182  -2.837  -6.842
  618    H    ARG  85           H        ARG  85  16.609  -8.189  -8.339
  619    HA   ARG  85           HA       ARG  85  17.195 -10.120  -7.302
  620   1HB   ARG  85          2HB       ARG  85  19.599 -10.357  -6.805
  621   2HB   ARG  85          1HB       ARG  85  19.302  -9.621  -8.370
  622   1HG   ARG  85          2HG       ARG  85  19.828  -7.433  -7.473
  623   2HG   ARG  85          1HG       ARG  85  20.054  -8.125  -5.867
  624   1HD   ARG  85          2HD       ARG  85  22.199  -7.773  -6.940
  625   2HD   ARG  85          1HD       ARG  85  21.894  -9.498  -6.732
  626    HE   ARG  85           HE       ARG  85  22.044  -9.715  -8.989
  627   1HH1  ARG  85          1HH1      ARG  85  21.215  -6.397  -8.284
  628   2HH1  ARG  85          2HH1      ARG  85  21.225  -5.913  -9.945
  629   1HH2  ARG  85          1HH2      ARG  85  22.063  -9.075 -11.174
  630   2HH2  ARG  85          2HH2      ARG  85  21.708  -7.430 -11.585
  631    H    ILE  86           H        ILE  86  16.196 -10.661  -5.500
  632    HA   ILE  86           HA       ILE  86  16.084  -9.159  -3.147
  633    HB   ILE  86           HB       ILE  86  15.707 -12.144  -3.435
  634   1HG1  ILE  86          2HG1      ILE  86  13.694  -9.890  -3.608
  635   2HG1  ILE  86          1HG1      ILE  86  14.287 -10.835  -4.971
  636   1HG2  ILE  86          1HG2      ILE  86  14.802 -10.214  -1.304
  637   2HG2  ILE  86          2HG2      ILE  86  15.955 -11.536  -1.120
  638   3HG2  ILE  86          3HG2      ILE  86  14.256 -11.886  -1.439
  639   1HD1  ILE  86          1HD1      ILE  86  12.352 -11.937  -4.585
  640   2HD1  ILE  86          2HD1      ILE  86  12.341 -11.549  -2.865
  641   3HD1  ILE  86          3HD1      ILE  86  13.388 -12.832  -3.472
  Start of MODEL   12
    1    H    ARG   9           H        ARG   9  -4.533 -14.841  -4.543
    2    HA   ARG   9           HA       ARG   9  -6.420 -13.678  -5.040
    3   1HB   ARG   9          2HB       ARG   9  -5.501 -11.877  -2.792
    4   2HB   ARG   9          1HB       ARG   9  -7.101 -11.859  -3.519
    5   1HG   ARG   9          2HG       ARG   9  -7.469 -14.156  -2.757
    6   2HG   ARG   9          1HG       ARG   9  -5.868 -14.157  -2.013
    7   1HD   ARG   9          2HD       ARG   9  -7.613 -13.708  -0.364
    8   2HD   ARG   9          1HD       ARG   9  -6.536 -12.324  -0.550
    9    HE   ARG   9           HE       ARG   9  -8.722 -11.987  -2.265
   10   1HH1  ARG   9          1HH1      ARG   9  -8.018 -12.046   1.152
   11   2HH1  ARG   9          2HH1      ARG   9  -9.316 -10.977   1.564
   12   1HH2  ARG   9          1HH2      ARG   9 -10.428 -10.581  -1.726
   13   2HH2  ARG   9          2HH2      ARG   9 -10.684 -10.145  -0.069
   14    H    HIS  10           H        HIS  10  -7.095 -12.024  -6.387
   15    HA   HIS  10           HA       HIS  10  -4.943 -10.270  -7.355
   16   1HB   HIS  10          2HB       HIS  10  -7.462 -11.193  -8.754
   17   2HB   HIS  10          1HB       HIS  10  -6.239 -10.138  -9.453
   18    HD1  HIS  10           1HD      HIS  10  -6.172 -13.564  -7.774
   19    HD2  HIS  10           2HD      HIS  10  -4.615 -11.558 -11.064
   20    HE1  HIS  10           1HE      HIS  10  -4.752 -15.252  -8.981
   21    HE2  HIS  10           2HE      HIS  10  -3.745 -13.989 -10.914
   22    H    GLU  11           H        GLU  11  -8.340 -10.332  -6.401
   23    HA   GLU  11           HA       GLU  11  -8.803  -7.559  -6.861
   24   1HB   GLU  11          2HB       GLU  11 -10.295  -9.510  -5.097
   25   2HB   GLU  11          1HB       GLU  11 -10.870  -7.915  -5.563
   26   1HG   GLU  11          2HG       GLU  11 -10.303 -10.185  -7.456
   27   2HG   GLU  11          1HG       GLU  11 -11.897  -9.704  -6.879
   28    H    LEU  12           H        LEU  12  -8.907  -5.861  -5.393
   29    HA   LEU  12           HA       LEU  12  -8.513  -6.044  -2.630
   30   1HB   LEU  12          2HB       LEU  12  -6.285  -6.856  -3.205
   31   2HB   LEU  12          1HB       LEU  12  -6.005  -5.437  -4.198
   32    HG   LEU  12           HG       LEU  12  -6.110  -4.016  -2.190
   33   1HD1  LEU  12          1HD1      LEU  12  -6.185  -4.972   0.015
   34   2HD1  LEU  12          2HD1      LEU  12  -6.276  -6.601  -0.654
   35   3HD1  LEU  12          3HD1      LEU  12  -7.614  -5.477  -0.885
   36   1HD2  LEU  12          1HD2      LEU  12  -3.933  -4.644  -2.819
   37   2HD2  LEU  12          2HD2      LEU  12  -4.151  -6.293  -2.231
   38   3HD2  LEU  12          3HD2      LEU  12  -4.024  -4.958  -1.085
   39    H    ILE  13           H        ILE  13  -8.023  -4.162  -5.562
   40    HA   ILE  13           HA       ILE  13  -7.821  -1.610  -4.523
   41    HB   ILE  13           HB       ILE  13  -9.358  -2.347  -7.015
   42   1HG1  ILE  13          2HG1      ILE  13  -6.409  -1.748  -6.661
   43   2HG1  ILE  13          1HG1      ILE  13  -7.094  -3.331  -7.014
   44   1HG2  ILE  13          1HG2      ILE  13  -9.803  -0.104  -6.645
   45   2HG2  ILE  13          2HG2      ILE  13  -8.373  -0.035  -7.674
   46   3HG2  ILE  13          3HG2      ILE  13  -8.219   0.198  -5.931
   47   1HD1  ILE  13          1HD1      ILE  13  -6.105  -2.087  -8.960
   48   2HD1  ILE  13          2HD1      ILE  13  -7.456  -0.961  -8.819
   49   3HD1  ILE  13          3HD1      ILE  13  -7.758  -2.661  -9.176
   50    H    GLY  14           H        GLY  14  -9.417   0.109  -4.348
   51   1HA   GLY  14          2HA       GLY  14 -11.596   0.925  -3.998
   52   2HA   GLY  14          1HA       GLY  14 -12.188  -0.728  -3.974
   53    H    LEU  15           H        LEU  15  -9.619  -0.931  -2.040
   54    HA   LEU  15           HA       LEU  15 -11.238  -0.531   0.363
   55   1HB   LEU  15          2HB       LEU  15  -8.597  -1.945   0.001
   56   2HB   LEU  15          1HB       LEU  15  -9.532  -1.893   1.482
   57    HG   LEU  15           HG       LEU  15 -10.410  -3.203  -1.091
   58   1HD1  LEU  15          1HD1      LEU  15  -9.973  -4.766   1.368
   59   2HD1  LEU  15          2HD1      LEU  15  -8.524  -4.146   0.576
   60   3HD1  LEU  15          3HD1      LEU  15  -9.644  -5.176  -0.314
   61   1HD2  LEU  15          1HD2      LEU  15 -11.775  -2.570   1.446
   62   2HD2  LEU  15          2HD2      LEU  15 -12.021  -4.198   0.815
   63   3HD2  LEU  15          3HD2      LEU  15 -12.435  -2.796  -0.172
   64    H    SER  16           H        SER  16 -10.150   0.326   2.311
   65    HA   SER  16           HA       SER  16  -8.534   2.653   1.593
   66   1HB   SER  16          2HB       SER  16  -9.057   3.470   3.857
   67   2HB   SER  16          1HB       SER  16 -10.531   3.040   2.989
   68    HG   SER  16           HG       SER  16  -9.191   1.497   4.958
   69    H    VAL  17           H        VAL  17  -6.569   3.141   2.686
   70    HA   VAL  17           HA       VAL  17  -5.391   1.040   4.320
   71    HB   VAL  17           HB       VAL  17  -4.768   0.316   2.114
   72   1HG1  VAL  17          1HG1      VAL  17  -3.327   1.861   0.695
   73   2HG1  VAL  17          2HG1      VAL  17  -3.930   3.170   1.709
   74   3HG1  VAL  17          3HG1      VAL  17  -5.057   2.204   0.755
   75   1HG2  VAL  17          1HG2      VAL  17  -2.484   1.680   3.533
   76   2HG2  VAL  17          2HG2      VAL  17  -2.294   0.480   2.256
   77   3HG2  VAL  17          3HG2      VAL  17  -3.060   0.031   3.780
   78    H    ARG  18           H        ARG  18  -4.236   1.875   5.924
   79    HA   ARG  18           HA       ARG  18  -3.371   4.684   5.692
   80   1HB   ARG  18          2HB       ARG  18  -4.180   3.155   8.170
   81   2HB   ARG  18          1HB       ARG  18  -3.608   4.817   8.145
   82   1HG   ARG  18          2HG       ARG  18  -5.540   5.464   6.796
   83   2HG   ARG  18          1HG       ARG  18  -6.114   3.795   6.823
   84   1HD   ARG  18          2HD       ARG  18  -6.299   3.899   9.258
   85   2HD   ARG  18          1HD       ARG  18  -5.716   5.561   9.235
   86    HE   ARG  18           HE       ARG  18  -7.956   5.388   7.568
   87   1HH1  ARG  18          1HH1      ARG  18  -7.152   5.155  10.956
   88   2HH1  ARG  18          2HH1      ARG  18  -8.704   5.708  11.490
   89   1HH2  ARG  18          1HH2      ARG  18  -9.996   6.117   8.268
   90   2HH2  ARG  18          2HH2      ARG  18 -10.319   6.254   9.964
   91    H    ILE  19           H        ILE  19  -1.316   5.232   6.201
   92    HA   ILE  19           HA       ILE  19   0.551   3.028   6.673
   93    HB   ILE  19           HB       ILE  19   1.075   5.860   5.760
   94   1HG1  ILE  19          2HG1      ILE  19   1.674   4.774   3.604
   95   2HG1  ILE  19          1HG1      ILE  19   1.130   3.233   4.257
   96   1HG2  ILE  19          1HG2      ILE  19   3.323   4.541   5.131
   97   2HG2  ILE  19          2HG2      ILE  19   2.864   3.666   6.591
   98   3HG2  ILE  19          3HG2      ILE  19   3.103   5.413   6.647
   99   1HD1  ILE  19          1HD1      ILE  19  -1.115   3.870   4.214
  100   2HD1  ILE  19          2HD1      ILE  19  -0.464   4.564   2.728
  101   3HD1  ILE  19          3HD1      ILE  19  -0.722   5.588   4.141
  102    H    ALA  20           H        ALA  20   1.702   2.836   8.502
  103    HA   ALA  20           HA       ALA  20   1.298   4.864  10.579
  104   1HB   ALA  20          1HB       ALA  20   2.600   2.324  11.299
  105   2HB   ALA  20          2HB       ALA  20   0.934   2.197  10.735
  106   3HB   ALA  20          3HB       ALA  20   1.321   3.217  12.120
  107    H    ARG  21           H        ARG  21   3.713   3.320   8.651
  108    HA   ARG  21           HA       ARG  21   5.657   5.290   9.370
  109   1HB   ARG  21          2HB       ARG  21   6.173   2.388  10.030
  110   2HB   ARG  21          1HB       ARG  21   7.406   3.641  10.020
  111   1HG   ARG  21          2HG       ARG  21   6.168   4.833  11.788
  112   2HG   ARG  21          1HG       ARG  21   5.000   3.509  11.828
  113   1HD   ARG  21          2HD       ARG  21   6.653   3.266  13.607
  114   2HD   ARG  21          1HD       ARG  21   6.781   1.950  12.441
  115    HE   ARG  21           HE       ARG  21   8.920   2.615  12.051
  116   1HH1  ARG  21          1HH1      ARG  21   7.167   5.346  13.337
  117   2HH1  ARG  21          2HH1      ARG  21   8.543   6.395  13.322
  118   1HH2  ARG  21          1HH2      ARG  21  10.733   3.992  12.038
  119   2HH2  ARG  21          2HH2      ARG  21  10.569   5.626  12.588
  120    H    SER  22           H        SER  22   6.897   5.747   7.649
  121    HA   SER  22           HA       SER  22   7.038   3.748   5.490
  122   1HB   SER  22          2HB       SER  22   5.482   5.524   4.859
  123   2HB   SER  22          1HB       SER  22   6.711   6.742   5.196
  124    HG   SER  22           HG       SER  22   6.308   5.678   2.918
  125    H    VAL  23           H        VAL  23   8.884   3.924   4.076
  126    HA   VAL  23           HA       VAL  23  11.316   4.147   5.430
  127    HB   VAL  23           HB       VAL  23  11.072   2.793   3.414
  128   1HG1  VAL  23          1HG1      VAL  23   9.685   3.867   1.932
  129   2HG1  VAL  23          2HG1      VAL  23  11.256   4.199   1.200
  130   3HG1  VAL  23          3HG1      VAL  23  10.458   5.434   2.175
  131   1HG2  VAL  23          1HG2      VAL  23  13.163   3.423   2.291
  132   2HG2  VAL  23          2HG2      VAL  23  13.311   3.522   4.046
  133   3HG2  VAL  23          3HG2      VAL  23  13.116   4.994   3.094
  134    H    HIS  24           H        HIS  24   9.418   6.523   3.756
  135    HA   HIS  24           HA       HIS  24  11.506   8.528   4.306
  136   1HB   HIS  24          2HB       HIS  24   9.601   8.476   1.954
  137   2HB   HIS  24          1HB       HIS  24  10.737   9.771   2.315
  138    HD1  HIS  24           1HD      HIS  24  13.358   8.629   2.608
  139    HD2  HIS  24           2HD      HIS  24  10.603   6.880   0.033
  140    HE1  HIS  24           1HE      HIS  24  14.719   7.264   0.993
  141    HE2  HIS  24           2HE      HIS  24  13.025   6.149  -0.504
  142    H    ARG  25           H        ARG  25  10.884  10.087   5.648
  143    HA   ARG  25           HA       ARG  25   8.375  10.163   6.859
  144   1HB   ARG  25          2HB       ARG  25  10.388  11.114   7.885
  145   2HB   ARG  25          1HB       ARG  25  10.426  12.373   6.656
  146   1HG   ARG  25          2HG       ARG  25   8.300  13.244   7.467
  147   2HG   ARG  25          1HG       ARG  25   8.239  11.970   8.686
  148   1HD   ARG  25          2HD       ARG  25  10.308  12.828   9.678
  149   2HD   ARG  25          1HD       ARG  25  10.361  14.104   8.461
  150    HE   ARG  25           HE       ARG  25   7.895  14.241   9.774
  151   1HH1  ARG  25          1HH1      ARG  25  11.284  14.735  10.449
  152   2HH1  ARG  25          2HH1      ARG  25  10.995  15.917  11.681
  153   1HH2  ARG  25          1HH2      ARG  25   7.513  15.797  11.393
  154   2HH2  ARG  25          2HH2      ARG  25   8.853  16.521  12.216
  155    H    ASP  26           H        ASP  26   9.428  11.497   3.876
  156    HA   ASP  26           HA       ASP  26   7.609  13.622   3.619
  157   1HB   ASP  26          2HB       ASP  26   8.853  11.909   1.462
  158   2HB   ASP  26          1HB       ASP  26   8.047  13.450   1.195
  159    H    ILE  27           H        ILE  27   7.231  10.220   3.326
  160    HA   ILE  27           HA       ILE  27   4.511  10.581   2.324
  161    HB   ILE  27           HB       ILE  27   6.151   8.062   2.164
  162   1HG1  ILE  27          2HG1      ILE  27   7.081   9.901   0.768
  163   2HG1  ILE  27          1HG1      ILE  27   6.478   8.553  -0.192
  164   1HG2  ILE  27          1HG2      ILE  27   3.380   8.793   1.447
  165   2HG2  ILE  27          2HG2      ILE  27   4.048   7.249   1.974
  166   3HG2  ILE  27          3HG2      ILE  27   4.247   7.772   0.302
  167   1HD1  ILE  27          1HD1      ILE  27   5.066  11.170   0.292
  168   2HD1  ILE  27          2HD1      ILE  27   4.423   9.816  -0.638
  169   3HD1  ILE  27          3HD1      ILE  27   5.864  10.666  -1.197
  170    H    GLN  28           H        GLN  28   6.447   9.461   4.921
  171    HA   GLN  28           HA       GLN  28   4.832   7.536   6.097
  172   1HB   GLN  28          2HB       GLN  28   7.099   8.047   6.877
  173   2HB   GLN  28          1HB       GLN  28   6.554   9.611   7.467
  174   1HG   GLN  28          2HG       GLN  28   5.134   8.547   9.100
  175   2HG   GLN  28          1HG       GLN  28   5.546   6.957   8.461
  176   1HE2  GLN  28          1HE2      GLN  28   6.098   8.929  10.947
  177   2HE2  GLN  28          2HE2      GLN  28   7.700   8.452  11.385
  178    H    GLY  29           H        GLY  29   3.285   7.619   7.774
  179   1HA   GLY  29          2HA       GLY  29   1.525   8.497   8.981
  180   2HA   GLY  29          1HA       GLY  29   2.167  10.101   8.665
  181    H    ILE  30           H        ILE  30   1.862   8.498   5.760
  182    HA   ILE  30           HA       ILE  30  -0.312  10.140   4.938
  183    HB   ILE  30           HB       ILE  30   1.509   9.566   3.394
  184   1HG1  ILE  30          2HG1      ILE  30  -1.172   8.470   2.509
  185   2HG1  ILE  30          1HG1      ILE  30  -0.707  10.170   2.493
  186   1HG2  ILE  30          1HG2      ILE  30   1.564   7.141   4.369
  187   2HG2  ILE  30          2HG2      ILE  30   2.034   7.445   2.698
  188   3HG2  ILE  30          3HG2      ILE  30   0.430   6.810   3.061
  189   1HD1  ILE  30          1HD1      ILE  30   1.018   9.699   0.845
  190   2HD1  ILE  30          2HD1      ILE  30  -0.556   9.147   0.272
  191   3HD1  ILE  30          3HD1      ILE  30   0.614   7.983   0.892
  192    H    SER  31           H        SER  31  -2.326   9.415   4.064
  193    HA   SER  31           HA       SER  31  -3.203   6.713   4.655
  194   1HB   SER  31          2HB       SER  31  -4.530   9.113   5.944
  195   2HB   SER  31          1HB       SER  31  -5.130   7.456   6.005
  196    HG   SER  31           HG       SER  31  -2.940   8.613   7.300
  197    H    GLY  32           H        GLY  32  -4.894   6.055   3.346
  198   1HA   GLY  32          2HA       GLY  32  -6.733   7.725   2.072
  199   2HA   GLY  32          1HA       GLY  32  -5.355   7.554   0.995
  200    H    ARG  33           H        ARG  33  -6.922   6.588  -0.446
  201    HA   ARG  33           HA       ARG  33  -7.710   3.879   0.283
  202   1HB   ARG  33          2HB       ARG  33  -9.391   5.563  -0.613
  203   2HB   ARG  33          1HB       ARG  33  -8.620   5.339  -2.164
  204   1HG   ARG  33          2HG       ARG  33  -9.247   3.047  -2.253
  205   2HG   ARG  33          1HG       ARG  33  -9.732   3.058  -0.561
  206   1HD   ARG  33          2HD       ARG  33 -11.096   4.364  -2.900
  207   2HD   ARG  33          1HD       ARG  33 -11.715   3.097  -1.850
  208    HE   ARG  33           HE       ARG  33 -11.887   5.885  -1.403
  209   1HH1  ARG  33          1HH1      ARG  33 -11.442   2.854   0.271
  210   2HH1  ARG  33          2HH1      ARG  33 -12.046   3.456   1.778
  211   1HH2  ARG  33          1HH2      ARG  33 -12.685   6.674   0.576
  212   2HH2  ARG  33          2HH2      ARG  33 -12.753   5.623   1.951
  213    H    VAL  34           H        VAL  34  -7.657   2.334  -1.709
  214    HA   VAL  34           HA       VAL  34  -4.863   2.278  -2.546
  215    HB   VAL  34           HB       VAL  34  -5.692   0.384  -1.223
  216   1HG1  VAL  34          1HG1      VAL  34  -7.853  -0.105  -1.694
  217   2HG1  VAL  34          2HG1      VAL  34  -7.081  -1.278  -2.752
  218   3HG1  VAL  34          3HG1      VAL  34  -7.678   0.244  -3.412
  219   1HG2  VAL  34          1HG2      VAL  34  -4.682  -1.347  -2.542
  220   2HG2  VAL  34          2HG2      VAL  34  -3.815   0.160  -2.837
  221   3HG2  VAL  34          3HG2      VAL  34  -4.969  -0.441  -4.027
  222    H    VAL  35           H        VAL  35  -4.218   1.456  -4.635
  223    HA   VAL  35           HA       VAL  35  -6.301   1.587  -6.682
  224    HB   VAL  35           HB       VAL  35  -4.860   3.773  -6.525
  225   1HG1  VAL  35          1HG1      VAL  35  -3.053   2.005  -8.149
  226   2HG1  VAL  35          2HG1      VAL  35  -2.682   2.719  -6.584
  227   3HG1  VAL  35          3HG1      VAL  35  -2.922   3.752  -7.988
  228   1HG2  VAL  35          1HG2      VAL  35  -6.547   2.969  -8.291
  229   2HG2  VAL  35          2HG2      VAL  35  -5.125   2.555  -9.249
  230   3HG2  VAL  35          3HG2      VAL  35  -5.396   4.224  -8.752
  231    H    ASP  36           H        ASP  36  -2.876   0.841  -6.037
  232    HA   ASP  36           HA       ASP  36  -3.187  -1.739  -7.256
  233   1HB   ASP  36          2HB       ASP  36  -1.349   0.287  -8.540
  234   2HB   ASP  36          1HB       ASP  36  -1.402  -1.426  -8.941
  235    H    GLU  37           H        GLU  37  -1.345  -3.110  -7.037
  236    HA   GLU  37           HA       GLU  37   0.568  -2.230  -4.974
  237   1HB   GLU  37          2HB       GLU  37  -1.012  -3.875  -4.075
  238   2HB   GLU  37          1HB       GLU  37  -0.633  -4.979  -5.389
  239   1HG   GLU  37          2HG       GLU  37   1.678  -5.130  -4.575
  240   2HG   GLU  37          1HG       GLU  37   1.261  -4.060  -3.239
  241    H    THR  38           H        THR  38   2.583  -2.104  -5.762
  242    HA   THR  38           HA       THR  38   3.295  -3.853  -8.025
  243    HB   THR  38           HB       THR  38   4.455  -1.154  -7.312
  244    HG1  THR  38           1HG      THR  38   2.608  -1.916  -9.324
  245   1HG2  THR  38          1HG2      THR  38   5.903  -2.800  -8.629
  246   2HG2  THR  38          2HG2      THR  38   5.660  -1.187  -9.294
  247   3HG2  THR  38          3HG2      THR  38   4.749  -2.552  -9.938
  248    H    ARG  39           H        ARG  39   5.371  -4.751  -8.124
  249    HA   ARG  39           HA       ARG  39   6.399  -5.846  -5.785
  250   1HB   ARG  39          2HB       ARG  39   6.763  -6.813  -7.987
  251   2HB   ARG  39          1HB       ARG  39   7.768  -5.445  -8.438
  252   1HG   ARG  39          2HG       ARG  39   9.387  -6.065  -6.717
  253   2HG   ARG  39          1HG       ARG  39   8.372  -7.431  -6.256
  254   1HD   ARG  39          2HD       ARG  39   9.657  -7.005  -8.951
  255   2HD   ARG  39          1HD       ARG  39  10.206  -8.132  -7.712
  256    HE   ARG  39           HE       ARG  39   7.531  -8.702  -8.300
  257   1HH1  ARG  39          1HH1      ARG  39  10.668  -8.852  -9.822
  258   2HH1  ARG  39          2HH1      ARG  39  10.246 -10.183 -10.846
  259   1HH2  ARG  39          1HH2      ARG  39   6.975 -10.453  -9.646
  260   2HH2  ARG  39          2HH2      ARG  39   8.149 -11.092 -10.747
  261    H    ASN  40           H        ASN  40   6.799  -2.661  -6.905
  262    HA   ASN  40           HA       ASN  40   8.818  -2.238  -4.853
  263   1HB   ASN  40          2HB       ASN  40  10.211  -0.850  -6.326
  264   2HB   ASN  40          1HB       ASN  40  10.136  -2.523  -6.850
  265   1HD2  ASN  40          1HD2      ASN  40   7.218  -1.139  -7.666
  266   2HD2  ASN  40          2HD2      ASN  40   7.592  -0.677  -9.279
  267    H    THR  41           H        THR  41   5.874  -1.405  -5.788
  268    HA   THR  41           HA       THR  41   6.046   1.136  -4.451
  269    HB   THR  41           HB       THR  41   4.838   2.341  -6.334
  270    HG1  THR  41           1HG      THR  41   6.039   0.382  -7.967
  271   1HG2  THR  41          1HG2      THR  41   7.653   1.569  -7.006
  272   2HG2  THR  41          2HG2      THR  41   7.225   2.705  -5.727
  273   3HG2  THR  41          3HG2      THR  41   6.806   3.065  -7.403
  274    H    LEU  42           H        LEU  42   4.089   2.029  -3.840
  275    HA   LEU  42           HA       LEU  42   1.712   0.320  -4.207
  276   1HB   LEU  42          2HB       LEU  42   2.707  -0.038  -1.961
  277   2HB   LEU  42          1HB       LEU  42   2.556   1.674  -1.636
  278    HG   LEU  42           HG       LEU  42   0.807   0.325  -0.537
  279   1HD1  LEU  42          1HD1      LEU  42  -0.903   1.836  -0.892
  280   2HD1  LEU  42          2HD1      LEU  42  -0.593   1.943  -2.625
  281   3HD1  LEU  42          3HD1      LEU  42   0.494   2.734  -1.483
  282   1HD2  LEU  42          1HD2      LEU  42  -0.878  -0.172  -2.793
  283   2HD2  LEU  42          2HD2      LEU  42  -0.252  -1.314  -1.603
  284   3HD2  LEU  42          3HD2      LEU  42   0.681  -0.952  -3.056
  285    H    ARG  43           H        ARG  43   0.274   1.500  -5.326
  286    HA   ARG  43           HA       ARG  43   0.259   4.396  -4.850
  287   1HB   ARG  43          2HB       ARG  43   0.654   3.658  -7.167
  288   2HB   ARG  43          1HB       ARG  43  -0.914   2.873  -7.178
  289   1HG   ARG  43          2HG       ARG  43  -2.047   4.963  -7.016
  290   2HG   ARG  43          1HG       ARG  43  -0.541   5.813  -6.680
  291   1HD   ARG  43          2HD       ARG  43  -1.388   6.073  -9.026
  292   2HD   ARG  43          1HD       ARG  43   0.257   5.454  -8.895
  293    HE   ARG  43           HE       ARG  43  -1.410   3.250  -9.048
  294   1HH1  ARG  43          1HH1      ARG  43  -0.573   5.982 -11.048
  295   2HH1  ARG  43          2HH1      ARG  43  -0.829   5.131 -12.534
  296   1HH2  ARG  43          1HH2      ARG  43  -1.749   2.129 -11.000
  297   2HH2  ARG  43          2HH2      ARG  43  -1.497   2.944 -12.507
  298    H    ILE  44           H        ILE  44  -1.424   5.428  -4.087
  299    HA   ILE  44           HA       ILE  44  -3.661   3.875  -3.027
  300    HB   ILE  44           HB       ILE  44  -2.323   6.459  -2.322
  301   1HG1  ILE  44          2HG1      ILE  44  -3.136   4.041  -0.710
  302   2HG1  ILE  44          1HG1      ILE  44  -1.519   4.400  -1.309
  303   1HG2  ILE  44          1HG2      ILE  44  -4.577   6.049  -0.590
  304   2HG2  ILE  44          2HG2      ILE  44  -5.100   6.328  -2.250
  305   3HG2  ILE  44          3HG2      ILE  44  -4.056   7.495  -1.447
  306   1HD1  ILE  44          1HD1      ILE  44  -1.802   6.587   0.077
  307   2HD1  ILE  44          2HD1      ILE  44  -1.371   5.074   0.875
  308   3HD1  ILE  44          3HD1      ILE  44  -3.037   5.654   0.924
  309    H    GLU  45           H        GLU  45  -5.650   3.976  -3.956
  310    HA   GLU  45           HA       GLU  45  -6.370   6.514  -5.223
  311   1HB   GLU  45          2HB       GLU  45  -5.986   5.078  -7.088
  312   2HB   GLU  45          1HB       GLU  45  -6.900   3.764  -6.354
  313   1HG   GLU  45          2HG       GLU  45  -8.946   5.080  -6.561
  314   2HG   GLU  45          1HG       GLU  45  -8.027   6.401  -7.278
  315    H    MET  46           H        MET  46  -8.243   7.288  -4.749
  316    HA   MET  46           HA       MET  46 -10.086   5.707  -3.102
  317   1HB   MET  46          2HB       MET  46 -10.654   7.748  -1.883
  318   2HB   MET  46          1HB       MET  46  -8.943   7.372  -1.743
  319   1HG   MET  46          2HG       MET  46  -8.668   9.003  -3.722
  320   2HG   MET  46          1HG       MET  46 -10.275   9.563  -3.266
  321   1HE   MET  46          1HE       MET  46  -6.612   9.156  -2.420
  322   2HE   MET  46          2HE       MET  46  -7.137   8.414  -0.907
  323   3HE   MET  46          3HE       MET  46  -6.382  10.006  -0.890
  324    H    ASP  47           H        ASP  47 -12.206   5.765  -3.538
  325    HA   ASP  47           HA       ASP  47 -13.187   6.046  -6.027
  326   1HB   ASP  47          2HB       ASP  47 -14.708   6.578  -3.474
  327   2HB   ASP  47          1HB       ASP  47 -15.442   6.223  -5.035
  328    H    ASP  48           H        ASP  48 -12.651   8.660  -3.810
  329    HA   ASP  48           HA       ASP  48 -14.289  10.607  -4.985
  330   1HB   ASP  48          2HB       ASP  48 -11.606  10.979  -3.631
  331   2HB   ASP  48          1HB       ASP  48 -12.778  12.256  -3.948
  332    H    GLY  49           H        GLY  49 -11.602   8.985  -6.243
  333   1HA   GLY  49          2HA       GLY  49 -10.907   9.151  -8.481
  334   2HA   GLY  49          1HA       GLY  49 -11.520  10.799  -8.529
  335    H    ARG  50           H        ARG  50  -9.695   9.903  -5.779
  336    HA   ARG  50           HA       ARG  50  -7.452  11.530  -6.788
  337   1HB   ARG  50          2HB       ARG  50  -8.271  10.941  -3.953
  338   2HB   ARG  50          1HB       ARG  50  -6.872  11.892  -4.413
  339   1HG   ARG  50          2HG       ARG  50  -9.745  12.563  -5.015
  340   2HG   ARG  50          1HG       ARG  50  -8.737  13.311  -3.774
  341   1HD   ARG  50          2HD       ARG  50  -7.206  14.111  -5.519
  342   2HD   ARG  50          1HD       ARG  50  -8.237  13.378  -6.749
  343    HE   ARG  50           HE       ARG  50  -9.552  15.227  -6.630
  344   1HH1  ARG  50          1HH1      ARG  50  -7.800  14.965  -3.621
  345   2HH1  ARG  50          2HH1      ARG  50  -8.477  16.414  -2.958
  346   1HH2  ARG  50          1HH2      ARG  50 -10.434  17.136  -5.762
  347   2HH2  ARG  50          2HH2      ARG  50  -9.971  17.648  -4.174
  348    H    GLU  51           H        GLU  51  -5.690  10.481  -7.383
  349    HA   GLU  51           HA       GLU  51  -5.072   7.948  -6.028
  350   1HB   GLU  51          2HB       GLU  51  -4.042   7.185  -8.093
  351   2HB   GLU  51          1HB       GLU  51  -5.704   7.676  -8.388
  352   1HG   GLU  51          2HG       GLU  51  -4.885   9.830  -9.260
  353   2HG   GLU  51          1HG       GLU  51  -3.231   9.259  -9.042
  354    H    ILE  52           H        ILE  52  -3.372   8.158  -4.702
  355    HA   ILE  52           HA       ILE  52  -1.154   9.922  -5.516
  356    HB   ILE  52           HB       ILE  52  -2.338  10.889  -3.612
  357   1HG1  ILE  52          2HG1      ILE  52   0.343   9.706  -2.843
  358   2HG1  ILE  52          1HG1      ILE  52   0.097  11.188  -3.768
  359   1HG2  ILE  52          1HG2      ILE  52  -2.446   9.753  -1.466
  360   2HG2  ILE  52          2HG2      ILE  52  -1.667   8.333  -2.161
  361   3HG2  ILE  52          3HG2      ILE  52  -3.272   8.813  -2.709
  362   1HD1  ILE  52          1HD1      ILE  52  -0.988  12.223  -1.836
  363   2HD1  ILE  52          2HD1      ILE  52   0.637  11.668  -1.430
  364   3HD1  ILE  52          3HD1      ILE  52  -0.771  10.738  -0.912
  365    H    THR  53           H        THR  53   0.775   8.973  -5.701
  366    HA   THR  53           HA       THR  53   1.073   6.176  -5.289
  367    HB   THR  53           HB       THR  53   2.221   7.299  -7.108
  368    HG1  THR  53           1HG      THR  53   4.131   6.386  -5.225
  369   1HG2  THR  53          1HG2      THR  53   2.955   9.370  -6.662
  370   2HG2  THR  53          2HG2      THR  53   4.430   8.522  -6.196
  371   3HG2  THR  53          3HG2      THR  53   3.267   9.012  -4.964
  372    H    VAL  54           H        VAL  54   2.608   5.092  -3.979
  373    HA   VAL  54           HA       VAL  54   3.753   6.517  -1.710
  374    HB   VAL  54           HB       VAL  54   1.895   4.162  -1.314
  375   1HG1  VAL  54          1HG1      VAL  54   2.287   4.401   1.026
  376   2HG1  VAL  54          2HG1      VAL  54   3.221   5.877   0.781
  377   3HG1  VAL  54          3HG1      VAL  54   3.862   4.327   0.236
  378   1HG2  VAL  54          1HG2      VAL  54   0.464   5.783  -0.109
  379   2HG2  VAL  54          2HG2      VAL  54   0.619   6.152  -1.827
  380   3HG2  VAL  54          3HG2      VAL  54   1.533   7.082  -0.640
  381    HA   PRO  55           HA       PRO  55   6.926   3.555  -2.644
  382   1HB   PRO  55          2HB       PRO  55   8.574   3.973  -0.558
  383   2HB   PRO  55          1HB       PRO  55   8.360   5.170  -1.841
  384   1HG   PRO  55          2HG       PRO  55   7.112   5.071   0.880
  385   2HG   PRO  55          1HG       PRO  55   7.821   6.453   0.025
  386   1HD   PRO  55          2HD       PRO  55   5.142   5.985   0.131
  387   2HD   PRO  55          1HD       PRO  55   5.928   6.806  -1.231
  388    H    LYS  56           H        LYS  56   7.350   1.472  -2.296
  389    HA   LYS  56           HA       LYS  56   6.106   0.165   0.012
  390   1HB   LYS  56          2HB       LYS  56   6.875  -0.764  -2.727
  391   2HB   LYS  56          1HB       LYS  56   6.673  -1.929  -1.428
  392   1HG   LYS  56          2HG       LYS  56   4.381  -1.121  -1.088
  393   2HG   LYS  56          1HG       LYS  56   4.594  -0.008  -2.442
  394   1HD   LYS  56          2HD       LYS  56   4.902  -1.829  -3.967
  395   2HD   LYS  56          1HD       LYS  56   4.916  -2.998  -2.647
  396   1HE   LYS  56          2HE       LYS  56   2.576  -1.279  -3.464
  397   2HE   LYS  56          1HE       LYS  56   2.773  -2.991  -3.828
  398   1HZ   LYS  56          1HZ       LYS  56   2.717  -3.476  -1.472
  399   2HZ   LYS  56          2HZ       LYS  56   1.327  -2.622  -1.918
  400   3HZ   LYS  56          3HZ       LYS  56   2.577  -1.831  -1.100
  401    H    GLY  57           H        GLY  57   9.123   1.273  -0.792
  402   1HA   GLY  57          2HA       GLY  57  10.907  -0.764  -0.385
  403   2HA   GLY  57          1HA       GLY  57  11.184   0.881   0.163
  404    H    ILE  58           H        ILE  58   9.378   1.157   2.199
  405    HA   ILE  58           HA       ILE  58   9.435  -1.054   3.999
  406    HB   ILE  58           HB       ILE  58  11.075   1.365   4.779
  407   1HG1  ILE  58          2HG1      ILE  58  12.946  -0.428   4.926
  408   2HG1  ILE  58          1HG1      ILE  58  11.929  -1.366   3.841
  409   1HG2  ILE  58          1HG2      ILE  58  10.870  -1.228   6.277
  410   2HG2  ILE  58          2HG2      ILE  58   9.740   0.097   6.540
  411   3HG2  ILE  58          3HG2      ILE  58  11.459   0.334   6.846
  412   1HD1  ILE  58          1HD1      ILE  58  12.083   1.164   2.690
  413   2HD1  ILE  58          2HD1      ILE  58  12.906  -0.305   2.164
  414   3HD1  ILE  58          3HD1      ILE  58  13.710   0.810   3.268
  415    H    ALA  59           H        ALA  59   7.178  -0.192   3.393
  416    HA   ALA  59           HA       ALA  59   6.476   1.908   5.329
  417   1HB   ALA  59          1HB       ALA  59   6.268   2.335   2.760
  418   2HB   ALA  59          2HB       ALA  59   5.046   2.938   3.879
  419   3HB   ALA  59          3HB       ALA  59   4.749   1.462   2.960
  420    H    VAL  60           H        VAL  60   5.506   1.019   7.039
  421    HA   VAL  60           HA       VAL  60   3.906  -1.369   6.809
  422    HB   VAL  60           HB       VAL  60   5.270  -0.972   8.820
  423   1HG1  VAL  60          1HG1      VAL  60   4.994   0.786  10.275
  424   2HG1  VAL  60          2HG1      VAL  60   3.333   1.088   9.767
  425   3HG1  VAL  60          3HG1      VAL  60   4.674   1.574   8.730
  426   1HG2  VAL  60          1HG2      VAL  60   2.294  -1.082   9.298
  427   2HG2  VAL  60          2HG2      VAL  60   3.522  -1.499  10.494
  428   3HG2  VAL  60          3HG2      VAL  60   3.375  -2.449   9.014
  429    H    PHE  61           H        PHE  61   1.762  -1.461   6.454
  430    HA   PHE  61           HA       PHE  61   0.049   0.684   7.333
  431   1HB   PHE  61          2HB       PHE  61  -0.924   0.982   4.995
  432   2HB   PHE  61          1HB       PHE  61   0.633   1.732   5.316
  433    HD1  PHE  61           1HD      PHE  61  -0.731  -1.494   4.009
  434    HD2  PHE  61           2HD      PHE  61   2.262   1.518   3.738
  435    HE1  PHE  61           1HE      PHE  61   0.234  -2.629   2.048
  436    HE2  PHE  61           2HE      PHE  61   3.229   0.389   1.779
  437    HZ   PHE  61           HZ       PHE  61   2.213  -1.687   0.932
  438    H    HIS  62           H        HIS  62  -2.064   0.135   7.530
  439    HA   HIS  62           HA       HIS  62  -2.721  -2.675   6.933
  440   1HB   HIS  62          2HB       HIS  62  -3.961  -0.963   9.094
  441   2HB   HIS  62          1HB       HIS  62  -4.099  -2.707   8.893
  442    HD1  HIS  62           1HD      HIS  62  -1.366  -3.748   8.833
  443    HD2  HIS  62           2HD      HIS  62  -2.361  -0.484  11.200
  444    HE1  HIS  62           1HE      HIS  62   0.398  -3.654  10.621
  445    HE2  HIS  62           2HE      HIS  62  -0.268  -1.716  12.087
  446    H    PHE  63           H        PHE  63  -4.580  -3.114   5.828
  447    HA   PHE  63           HA       PHE  63  -5.990  -0.814   4.714
  448   1HB   PHE  63          2HB       PHE  63  -6.127  -3.748   3.984
  449   2HB   PHE  63          1HB       PHE  63  -6.996  -2.464   3.155
  450    HD1  PHE  63           1HD      PHE  63  -6.110  -1.860   1.146
  451    HD2  PHE  63           2HD      PHE  63  -3.474  -3.097   4.250
  452    HE1  PHE  63           1HE      PHE  63  -4.190  -1.534  -0.357
  453    HE2  PHE  63           2HE      PHE  63  -1.554  -2.770   2.754
  454    HZ   PHE  63           HZ       PHE  63  -1.907  -1.987   0.447
  455    H    ARG  64           H        ARG  64  -8.299  -0.716   4.658
  456    HA   ARG  64           HA       ARG  64  -9.714  -2.412   6.576
  457   1HB   ARG  64          2HB       ARG  64  -9.743   0.604   6.660
  458   2HB   ARG  64          1HB       ARG  64 -10.787  -0.448   7.608
  459   1HG   ARG  64          2HG       ARG  64  -8.333  -1.436   8.224
  460   2HG   ARG  64          1HG       ARG  64  -7.982   0.280   8.007
  461   1HD   ARG  64          2HD       ARG  64 -10.122  -0.871   9.780
  462   2HD   ARG  64          1HD       ARG  64  -8.565  -0.252  10.328
  463    HE   ARG  64           HE       ARG  64  -9.858   1.754   8.863
  464   1HH1  ARG  64          1HH1      ARG  64 -10.197   0.037  11.882
  465   2HH1  ARG  64          2HH1      ARG  64 -10.996   1.348  12.683
  466   1HH2  ARG  64          1HH2      ARG  64 -10.909   3.480   9.914
  467   2HH2  ARG  64          2HH2      ARG  64 -11.401   3.303  11.565
  468    H    THR  65           H        THR  65 -11.779  -2.871   6.005
  469    HA   THR  65           HA       THR  65 -12.799  -1.557   3.574
  470    HB   THR  65           HB       THR  65 -13.410  -4.327   4.624
  471    HG1  THR  65           1HG      THR  65 -11.383  -4.361   3.771
  472   1HG2  THR  65          1HG2      THR  65 -14.924  -4.629   3.020
  473   2HG2  THR  65          2HG2      THR  65 -13.988  -3.726   1.830
  474   3HG2  THR  65          3HG2      THR  65 -15.010  -2.868   2.981
  475    HA   PRO  66           HA       PRO  66 -16.053   0.308   5.943
  476   1HB   PRO  66          2HB       PRO  66 -18.022  -0.003   3.951
  477   2HB   PRO  66          1HB       PRO  66 -16.981   1.401   4.192
  478   1HG   PRO  66          2HG       PRO  66 -16.695  -0.869   2.289
  479   2HG   PRO  66          1HG       PRO  66 -16.246   0.834   2.088
  480   1HD   PRO  66          2HD       PRO  66 -14.394  -1.044   2.528
  481   2HD   PRO  66          1HD       PRO  66 -14.250   0.573   3.253
  482    H    GLN  67           H        GLN  67 -16.449  -2.784   4.335
  483    HA   GLN  67           HA       GLN  67 -18.873  -3.552   5.557
  484   1HB   GLN  67          2HB       GLN  67 -16.610  -5.281   4.539
  485   2HB   GLN  67          1HB       GLN  67 -18.229  -5.848   4.924
  486   1HG   GLN  67          2HG       GLN  67 -19.146  -4.415   3.167
  487   2HG   GLN  67          1HG       GLN  67 -17.518  -3.864   2.776
  488   1HE2  GLN  67          1HE2      GLN  67 -19.884  -5.884   1.831
  489   2HE2  GLN  67          2HE2      GLN  67 -18.952  -7.086   1.014
  490    H    GLY  68           H        GLY  68 -15.744  -3.176   6.833
  491   1HA   GLY  68          2HA       GLY  68 -15.419  -3.225   9.205
  492   2HA   GLY  68          1HA       GLY  68 -16.602  -4.521   9.302
  493    H    GLU  69           H        GLU  69 -13.748  -4.131   7.215
  494    HA   GLU  69           HA       GLU  69 -12.710  -6.646   8.366
  495   1HB   GLU  69          2HB       GLU  69 -12.359  -5.632   5.540
  496   2HB   GLU  69          1HB       GLU  69 -11.702  -7.127   6.186
  497   1HG   GLU  69          2HG       GLU  69 -13.964  -7.971   6.546
  498   2HG   GLU  69          1HG       GLU  69 -14.624  -6.472   5.895
  499    H    LEU  70           H        LEU  70 -10.515  -6.809   8.775
  500    HA   LEU  70           HA       LEU  70  -8.956  -4.329   8.482
  501   1HB   LEU  70          2HB       LEU  70  -9.680  -4.558  10.798
  502   2HB   LEU  70          1HB       LEU  70  -9.019  -6.180  10.864
  503    HG   LEU  70           HG       LEU  70  -6.751  -5.266  10.564
  504   1HD1  LEU  70          1HD1      LEU  70  -6.359  -2.877  10.682
  505   2HD1  LEU  70          2HD1      LEU  70  -8.094  -2.572  10.768
  506   3HD1  LEU  70          3HD1      LEU  70  -7.391  -3.252   9.302
  507   1HD2  LEU  70          1HD2      LEU  70  -7.618  -5.644  12.814
  508   2HD2  LEU  70          2HD2      LEU  70  -8.304  -4.019  12.831
  509   3HD2  LEU  70          3HD2      LEU  70  -6.555  -4.237  12.777
  510    H    VAL  71           H        VAL  71  -7.228  -4.637   7.264
  511    HA   VAL  71           HA       VAL  71  -5.896  -7.267   7.335
  512    HB   VAL  71           HB       VAL  71  -6.110  -5.440   4.936
  513   1HG1  VAL  71          1HG1      VAL  71  -5.182  -7.441   3.741
  514   2HG1  VAL  71          2HG1      VAL  71  -4.842  -8.144   5.322
  515   3HG1  VAL  71          3HG1      VAL  71  -4.058  -6.640   4.837
  516   1HG2  VAL  71          1HG2      VAL  71  -8.254  -6.476   5.447
  517   2HG2  VAL  71          2HG2      VAL  71  -7.488  -8.064   5.498
  518   3HG2  VAL  71          3HG2      VAL  71  -7.560  -7.168   3.981
  519    H    GLU  72           H        GLU  72  -3.580  -7.211   6.848
  520    HA   GLU  72           HA       GLU  72  -2.339  -4.604   7.412
  521   1HB   GLU  72          2HB       GLU  72  -0.700  -5.727   8.865
  522   2HB   GLU  72          1HB       GLU  72  -2.340  -5.890   9.478
  523   1HG   GLU  72          2HG       GLU  72  -2.454  -8.156   8.569
  524   2HG   GLU  72          1HG       GLU  72  -0.807  -7.991   7.962
  525    H    ILE  73           H        ILE  73  -0.293  -4.242   6.522
  526    HA   ILE  73           HA       ILE  73   0.895  -6.306   4.845
  527    HB   ILE  73           HB       ILE  73  -0.015  -3.655   3.714
  528   1HG1  ILE  73          2HG1      ILE  73  -1.806  -5.344   3.912
  529   2HG1  ILE  73          1HG1      ILE  73  -1.419  -4.987   2.233
  530   1HG2  ILE  73          1HG2      ILE  73   0.919  -4.501   1.580
  531   2HG2  ILE  73          2HG2      ILE  73   1.616  -5.860   2.463
  532   3HG2  ILE  73          3HG2      ILE  73   2.146  -4.214   2.813
  533   1HD1  ILE  73          1HD1      ILE  73  -0.240  -7.341   3.674
  534   2HD1  ILE  73          2HD1      ILE  73  -0.321  -7.042   1.938
  535   3HD1  ILE  73          3HD1      ILE  73  -1.791  -7.419   2.840
  536    H    ASP  74           H        ASP  74   2.885  -6.307   5.681
  537    HA   ASP  74           HA       ASP  74   4.107  -3.958   6.758
  538   1HB   ASP  74          2HB       ASP  74   6.062  -5.422   7.136
  539   2HB   ASP  74          1HB       ASP  74   4.569  -6.143   7.734
  540    H    GLY  75           H        GLY  75   4.618  -2.402   5.371
  541   1HA   GLY  75          2HA       GLY  75   5.410  -2.678   2.707
  542   2HA   GLY  75          1HA       GLY  75   5.695  -1.268   3.696
  543    H    ARG  76           H        ARG  76   7.218  -3.390   5.494
  544    HA   ARG  76           HA       ARG  76   9.785  -2.690   4.483
  545   1HB   ARG  76          2HB       ARG  76   9.372  -2.879   6.887
  546   2HB   ARG  76          1HB       ARG  76   9.000  -4.587   6.697
  547   1HG   ARG  76          2HG       ARG  76  11.294  -5.007   5.971
  548   2HG   ARG  76          1HG       ARG  76  11.666  -3.294   6.161
  549   1HD   ARG  76          2HD       ARG  76  11.128  -3.452   8.549
  550   2HD   ARG  76          1HD       ARG  76  10.773  -5.168   8.351
  551    HE   ARG  76           HE       ARG  76  13.003  -5.566   8.520
  552   1HH1  ARG  76          1HH1      ARG  76  12.582  -2.260   7.482
  553   2HH1  ARG  76          2HH1      ARG  76  14.279  -1.920   7.458
  554   1HH2  ARG  76          1HH2      ARG  76  15.236  -5.116   8.498
  555   2HH2  ARG  76          2HH2      ARG  76  15.785  -3.539   8.037
  556    H    ALA  77           H        ALA  77   7.642  -5.289   3.940
  557    HA   ALA  77           HA       ALA  77   9.760  -7.018   2.957
  558   1HB   ALA  77          1HB       ALA  77   8.231  -8.140   4.395
  559   2HB   ALA  77          2HB       ALA  77   7.940  -8.716   2.753
  560   3HB   ALA  77          3HB       ALA  77   6.847  -7.539   3.482
  561    H    LEU  78           H        LEU  78   7.866  -4.600   1.751
  562    HA   LEU  78           HA       LEU  78   7.518  -5.868  -0.869
  563   1HB   LEU  78          2HB       LEU  78   6.430  -3.277   0.237
  564   2HB   LEU  78          1HB       LEU  78   6.193  -3.820  -1.412
  565    HG   LEU  78           HG       LEU  78   4.217  -4.275  -0.079
  566   1HD1  LEU  78          1HD1      LEU  78   3.943  -6.037  -1.393
  567   2HD1  LEU  78          2HD1      LEU  78   4.825  -7.028  -0.231
  568   3HD1  LEU  78          3HD1      LEU  78   5.689  -6.230  -1.545
  569   1HD2  LEU  78          1HD2      LEU  78   5.728  -6.245   1.581
  570   2HD2  LEU  78          2HD2      LEU  78   4.184  -5.454   1.901
  571   3HD2  LEU  78          3HD2      LEU  78   5.687  -4.546   2.049
  572    H    VAL  79           H        VAL  79  10.100  -5.156   0.127
  573    HA   VAL  79           HA       VAL  79  11.191  -2.776  -0.683
  574    HB   VAL  79           HB       VAL  79  12.461  -4.524   0.480
  575   1HG1  VAL  79          1HG1      VAL  79  13.511  -6.192  -1.386
  576   2HG1  VAL  79          2HG1      VAL  79  11.854  -6.031  -1.964
  577   3HG1  VAL  79          3HG1      VAL  79  12.163  -6.599  -0.324
  578   1HG2  VAL  79          1HG2      VAL  79  13.567  -2.682  -0.857
  579   2HG2  VAL  79          2HG2      VAL  79  13.855  -3.889  -2.109
  580   3HG2  VAL  79          3HG2      VAL  79  14.564  -4.093  -0.507
  581    H    ALA  80           H        ALA  80  12.538  -2.280  -2.596
  582    HA   ALA  80           HA       ALA  80  11.146  -2.200  -4.943
  583   1HB   ALA  80          1HB       ALA  80  13.221  -0.909  -4.351
  584   2HB   ALA  80          2HB       ALA  80  13.140  -1.486  -6.017
  585   3HB   ALA  80          3HB       ALA  80  14.151  -2.326  -4.840
  586    H    ARG  81           H        ARG  81  11.680  -3.212  -7.082
  587    HA   ARG  81           HA       ARG  81  11.331  -6.028  -6.936
  588   1HB   ARG  81          2HB       ARG  81  12.335  -4.433  -9.312
  589   2HB   ARG  81          1HB       ARG  81  11.575  -6.016  -9.356
  590   1HG   ARG  81          2HG       ARG  81   9.497  -4.991  -8.505
  591   2HG   ARG  81          1HG       ARG  81  10.273  -3.412  -8.598
  592   1HD   ARG  81          2HD       ARG  81  10.603  -3.704 -10.999
  593   2HD   ARG  81          1HD       ARG  81   9.867  -5.304 -10.917
  594    HE   ARG  81           HE       ARG  81   8.055  -3.418  -9.899
  595   1HH1  ARG  81          1HH1      ARG  81   9.527  -4.356 -12.922
  596   2HH1  ARG  81          2HH1      ARG  81   8.195  -3.812 -13.886
  597   1HH2  ARG  81          1HH2      ARG  81   6.300  -2.701 -11.169
  598   2HH2  ARG  81          2HH2      ARG  81   6.364  -2.873 -12.891
  599    HA   PRO  82           HA       PRO  82  15.459  -7.864  -6.630
  600   1HB   PRO  82          2HB       PRO  82  15.056  -8.707  -9.482
  601   2HB   PRO  82          1HB       PRO  82  15.669  -9.649  -8.117
  602   1HG   PRO  82          2HG       PRO  82  13.152  -9.946  -8.983
  603   2HG   PRO  82          1HG       PRO  82  13.559 -10.045  -7.262
  604   1HD   PRO  82          2HD       PRO  82  12.115  -7.925  -8.734
  605   2HD   PRO  82          1HD       PRO  82  12.059  -8.341  -7.011
  606    H    GLU  83           H        GLU  83  14.401  -6.188  -9.427
  607    HA   GLU  83           HA       GLU  83  16.887  -5.105 -10.358
  608   1HB   GLU  83          2HB       GLU  83  14.018  -4.397 -10.927
  609   2HB   GLU  83          1HB       GLU  83  15.401  -3.767 -11.807
  610   1HG   GLU  83          2HG       GLU  83  14.545  -6.653 -11.695
  611   2HG   GLU  83          1HG       GLU  83  14.277  -5.547 -13.042
  612    H    GLU  84           H        GLU  84  15.971  -4.727  -7.570
  613    HA   GLU  84           HA       GLU  84  14.748  -2.577  -6.736
  614   1HB   GLU  84          2HB       GLU  84  17.434  -3.426  -5.660
  615   2HB   GLU  84          1HB       GLU  84  16.270  -2.425  -4.807
  616   1HG   GLU  84          2HG       GLU  84  14.662  -4.289  -4.871
  617   2HG   GLU  84          1HG       GLU  84  15.887  -5.287  -5.652
  618    H    ARG  85           H        ARG  85  17.510  -2.243  -8.761
  619    HA   ARG  85           HA       ARG  85  18.204   0.402  -7.878
  620   1HB   ARG  85          2HB       ARG  85  18.527  -0.855 -10.625
  621   2HB   ARG  85          1HB       ARG  85  19.315   0.612 -10.068
  622   1HG   ARG  85          2HG       ARG  85  19.762  -2.141  -8.934
  623   2HG   ARG  85          1HG       ARG  85  20.824  -1.313 -10.073
  624   1HD   ARG  85          2HD       ARG  85  21.769  -1.013  -7.921
  625   2HD   ARG  85          1HD       ARG  85  21.037   0.526  -8.370
  626    HE   ARG  85           HE       ARG  85  19.190  -1.002  -6.892
  627   1HH1  ARG  85          1HH1      ARG  85  22.159   0.786  -6.480
  628   2HH1  ARG  85          2HH1      ARG  85  21.846   1.164  -4.820
  629   1HH2  ARG  85          1HH2      ARG  85  18.776  -0.503  -4.709
  630   2HH2  ARG  85          2HH2      ARG  85  19.927   0.433  -3.814
  631    H    ILE  86           H        ILE  86  15.952   0.994  -7.511
  632    HA   ILE  86           HA       ILE  86  13.907   0.955  -9.348
  633    HB   ILE  86           HB       ILE  86  14.305   3.170  -7.324
  634   1HG1  ILE  86          2HG1      ILE  86  12.623   1.400  -6.124
  635   2HG1  ILE  86          1HG1      ILE  86  13.695   0.301  -6.983
  636   1HG2  ILE  86          1HG2      ILE  86  11.884   3.293  -7.323
  637   2HG2  ILE  86          2HG2      ILE  86  11.795   1.971  -8.487
  638   3HG2  ILE  86          3HG2      ILE  86  12.504   3.515  -8.960
  639   1HD1  ILE  86          1HD1      ILE  86  14.222   2.051  -4.677
  640   2HD1  ILE  86          2HD1      ILE  86  15.515   1.916  -5.868
  641   3HD1  ILE  86          3HD1      ILE  86  14.885   0.468  -5.081
  Start of MODEL   13
    1    H    ARG   9           H        ARG   9  -9.180 -15.746  -8.202
    2    HA   ARG   9           HA       ARG   9  -7.399 -13.524  -8.317
    3   1HB   ARG   9          2HB       ARG   9 -10.063 -13.950  -9.679
    4   2HB   ARG   9          1HB       ARG   9  -8.908 -12.688 -10.080
    5   1HG   ARG   9          2HG       ARG   9  -7.273 -14.393 -10.718
    6   2HG   ARG   9          1HG       ARG   9  -8.446 -15.653 -10.330
    7   1HD   ARG   9          2HD       ARG   9  -8.389 -15.211 -12.728
    8   2HD   ARG   9          1HD       ARG   9  -9.954 -14.783 -12.040
    9    HE   ARG   9           HE       ARG   9  -8.339 -12.500 -12.051
   10   1HH1  ARG   9          1HH1      ARG   9  -9.926 -14.632 -14.311
   11   2HH1  ARG   9          2HH1      ARG   9 -10.123 -13.408 -15.519
   12   1HH2  ARG   9          1HH2      ARG   9  -8.598 -10.888 -13.638
   13   2HH2  ARG   9          2HH2      ARG   9  -9.370 -11.283 -15.138
   14    H    HIS  10           H        HIS  10  -7.427 -11.807  -7.041
   15    HA   HIS  10           HA       HIS  10 -10.005 -10.712  -6.177
   16   1HB   HIS  10          2HB       HIS  10  -9.185 -12.081  -4.314
   17   2HB   HIS  10          1HB       HIS  10  -7.653 -11.212  -4.337
   18    HD1  HIS  10           1HD      HIS  10 -11.315 -10.170  -4.080
   19    HD2  HIS  10           2HD      HIS  10  -7.613  -9.377  -2.369
   20    HE1  HIS  10           1HE      HIS  10 -11.751  -8.440  -2.306
   21    HE2  HIS  10           2HE      HIS  10  -9.512  -8.048  -1.220
   22    H    GLU  11           H        GLU  11  -9.853  -8.474  -5.430
   23    HA   GLU  11           HA       GLU  11  -7.458  -7.058  -6.360
   24   1HB   GLU  11          2HB       GLU  11  -8.856  -5.360  -7.460
   25   2HB   GLU  11          1HB       GLU  11  -9.071  -6.948  -8.186
   26   1HG   GLU  11          2HG       GLU  11 -11.151  -7.237  -6.944
   27   2HG   GLU  11          1HG       GLU  11 -10.934  -5.649  -6.210
   28    H    LEU  12           H        LEU  12  -6.903  -5.273  -5.187
   29    HA   LEU  12           HA       LEU  12  -8.438  -4.836  -2.733
   30   1HB   LEU  12          2HB       LEU  12  -5.630  -4.025  -3.488
   31   2HB   LEU  12          1HB       LEU  12  -6.395  -3.642  -1.958
   32    HG   LEU  12           HG       LEU  12  -6.586  -6.065  -1.475
   33   1HD1  LEU  12          1HD1      LEU  12  -6.643  -7.140  -3.536
   34   2HD1  LEU  12          2HD1      LEU  12  -5.034  -7.523  -2.918
   35   3HD1  LEU  12          3HD1      LEU  12  -5.234  -6.266  -4.140
   36   1HD2  LEU  12          1HD2      LEU  12  -4.466  -4.451  -1.120
   37   2HD2  LEU  12          2HD2      LEU  12  -3.717  -5.736  -2.068
   38   3HD2  LEU  12          3HD2      LEU  12  -4.530  -6.118  -0.549
   39    H    ILE  13           H        ILE  13  -9.288  -3.754  -5.307
   40    HA   ILE  13           HA       ILE  13  -8.722  -0.920  -5.205
   41    HB   ILE  13           HB       ILE  13 -10.711  -2.418  -6.918
   42   1HG1  ILE  13          2HG1      ILE  13  -8.415  -3.158  -7.332
   43   2HG1  ILE  13          1HG1      ILE  13  -9.013  -2.213  -8.691
   44   1HG2  ILE  13          1HG2      ILE  13  -9.588   0.360  -7.252
   45   2HG2  ILE  13          2HG2      ILE  13 -11.202  -0.016  -6.649
   46   3HG2  ILE  13          3HG2      ILE  13 -10.759  -0.436  -8.303
   47   1HD1  ILE  13          1HD1      ILE  13  -6.982  -1.471  -6.630
   48   2HD1  ILE  13          2HD1      ILE  13  -7.835  -0.233  -7.554
   49   3HD1  ILE  13          3HD1      ILE  13  -6.854  -1.439  -8.389
   50    H    GLY  14           H        GLY  14 -10.174   0.710  -4.667
   51   1HA   GLY  14          2HA       GLY  14 -12.013   1.690  -3.677
   52   2HA   GLY  14          1HA       GLY  14 -12.867   0.165  -3.866
   53    H    LEU  15           H        LEU  15  -9.863  -0.072  -2.258
   54    HA   LEU  15           HA       LEU  15 -11.271  -0.410   0.298
   55   1HB   LEU  15          2HB       LEU  15  -8.545  -1.407  -0.532
   56   2HB   LEU  15          1HB       LEU  15  -9.349  -1.758   0.984
   57    HG   LEU  15           HG       LEU  15 -10.243  -2.660  -1.754
   58   1HD1  LEU  15          1HD1      LEU  15  -8.234  -3.778  -0.731
   59   2HD1  LEU  15          2HD1      LEU  15  -9.594  -4.838  -1.097
   60   3HD1  LEU  15          3HD1      LEU  15  -9.298  -4.326   0.564
   61   1HD2  LEU  15          1HD2      LEU  15 -11.530  -2.772   0.935
   62   2HD2  LEU  15          2HD2      LEU  15 -11.780  -4.095  -0.203
   63   3HD2  LEU  15          3HD2      LEU  15 -12.249  -2.452  -0.645
   64    H    SER  16           H        SER  16  -9.950   0.157   2.274
   65    HA   SER  16           HA       SER  16  -8.640   2.752   1.803
   66   1HB   SER  16          2HB       SER  16  -9.142   3.233   4.173
   67   2HB   SER  16          1HB       SER  16 -10.604   2.833   3.275
   68    HG   SER  16           HG       SER  16 -10.817   1.035   4.386
   69    H    VAL  17           H        VAL  17  -6.641   3.234   2.788
   70    HA   VAL  17           HA       VAL  17  -5.279   1.088   4.208
   71    HB   VAL  17           HB       VAL  17  -4.753   0.581   1.907
   72   1HG1  VAL  17          1HG1      VAL  17  -5.165   2.613   0.776
   73   2HG1  VAL  17          2HG1      VAL  17  -3.448   2.271   0.557
   74   3HG1  VAL  17          3HG1      VAL  17  -3.962   3.477   1.737
   75   1HG2  VAL  17          1HG2      VAL  17  -2.153   1.633   2.297
   76   2HG2  VAL  17          2HG2      VAL  17  -2.735   0.002   2.625
   77   3HG2  VAL  17          3HG2      VAL  17  -2.809   1.234   3.883
   78    H    ARG  18           H        ARG  18  -3.994   1.830   5.770
   79    HA   ARG  18           HA       ARG  18  -3.299   4.690   5.738
   80   1HB   ARG  18          2HB       ARG  18  -3.357   4.615   8.196
   81   2HB   ARG  18          1HB       ARG  18  -4.911   4.192   7.489
   82   1HG   ARG  18          2HG       ARG  18  -4.430   1.821   7.858
   83   2HG   ARG  18          1HG       ARG  18  -2.878   2.254   8.580
   84   1HD   ARG  18          2HD       ARG  18  -4.047   3.514  10.324
   85   2HD   ARG  18          1HD       ARG  18  -5.594   3.077   9.602
   86    HE   ARG  18           HE       ARG  18  -4.173   0.728  10.145
   87   1HH1  ARG  18          1HH1      ARG  18  -5.732   3.341  11.853
   88   2HH1  ARG  18          2HH1      ARG  18  -6.110   2.377  13.239
   89   1HH2  ARG  18          1HH2      ARG  18  -4.672  -0.544  11.969
   90   2HH2  ARG  18          2HH2      ARG  18  -5.508   0.171  13.306
   91    H    ILE  19           H        ILE  19  -1.211   5.129   5.608
   92    HA   ILE  19           HA       ILE  19   0.750   3.026   5.840
   93    HB   ILE  19           HB       ILE  19   1.176   5.974   5.336
   94   1HG1  ILE  19          2HG1      ILE  19  -0.265   4.985   3.623
   95   2HG1  ILE  19          1HG1      ILE  19   1.328   5.349   2.962
   96   1HG2  ILE  19          1HG2      ILE  19   3.228   4.696   4.122
   97   2HG2  ILE  19          2HG2      ILE  19   2.968   3.649   5.518
   98   3HG2  ILE  19          3HG2      ILE  19   3.303   5.366   5.752
   99   1HD1  ILE  19          1HD1      ILE  19   0.175   2.664   3.669
  100   2HD1  ILE  19          2HD1      ILE  19   1.902   2.909   3.404
  101   3HD1  ILE  19          3HD1      ILE  19   0.756   3.233   2.102
  102    H    ALA  20           H        ALA  20   1.710   2.471   7.680
  103    HA   ALA  20           HA       ALA  20   1.563   4.194   9.995
  104   1HB   ALA  20          1HB       ALA  20   2.122   1.363   9.494
  105   2HB   ALA  20          2HB       ALA  20   1.308   2.135  10.855
  106   3HB   ALA  20          3HB       ALA  20   3.070   2.077  10.800
  107    H    ARG  21           H        ARG  21   3.944   3.067   7.729
  108    HA   ARG  21           HA       ARG  21   5.742   5.169   8.467
  109   1HB   ARG  21          2HB       ARG  21   6.390   3.463  10.084
  110   2HB   ARG  21          1HB       ARG  21   6.576   2.289   8.791
  111   1HG   ARG  21          2HG       ARG  21   8.373   3.714   7.838
  112   2HG   ARG  21          1HG       ARG  21   8.241   4.743   9.266
  113   1HD   ARG  21          2HD       ARG  21   8.851   1.792   9.306
  114   2HD   ARG  21          1HD       ARG  21  10.060   3.069   9.443
  115    HE   ARG  21           HE       ARG  21   8.434   2.057  11.521
  116   1HH1  ARG  21          1HH1      ARG  21   9.806   5.039  10.329
  117   2HH1  ARG  21          2HH1      ARG  21   9.777   5.814  11.876
  118   1HH2  ARG  21          1HH2      ARG  21   8.403   3.075  13.555
  119   2HH2  ARG  21          2HH2      ARG  21   8.984   4.700  13.709
  120    H    SER  22           H        SER  22   7.304   5.583   6.897
  121    HA   SER  22           HA       SER  22   7.265   3.920   4.488
  122   1HB   SER  22          2HB       SER  22   6.787   6.908   4.495
  123   2HB   SER  22          1HB       SER  22   7.009   5.916   3.053
  124    HG   SER  22           HG       SER  22   4.759   6.433   4.016
  125    H    VAL  23           H        VAL  23   9.005   4.544   2.934
  126    HA   VAL  23           HA       VAL  23  11.488   4.685   4.258
  127    HB   VAL  23           HB       VAL  23  11.313   3.560   2.126
  128   1HG1  VAL  23          1HG1      VAL  23   9.729   5.656   1.355
  129   2HG1  VAL  23          2HG1      VAL  23  10.358   4.401   0.287
  130   3HG1  VAL  23          3HG1      VAL  23  11.210   5.936   0.439
  131   1HG2  VAL  23          1HG2      VAL  23  13.253   4.529   0.972
  132   2HG2  VAL  23          2HG2      VAL  23  13.494   4.467   2.718
  133   3HG2  VAL  23          3HG2      VAL  23  13.087   5.996   1.937
  134    H    HIS  24           H        HIS  24   9.517   7.137   2.650
  135    HA   HIS  24           HA       HIS  24  11.566   9.161   3.142
  136   1HB   HIS  24          2HB       HIS  24   8.871   9.417   1.789
  137   2HB   HIS  24          1HB       HIS  24  10.056  10.706   1.939
  138    HD1  HIS  24           1HD      HIS  24   9.664   7.313   0.306
  139    HD2  HIS  24           2HD      HIS  24  11.891  10.798  -0.073
  140    HE1  HIS  24           1HE      HIS  24  10.995   7.030  -1.808
  141    HE2  HIS  24           2HE      HIS  24  12.416   9.106  -1.958
  142    H    ARG  25           H        ARG  25  11.418  10.727   4.662
  143    HA   ARG  25           HA       ARG  25   9.625  10.300   6.849
  144   1HB   ARG  25          2HB       ARG  25  11.565  12.565   6.361
  145   2HB   ARG  25          1HB       ARG  25  10.794  12.179   7.892
  146   1HG   ARG  25          2HG       ARG  25  12.658  10.335   6.416
  147   2HG   ARG  25          1HG       ARG  25  13.143  11.415   7.724
  148   1HD   ARG  25          2HD       ARG  25  11.089   9.215   7.936
  149   2HD   ARG  25          1HD       ARG  25  12.754   9.119   8.509
  150    HE   ARG  25           HE       ARG  25  11.477  11.359   9.650
  151   1HH1  ARG  25          1HH1      ARG  25  11.516   7.874   9.833
  152   2HH1  ARG  25          2HH1      ARG  25  10.992   7.830  11.482
  153   1HH2  ARG  25          1HH2      ARG  25  10.785  11.302  11.820
  154   2HH2  ARG  25          2HH2      ARG  25  10.576   9.775  12.610
  155    H    ASP  26           H        ASP  26   9.126  11.854   3.955
  156    HA   ASP  26           HA       ASP  26   7.477  13.947   5.102
  157   1HB   ASP  26          2HB       ASP  26   7.343  14.843   2.808
  158   2HB   ASP  26          1HB       ASP  26   9.006  14.665   3.361
  159    H    ILE  27           H        ILE  27   7.190  10.885   3.597
  160    HA   ILE  27           HA       ILE  27   4.373  11.337   3.021
  161    HB   ILE  27           HB       ILE  27   4.401   9.282   1.741
  162   1HG1  ILE  27          2HG1      ILE  27   7.275   9.061   2.661
  163   2HG1  ILE  27          1HG1      ILE  27   5.948   7.993   3.095
  164   1HG2  ILE  27          1HG2      ILE  27   6.242  11.496   1.192
  165   2HG2  ILE  27          2HG2      ILE  27   4.974  10.795   0.187
  166   3HG2  ILE  27          3HG2      ILE  27   6.560  10.029   0.265
  167   1HD1  ILE  27          1HD1      ILE  27   7.047   8.343   0.315
  168   2HD1  ILE  27          2HD1      ILE  27   5.777   7.221   0.807
  169   3HD1  ILE  27          3HD1      ILE  27   7.422   7.009   1.407
  170    H    GLN  28           H        GLN  28   6.468   9.713   5.205
  171    HA   GLN  28           HA       GLN  28   5.058   7.547   6.087
  172   1HB   GLN  28          2HB       GLN  28   6.093   7.894   8.287
  173   2HB   GLN  28          1HB       GLN  28   7.243   8.139   6.978
  174   1HG   GLN  28          2HG       GLN  28   7.030  10.539   7.203
  175   2HG   GLN  28          1HG       GLN  28   5.809  10.334   8.454
  176   1HE2  GLN  28          1HE2      GLN  28   7.952   7.901   8.963
  177   2HE2  GLN  28          2HE2      GLN  28   9.002   8.672  10.091
  178    H    GLY  29           H        GLY  29   3.429   7.126   7.553
  179   1HA   GLY  29          2HA       GLY  29   1.550   7.503   8.824
  180   2HA   GLY  29          1HA       GLY  29   2.118   9.146   9.071
  181    H    ILE  30           H        ILE  30   1.792   8.150   5.798
  182    HA   ILE  30           HA       ILE  30  -0.396  10.004   5.467
  183    HB   ILE  30           HB       ILE  30   1.472  10.131   3.901
  184   1HG1  ILE  30          2HG1      ILE  30  -1.088   9.175   2.601
  185   2HG1  ILE  30          1HG1      ILE  30  -0.760  10.819   3.140
  186   1HG2  ILE  30          1HG2      ILE  30   0.772   7.700   2.424
  187   2HG2  ILE  30          2HG2      ILE  30   1.513   7.413   3.997
  188   3HG2  ILE  30          3HG2      ILE  30   2.353   8.391   2.794
  189   1HD1  ILE  30          1HD1      ILE  30  -0.497  10.624   0.733
  190   2HD1  ILE  30          2HD1      ILE  30   0.701   9.347   0.953
  191   3HD1  ILE  30          3HD1      ILE  30   1.051  10.988   1.498
  192    H    SER  31           H        SER  31  -2.339   9.172   5.974
  193    HA   SER  31           HA       SER  31  -3.002   6.448   5.156
  194   1HB   SER  31          2HB       SER  31  -3.575   7.097   7.451
  195   2HB   SER  31          1HB       SER  31  -4.554   8.430   6.840
  196    HG   SER  31           HG       SER  31  -5.028   5.717   6.174
  197    H    GLY  32           H        GLY  32  -4.872   5.974   3.864
  198   1HA   GLY  32          2HA       GLY  32  -6.572   7.898   2.762
  199   2HA   GLY  32          1HA       GLY  32  -5.196   7.740   1.684
  200    H    ARG  33           H        ARG  33  -6.797   7.058   0.141
  201    HA   ARG  33           HA       ARG  33  -7.825   4.363   0.558
  202   1HB   ARG  33          2HB       ARG  33  -8.564   6.521  -1.370
  203   2HB   ARG  33          1HB       ARG  33  -9.104   4.862  -1.582
  204   1HG   ARG  33          2HG       ARG  33 -10.786   6.225  -0.463
  205   2HG   ARG  33          1HG       ARG  33 -10.214   4.898   0.547
  206   1HD   ARG  33          2HD       ARG  33  -8.855   6.371   1.843
  207   2HD   ARG  33          1HD       ARG  33  -9.147   7.710   0.736
  208    HE   ARG  33           HE       ARG  33 -11.040   8.160   1.908
  209   1HH1  ARG  33          1HH1      ARG  33 -10.221   4.810   2.450
  210   2HH1  ARG  33          2HH1      ARG  33 -11.549   4.533   3.527
  211   1HH2  ARG  33          1HH2      ARG  33 -12.781   7.794   3.326
  212   2HH2  ARG  33          2HH2      ARG  33 -13.000   6.226   4.026
  213    H    VAL  34           H        VAL  34  -7.903   3.032  -1.534
  214    HA   VAL  34           HA       VAL  34  -5.111   2.800  -2.406
  215    HB   VAL  34           HB       VAL  34  -7.290   0.724  -2.543
  216   1HG1  VAL  34          1HG1      VAL  34  -4.359   0.683  -3.172
  217   2HG1  VAL  34          2HG1      VAL  34  -5.713   0.095  -4.139
  218   3HG1  VAL  34          3HG1      VAL  34  -5.214  -0.786  -2.696
  219   1HG2  VAL  34          1HG2      VAL  34  -5.006   0.834  -0.591
  220   2HG2  VAL  34          2HG2      VAL  34  -6.425  -0.215  -0.558
  221   3HG2  VAL  34          3HG2      VAL  34  -6.595   1.511  -0.237
  222    H    VAL  35           H        VAL  35  -4.516   2.147  -4.547
  223    HA   VAL  35           HA       VAL  35  -6.547   2.552  -6.616
  224    HB   VAL  35           HB       VAL  35  -3.970   3.429  -7.568
  225   1HG1  VAL  35          1HG1      VAL  35  -6.793   4.214  -7.805
  226   2HG1  VAL  35          2HG1      VAL  35  -5.579   3.924  -9.048
  227   3HG1  VAL  35          3HG1      VAL  35  -5.584   5.447  -8.159
  228   1HG2  VAL  35          1HG2      VAL  35  -5.049   5.659  -6.070
  229   2HG2  VAL  35          2HG2      VAL  35  -3.396   5.130  -6.258
  230   3HG2  VAL  35          3HG2      VAL  35  -4.425   4.378  -5.050
  231    H    ASP  36           H        ASP  36  -3.190   1.633  -5.955
  232    HA   ASP  36           HA       ASP  36  -3.532  -0.908  -7.236
  233   1HB   ASP  36          2HB       ASP  36  -1.659   1.120  -8.469
  234   2HB   ASP  36          1HB       ASP  36  -1.716  -0.586  -8.895
  235    H    GLU  37           H        GLU  37  -1.453  -2.177  -7.225
  236    HA   GLU  37           HA       GLU  37   0.347  -1.327  -5.056
  237   1HB   GLU  37          2HB       GLU  37  -0.809  -4.098  -5.447
  238   2HB   GLU  37          1HB       GLU  37   0.441  -3.685  -4.283
  239   1HG   GLU  37          2HG       GLU  37  -1.667  -3.830  -3.159
  240   2HG   GLU  37          1HG       GLU  37  -1.142  -2.148  -3.180
  241    H    THR  38           H        THR  38   2.395  -1.209  -5.819
  242    HA   THR  38           HA       THR  38   3.153  -3.082  -7.963
  243    HB   THR  38           HB       THR  38   4.004  -0.209  -7.621
  244    HG1  THR  38           1HG      THR  38   1.909  -0.519  -8.509
  245   1HG2  THR  38          1HG2      THR  38   4.893  -2.301  -9.566
  246   2HG2  THR  38          2HG2      THR  38   5.874  -1.212  -8.584
  247   3HG2  THR  38          3HG2      THR  38   4.955  -0.581  -9.952
  248    H    ARG  39           H        ARG  39   5.417  -3.595  -8.104
  249    HA   ARG  39           HA       ARG  39   6.548  -4.646  -5.871
  250   1HB   ARG  39          2HB       ARG  39   7.299  -5.105  -8.163
  251   2HB   ARG  39          1HB       ARG  39   8.019  -3.507  -8.254
  252   1HG   ARG  39          2HG       ARG  39   8.870  -5.544  -6.219
  253   2HG   ARG  39          1HG       ARG  39   9.580  -5.451  -7.828
  254   1HD   ARG  39          2HD       ARG  39  10.070  -3.011  -7.303
  255   2HD   ARG  39          1HD       ARG  39   9.657  -3.394  -5.635
  256    HE   ARG  39           HE       ARG  39  11.723  -4.299  -5.417
  257   1HH1  ARG  39          1HH1      ARG  39  10.867  -4.397  -8.800
  258   2HH1  ARG  39          2HH1      ARG  39  12.374  -5.090  -9.289
  259   1HH2  ARG  39          1HH2      ARG  39  13.712  -5.198  -6.062
  260   2HH2  ARG  39          2HH2      ARG  39  13.992  -5.544  -7.737
  261    H    ASN  40           H        ASN  40   7.376  -1.446  -7.230
  262    HA   ASN  40           HA       ASN  40   8.495  -0.776  -4.591
  263   1HB   ASN  40          2HB       ASN  40  10.079   0.722  -5.714
  264   2HB   ASN  40          1HB       ASN  40  10.268  -0.945  -6.233
  265   1HD2  ASN  40          1HD2      ASN  40   7.506   0.252  -7.696
  266   2HD2  ASN  40          2HD2      ASN  40   8.204   0.748  -9.187
  267    H    THR  41           H        THR  41   5.713  -0.308  -5.651
  268    HA   THR  41           HA       THR  41   5.560   2.406  -4.721
  269    HB   THR  41           HB       THR  41   4.193   3.117  -6.773
  270    HG1  THR  41           1HG      THR  41   5.756   1.109  -8.006
  271   1HG2  THR  41          1HG2      THR  41   7.120   2.753  -7.302
  272   2HG2  THR  41          2HG2      THR  41   6.477   3.954  -6.181
  273   3HG2  THR  41          3HG2      THR  41   6.048   4.025  -7.891
  274    H    LEU  42           H        LEU  42   3.453   3.104  -4.252
  275    HA   LEU  42           HA       LEU  42   1.367   1.042  -4.377
  276   1HB   LEU  42          2HB       LEU  42   2.535   0.908  -2.203
  277   2HB   LEU  42          1HB       LEU  42   2.114   2.574  -1.885
  278    HG   LEU  42           HG       LEU  42   0.685   0.973  -0.673
  279   1HD1  LEU  42          1HD1      LEU  42  -0.085   3.272  -1.615
  280   2HD1  LEU  42          2HD1      LEU  42  -1.285   2.155  -0.965
  281   3HD1  LEU  42          3HD1      LEU  42  -1.067   2.297  -2.709
  282   1HD2  LEU  42          1HD2      LEU  42  -1.004  -0.307  -1.974
  283   2HD2  LEU  42          2HD2      LEU  42   0.650  -0.863  -2.229
  284   3HD2  LEU  42          3HD2      LEU  42  -0.144   0.129  -3.450
  285    H    ARG  43           H        ARG  43  -0.103   2.013  -5.604
  286    HA   ARG  43           HA       ARG  43  -0.543   4.843  -5.530
  287   1HB   ARG  43          2HB       ARG  43  -1.837   2.560  -6.997
  288   2HB   ARG  43          1HB       ARG  43  -2.499   4.176  -7.057
  289   1HG   ARG  43          2HG       ARG  43  -1.128   3.742  -8.978
  290   2HG   ARG  43          1HG       ARG  43  -0.449   5.030  -7.986
  291   1HD   ARG  43          2HD       ARG  43   1.146   3.467  -7.010
  292   2HD   ARG  43          1HD       ARG  43   0.443   2.143  -7.939
  293    HE   ARG  43           HE       ARG  43   2.386   3.987  -8.839
  294   1HH1  ARG  43          1HH1      ARG  43  -0.429   2.230  -9.922
  295   2HH1  ARG  43          2HH1      ARG  43   0.038   2.264 -11.589
  296   1HH2  ARG  43          1HH2      ARG  43   3.003   4.026 -11.028
  297   2HH2  ARG  43          2HH2      ARG  43   1.988   3.281 -12.217
  298    H    ILE  44           H        ILE  44  -1.929   5.943  -4.342
  299    HA   ILE  44           HA       ILE  44  -3.898   4.492  -2.695
  300    HB   ILE  44           HB       ILE  44  -2.403   7.074  -2.184
  301   1HG1  ILE  44          2HG1      ILE  44  -2.371   4.414  -0.753
  302   2HG1  ILE  44          1HG1      ILE  44  -1.098   5.055  -1.788
  303   1HG2  ILE  44          1HG2      ILE  44  -4.893   6.879  -1.350
  304   2HG2  ILE  44          2HG2      ILE  44  -3.632   7.601  -0.358
  305   3HG2  ILE  44          3HG2      ILE  44  -4.133   5.938  -0.066
  306   1HD1  ILE  44          1HD1      ILE  44  -1.930   5.956   0.940
  307   2HD1  ILE  44          2HD1      ILE  44  -0.999   7.001  -0.133
  308   3HD1  ILE  44          3HD1      ILE  44  -0.340   5.445   0.372
  309    H    GLU  45           H        GLU  45  -5.846   4.654  -3.765
  310    HA   GLU  45           HA       GLU  45  -6.694   7.367  -4.477
  311   1HB   GLU  45          2HB       GLU  45  -6.302   6.241  -6.559
  312   2HB   GLU  45          1HB       GLU  45  -7.207   4.828  -6.028
  313   1HG   GLU  45          2HG       GLU  45  -9.254   6.198  -5.980
  314   2HG   GLU  45          1HG       GLU  45  -8.324   7.574  -6.570
  315    H    MET  46           H        MET  46  -8.705   7.950  -4.112
  316    HA   MET  46           HA       MET  46 -10.424   6.161  -2.526
  317   1HB   MET  46          2HB       MET  46 -11.270   8.250  -1.432
  318   2HB   MET  46          1HB       MET  46  -9.592   7.892  -1.080
  319   1HG   MET  46          2HG       MET  46  -9.348   9.499  -3.251
  320   2HG   MET  46          1HG       MET  46 -10.777  10.166  -2.466
  321   1HE   MET  46          1HE       MET  46  -6.804   9.570  -2.054
  322   2HE   MET  46          2HE       MET  46  -7.672   8.347  -1.121
  323   3HE   MET  46          3HE       MET  46  -6.755   9.602  -0.289
  324    H    ASP  47           H        ASP  47 -12.552   6.070  -3.004
  325    HA   ASP  47           HA       ASP  47 -13.492   6.260  -5.519
  326   1HB   ASP  47          2HB       ASP  47 -15.111   6.708  -3.010
  327   2HB   ASP  47          1HB       ASP  47 -15.777   6.281  -4.583
  328    H    ASP  48           H        ASP  48 -13.174   8.924  -3.325
  329    HA   ASP  48           HA       ASP  48 -14.923  10.750  -4.529
  330   1HB   ASP  48          2HB       ASP  48 -13.830  11.159  -2.361
  331   2HB   ASP  48          1HB       ASP  48 -12.273  11.297  -3.168
  332    H    GLY  49           H        GLY  49 -12.042   9.348  -5.675
  333   1HA   GLY  49          2HA       GLY  49 -11.408   9.493  -7.956
  334   2HA   GLY  49          1HA       GLY  49 -12.080  11.118  -8.011
  335    H    ARG  50           H        ARG  50 -10.233  10.334  -5.250
  336    HA   ARG  50           HA       ARG  50  -8.033  12.009  -6.281
  337   1HB   ARG  50          2HB       ARG  50  -8.859  11.443  -3.441
  338   2HB   ARG  50          1HB       ARG  50  -7.475  12.418  -3.901
  339   1HG   ARG  50          2HG       ARG  50 -10.325  13.053  -4.637
  340   2HG   ARG  50          1HG       ARG  50  -9.476  13.727  -3.247
  341   1HD   ARG  50          2HD       ARG  50  -9.314  15.348  -4.952
  342   2HD   ARG  50          1HD       ARG  50  -7.737  14.567  -4.878
  343    HE   ARG  50           HE       ARG  50  -9.333  13.276  -6.800
  344   1HH1  ARG  50          1HH1      ARG  50  -7.651  16.287  -6.282
  345   2HH1  ARG  50          2HH1      ARG  50  -7.395  16.577  -7.969
  346   1HH2  ARG  50          1HH2      ARG  50  -8.996  13.653  -9.020
  347   2HH2  ARG  50          2HH2      ARG  50  -8.158  15.083  -9.525
  348    H    GLU  51           H        GLU  51  -6.286  10.948  -6.910
  349    HA   GLU  51           HA       GLU  51  -5.567   8.483  -5.473
  350   1HB   GLU  51          2HB       GLU  51  -4.549   7.684  -7.527
  351   2HB   GLU  51          1HB       GLU  51  -6.224   8.128  -7.821
  352   1HG   GLU  51          2HG       GLU  51  -5.502  10.243  -8.795
  353   2HG   GLU  51          1HG       GLU  51  -3.820   9.807  -8.498
  354    H    ILE  52           H        ILE  52  -3.363   8.102  -5.017
  355    HA   ILE  52           HA       ILE  52  -1.359  10.071  -5.674
  356    HB   ILE  52           HB       ILE  52  -2.450  11.161  -3.775
  357   1HG1  ILE  52          2HG1      ILE  52  -0.453  11.465  -2.359
  358   2HG1  ILE  52          1HG1      ILE  52   0.272  10.030  -3.084
  359   1HG2  ILE  52          1HG2      ILE  52  -3.182   8.936  -2.763
  360   2HG2  ILE  52          2HG2      ILE  52  -2.678  10.210  -1.651
  361   3HG2  ILE  52          3HG2      ILE  52  -1.579   8.884  -2.030
  362   1HD1  ILE  52          1HD1      ILE  52   1.187  12.067  -4.067
  363   2HD1  ILE  52          2HD1      ILE  52  -0.435  12.581  -4.538
  364   3HD1  ILE  52          3HD1      ILE  52   0.283  11.145  -5.269
  365    H    THR  53           H        THR  53   0.474   8.988  -6.013
  366    HA   THR  53           HA       THR  53   0.750   6.246  -5.297
  367    HB   THR  53           HB       THR  53   1.698   7.094  -7.365
  368    HG1  THR  53           1HG      THR  53   3.434   5.872  -7.241
  369   1HG2  THR  53          1HG2      THR  53   4.065   8.353  -6.364
  370   2HG2  THR  53          2HG2      THR  53   2.630   9.229  -5.826
  371   3HG2  THR  53          3HG2      THR  53   2.894   8.940  -7.546
  372    H    VAL  54           H        VAL  54   2.397   5.270  -4.028
  373    HA   VAL  54           HA       VAL  54   3.898   6.909  -2.165
  374    HB   VAL  54           HB       VAL  54   1.873   4.909  -1.145
  375   1HG1  VAL  54          1HG1      VAL  54   3.786   6.693   0.365
  376   2HG1  VAL  54          2HG1      VAL  54   3.943   4.948   0.172
  377   3HG1  VAL  54          3HG1      VAL  54   2.587   5.616   1.081
  378   1HG2  VAL  54          1HG2      VAL  54   0.627   6.809  -1.693
  379   2HG2  VAL  54          2HG2      VAL  54   1.918   7.910  -1.210
  380   3HG2  VAL  54          3HG2      VAL  54   1.001   7.036   0.016
  381    HA   PRO  55           HA       PRO  55   6.692   3.552  -3.269
  382   1HB   PRO  55          2HB       PRO  55   8.242   4.756  -1.029
  383   2HB   PRO  55          1HB       PRO  55   8.755   4.373  -2.677
  384   1HG   PRO  55          2HG       PRO  55   8.300   6.888  -1.966
  385   2HG   PRO  55          1HG       PRO  55   7.793   6.297  -3.561
  386   1HD   PRO  55          2HD       PRO  55   6.149   6.784  -1.108
  387   2HD   PRO  55          1HD       PRO  55   5.761   7.113  -2.809
  388    H    LYS  56           H        LYS  56   6.467   1.519  -2.613
  389    HA   LYS  56           HA       LYS  56   5.896   0.956   0.203
  390   1HB   LYS  56          2HB       LYS  56   5.110  -0.257  -2.337
  391   2HB   LYS  56          1HB       LYS  56   5.599  -1.432  -1.123
  392   1HG   LYS  56          2HG       LYS  56   3.982  -0.523   0.436
  393   2HG   LYS  56          1HG       LYS  56   3.512   0.698  -0.745
  394   1HD   LYS  56          2HD       LYS  56   1.922  -1.153  -0.734
  395   2HD   LYS  56          1HD       LYS  56   2.777  -1.076  -2.275
  396   1HE   LYS  56          2HE       LYS  56   4.284  -2.854  -1.518
  397   2HE   LYS  56          1HE       LYS  56   3.418  -2.934   0.015
  398   1HZ   LYS  56          1HZ       LYS  56   2.506  -3.754  -2.666
  399   2HZ   LYS  56          2HZ       LYS  56   1.382  -3.371  -1.463
  400   3HZ   LYS  56          3HZ       LYS  56   2.482  -4.631  -1.218
  401    H    GLY  57           H        GLY  57   8.583   1.023  -1.735
  402   1HA   GLY  57          2HA       GLY  57   9.906  -1.364  -1.411
  403   2HA   GLY  57          1HA       GLY  57  10.712   0.197  -1.386
  404    H    ILE  58           H        ILE  58   9.243   1.042   1.017
  405    HA   ILE  58           HA       ILE  58   9.955  -0.788   3.097
  406    HB   ILE  58           HB       ILE  58  11.342   1.895   3.061
  407   1HG1  ILE  58          2HG1      ILE  58  13.448   0.388   2.983
  408   2HG1  ILE  58          1HG1      ILE  58  12.363  -0.854   2.364
  409   1HG2  ILE  58          1HG2      ILE  58  12.326   1.308   5.099
  410   2HG2  ILE  58          2HG2      ILE  58  11.888  -0.391   4.926
  411   3HG2  ILE  58          3HG2      ILE  58  10.643   0.810   5.262
  412   1HD1  ILE  58          1HD1      ILE  58  13.590   1.356   1.005
  413   2HD1  ILE  58          2HD1      ILE  58  11.836   1.412   0.830
  414   3HD1  ILE  58          3HD1      ILE  58  12.725  -0.032   0.345
  415    H    ALA  59           H        ALA  59   7.507  -0.268   2.832
  416    HA   ALA  59           HA       ALA  59   6.915   1.830   4.778
  417   1HB   ALA  59          1HB       ALA  59   5.006   1.640   2.538
  418   2HB   ALA  59          2HB       ALA  59   6.569   2.389   2.202
  419   3HB   ALA  59          3HB       ALA  59   5.532   3.043   3.471
  420    H    VAL  60           H        VAL  60   5.947   0.874   6.443
  421    HA   VAL  60           HA       VAL  60   4.314  -1.492   6.098
  422    HB   VAL  60           HB       VAL  60   5.745  -1.303   8.084
  423   1HG1  VAL  60          1HG1      VAL  60   4.041   0.607   9.493
  424   2HG1  VAL  60          2HG1      VAL  60   4.949   1.315   8.157
  425   3HG1  VAL  60          3HG1      VAL  60   5.798   0.469   9.451
  426   1HG2  VAL  60          1HG2      VAL  60   3.646  -2.630   8.134
  427   2HG2  VAL  60          2HG2      VAL  60   2.822  -1.238   8.836
  428   3HG2  VAL  60          3HG2      VAL  60   4.131  -2.027   9.718
  429    H    PHE  61           H        PHE  61   2.104  -1.609   6.198
  430    HA   PHE  61           HA       PHE  61   0.557   0.687   7.027
  431   1HB   PHE  61          2HB       PHE  61  -0.608   0.967   4.891
  432   2HB   PHE  61          1HB       PHE  61   1.118   1.274   4.713
  433    HD1  PHE  61           1HD      PHE  61   2.272   0.256   3.002
  434    HD2  PHE  61           2HD      PHE  61  -1.390  -1.456   4.328
  435    HE1  PHE  61           1HE      PHE  61   2.378  -1.382   1.173
  436    HE2  PHE  61           2HE      PHE  61  -1.289  -3.099   2.500
  437    HZ   PHE  61           HZ       PHE  61   0.598  -3.064   0.919
  438    H    HIS  62           H        HIS  62  -1.813   0.281   6.744
  439    HA   HIS  62           HA       HIS  62  -2.516  -2.567   6.768
  440   1HB   HIS  62          2HB       HIS  62  -3.522  -0.619   8.850
  441   2HB   HIS  62          1HB       HIS  62  -3.767  -2.362   8.807
  442    HD1  HIS  62           1HD      HIS  62  -1.098  -3.555   8.661
  443    HD2  HIS  62           2HD      HIS  62  -1.770  -0.067  10.811
  444    HE1  HIS  62           1HE      HIS  62   0.779  -3.422  10.327
  445    HE2  HIS  62           2HE      HIS  62   0.299  -1.350  11.678
  446    H    PHE  63           H        PHE  63  -4.311  -2.931   5.539
  447    HA   PHE  63           HA       PHE  63  -5.939  -0.567   4.881
  448   1HB   PHE  63          2HB       PHE  63  -6.406  -1.546   2.713
  449   2HB   PHE  63          1HB       PHE  63  -4.671  -1.439   2.963
  450    HD1  PHE  63           1HD      PHE  63  -7.479  -3.862   3.390
  451    HD2  PHE  63           2HD      PHE  63  -3.380  -3.248   2.420
  452    HE1  PHE  63           1HE      PHE  63  -7.264  -6.242   2.811
  453    HE2  PHE  63           2HE      PHE  63  -3.157  -5.626   1.840
  454    HZ   PHE  63           HZ       PHE  63  -5.100  -7.128   2.034
  455    H    ARG  64           H        ARG  64  -8.082  -0.605   5.036
  456    HA   ARG  64           HA       ARG  64  -9.281  -2.950   6.329
  457   1HB   ARG  64          2HB       ARG  64  -9.471  -0.853   7.559
  458   2HB   ARG  64          1HB       ARG  64 -10.192  -0.067   6.164
  459   1HG   ARG  64          2HG       ARG  64 -12.004  -0.512   7.535
  460   2HG   ARG  64          1HG       ARG  64 -12.039  -1.838   6.375
  461   1HD   ARG  64          2HD       ARG  64 -12.418  -2.727   8.571
  462   2HD   ARG  64          1HD       ARG  64 -10.823  -3.240   8.023
  463    HE   ARG  64           HE       ARG  64 -10.441  -0.908   9.455
  464   1HH1  ARG  64          1HH1      ARG  64 -11.697  -4.104  10.083
  465   2HH1  ARG  64          2HH1      ARG  64 -11.210  -4.107  11.743
  466   1HH2  ARG  64          1HH2      ARG  64  -9.797  -0.911  11.641
  467   2HH2  ARG  64          2HH2      ARG  64 -10.131  -2.294  12.628
  468    H    THR  65           H        THR  65 -11.256  -3.794   5.615
  469    HA   THR  65           HA       THR  65 -11.993  -3.082   2.856
  470    HB   THR  65           HB       THR  65 -12.153  -5.779   4.218
  471    HG1  THR  65           1HG      THR  65 -10.201  -5.940   3.506
  472   1HG2  THR  65          1HG2      THR  65 -13.773  -4.949   2.188
  473   2HG2  THR  65          2HG2      THR  65 -13.323  -6.621   2.523
  474   3HG2  THR  65          3HG2      THR  65 -12.429  -5.691   1.320
  475    HA   PRO  66           HA       PRO  66 -15.943  -1.703   4.322
  476   1HB   PRO  66          2HB       PRO  66 -17.372  -2.801   2.137
  477   2HB   PRO  66          1HB       PRO  66 -16.777  -1.148   2.300
  478   1HG   PRO  66          2HG       PRO  66 -15.585  -3.457   0.863
  479   2HG   PRO  66          1HG       PRO  66 -15.495  -1.727   0.488
  480   1HD   PRO  66          2HD       PRO  66 -13.404  -3.038   1.520
  481   2HD   PRO  66          1HD       PRO  66 -13.768  -1.366   2.001
  482    H    GLN  67           H        GLN  67 -15.473  -5.022   3.230
  483    HA   GLN  67           HA       GLN  67 -17.865  -6.104   4.220
  484   1HB   GLN  67          2HB       GLN  67 -15.148  -7.323   3.757
  485   2HB   GLN  67          1HB       GLN  67 -16.516  -8.268   4.324
  486   1HG   GLN  67          2HG       GLN  67 -16.259  -8.526   1.945
  487   2HG   GLN  67          1HG       GLN  67 -17.757  -7.670   2.297
  488   1HE2  GLN  67          1HE2      GLN  67 -15.037  -7.717   0.413
  489   2HE2  GLN  67          2HE2      GLN  67 -15.069  -6.089  -0.163
  490    H    GLY  68           H        GLY  68 -15.134  -4.877   5.852
  491   1HA   GLY  68          2HA       GLY  68 -15.231  -4.439   8.199
  492   2HA   GLY  68          1HA       GLY  68 -16.214  -5.883   8.392
  493    H    GLU  69           H        GLU  69 -13.223  -5.596   6.539
  494    HA   GLU  69           HA       GLU  69 -11.928  -7.362   8.519
  495   1HB   GLU  69          2HB       GLU  69 -11.699  -7.539   5.511
  496   2HB   GLU  69          1HB       GLU  69 -10.794  -8.515   6.660
  497   1HG   GLU  69          2HG       GLU  69 -12.875  -9.492   7.476
  498   2HG   GLU  69          1HG       GLU  69 -13.786  -8.509   6.330
  499    H    LEU  70           H        LEU  70  -9.759  -7.052   8.914
  500    HA   LEU  70           HA       LEU  70  -8.523  -4.716   7.608
  501   1HB   LEU  70          2HB       LEU  70  -9.213  -4.148   9.879
  502   2HB   LEU  70          1HB       LEU  70  -8.334  -5.525  10.511
  503    HG   LEU  70           HG       LEU  70  -6.215  -4.507   9.777
  504   1HD1  LEU  70          1HD1      LEU  70  -7.932  -2.149   9.002
  505   2HD1  LEU  70          2HD1      LEU  70  -7.099  -3.226   7.881
  506   3HD1  LEU  70          3HD1      LEU  70  -6.170  -2.208   8.980
  507   1HD2  LEU  70          1HD2      LEU  70  -7.954  -2.739  11.497
  508   2HD2  LEU  70          2HD2      LEU  70  -6.194  -2.657  11.408
  509   3HD2  LEU  70          3HD2      LEU  70  -6.979  -4.104  12.042
  510    H    VAL  71           H        VAL  71  -6.664  -5.141   6.629
  511    HA   VAL  71           HA       VAL  71  -5.175  -7.551   7.458
  512    HB   VAL  71           HB       VAL  71  -5.217  -6.312   4.709
  513   1HG1  VAL  71          1HG1      VAL  71  -3.793  -8.635   5.919
  514   2HG1  VAL  71          2HG1      VAL  71  -3.197  -7.406   4.804
  515   3HG1  VAL  71          3HG1      VAL  71  -4.254  -8.690   4.219
  516   1HG2  VAL  71          1HG2      VAL  71  -6.401  -8.979   5.303
  517   2HG2  VAL  71          2HG2      VAL  71  -6.791  -7.833   4.021
  518   3HG2  VAL  71          3HG2      VAL  71  -7.337  -7.531   5.670
  519    H    GLU  72           H        GLU  72  -2.867  -7.478   7.267
  520    HA   GLU  72           HA       GLU  72  -1.762  -4.752   7.304
  521   1HB   GLU  72          2HB       GLU  72  -0.301  -5.316   9.114
  522   2HB   GLU  72          1HB       GLU  72  -1.932  -5.755   9.589
  523   1HG   GLU  72          2HG       GLU  72   0.124  -7.688   8.540
  524   2HG   GLU  72          1HG       GLU  72  -0.209  -7.401  10.245
  525    H    ILE  73           H        ILE  73   0.169  -4.416   6.315
  526    HA   ILE  73           HA       ILE  73   1.688  -6.679   5.283
  527    HB   ILE  73           HB       ILE  73   0.627  -4.513   3.458
  528   1HG1  ILE  73          2HG1      ILE  73  -0.002  -7.471   3.598
  529   2HG1  ILE  73          1HG1      ILE  73  -1.093  -6.160   4.037
  530   1HG2  ILE  73          1HG2      ILE  73   2.378  -6.896   2.861
  531   2HG2  ILE  73          2HG2      ILE  73   2.885  -5.207   2.863
  532   3HG2  ILE  73          3HG2      ILE  73   1.719  -5.776   1.668
  533   1HD1  ILE  73          1HD1      ILE  73  -0.007  -6.704   1.281
  534   2HD1  ILE  73          2HD1      ILE  73  -1.096  -5.386   1.718
  535   3HD1  ILE  73          3HD1      ILE  73  -1.639  -7.059   1.848
  536    H    ASP  74           H        ASP  74   3.701  -6.267   5.925
  537    HA   ASP  74           HA       ASP  74   4.551  -3.568   6.471
  538   1HB   ASP  74          2HB       ASP  74   6.019  -6.195   6.707
  539   2HB   ASP  74          1HB       ASP  74   6.654  -4.643   7.241
  540    H    GLY  75           H        GLY  75   4.867  -2.408   4.679
  541   1HA   GLY  75          2HA       GLY  75   5.972  -3.312   2.259
  542   2HA   GLY  75          1HA       GLY  75   5.839  -1.636   2.757
  543    H    ARG  76           H        ARG  76   7.507  -2.711   5.227
  544    HA   ARG  76           HA       ARG  76  10.042  -2.088   3.971
  545   1HB   ARG  76          2HB       ARG  76  10.848  -1.661   6.252
  546   2HB   ARG  76          1HB       ARG  76   9.426  -0.704   5.863
  547   1HG   ARG  76          2HG       ARG  76   8.027  -2.276   7.101
  548   2HG   ARG  76          1HG       ARG  76   9.455  -3.236   7.490
  549   1HD   ARG  76          2HD       ARG  76   8.966  -0.370   8.298
  550   2HD   ARG  76          1HD       ARG  76   8.829  -1.778   9.350
  551    HE   ARG  76           HE       ARG  76  11.202  -0.389   8.696
  552   1HH1  ARG  76          1HH1      ARG  76   9.985  -3.609   9.282
  553   2HH1  ARG  76          2HH1      ARG  76  11.527  -4.240   9.752
  554   1HH2  ARG  76          1HH2      ARG  76  13.228  -1.217   9.321
  555   2HH2  ARG  76          2HH2      ARG  76  13.367  -2.883   9.778
  556    H    ALA  77           H        ALA  77   8.506  -4.555   5.884
  557    HA   ALA  77           HA       ALA  77  10.926  -6.156   5.867
  558   1HB   ALA  77          1HB       ALA  77  10.170  -6.323   7.989
  559   2HB   ALA  77          2HB       ALA  77   9.270  -7.670   7.292
  560   3HB   ALA  77          3HB       ALA  77   8.483  -6.108   7.519
  561    H    LEU  78           H        LEU  78   8.248  -5.813   3.906
  562    HA   LEU  78           HA       LEU  78   8.531  -8.594   2.979
  563   1HB   LEU  78          2HB       LEU  78   6.029  -6.953   3.248
  564   2HB   LEU  78          1HB       LEU  78   6.114  -8.339   2.178
  565    HG   LEU  78           HG       LEU  78   5.085  -8.912   4.329
  566   1HD1  LEU  78          1HD1      LEU  78   6.460 -10.865   4.845
  567   2HD1  LEU  78          2HD1      LEU  78   7.790 -10.176   3.916
  568   3HD1  LEU  78          3HD1      LEU  78   6.293 -10.634   3.106
  569   1HD2  LEU  78          1HD2      LEU  78   6.921  -7.225   5.440
  570   2HD2  LEU  78          2HD2      LEU  78   7.579  -8.807   5.854
  571   3HD2  LEU  78          3HD2      LEU  78   5.935  -8.383   6.331
  572    H    VAL  79           H        VAL  79  10.115  -6.571   1.959
  573    HA   VAL  79           HA       VAL  79   8.965  -5.511  -0.437
  574    HB   VAL  79           HB       VAL  79  10.774  -4.309   0.685
  575   1HG1  VAL  79          1HG1      VAL  79  12.897  -6.120  -0.230
  576   2HG1  VAL  79          2HG1      VAL  79  11.914  -6.730   1.103
  577   3HG1  VAL  79          3HG1      VAL  79  12.758  -5.190   1.263
  578   1HG2  VAL  79          1HG2      VAL  79  11.998  -5.186  -1.889
  579   2HG2  VAL  79          2HG2      VAL  79  11.807  -3.562  -1.227
  580   3HG2  VAL  79          3HG2      VAL  79  10.416  -4.405  -1.911
  581    H    ALA  80           H        ALA  80   8.305  -7.043  -1.861
  582    HA   ALA  80           HA       ALA  80  10.095  -9.272  -2.480
  583   1HB   ALA  80          1HB       ALA  80   8.064 -10.244  -2.247
  584   2HB   ALA  80          2HB       ALA  80   7.935  -9.820  -3.953
  585   3HB   ALA  80          3HB       ALA  80   7.189  -8.793  -2.729
  586    H    ARG  81           H        ARG  81  10.693  -9.801  -4.605
  587    HA   ARG  81           HA       ARG  81  10.579  -7.547  -6.502
  588   1HB   ARG  81          2HB       ARG  81  12.764  -9.620  -6.211
  589   2HB   ARG  81          1HB       ARG  81  12.741  -8.313  -7.382
  590   1HG   ARG  81          2HG       ARG  81  14.186  -7.591  -5.698
  591   2HG   ARG  81          1HG       ARG  81  12.676  -6.737  -5.388
  592   1HD   ARG  81          2HD       ARG  81  12.108  -8.271  -3.624
  593   2HD   ARG  81          1HD       ARG  81  13.492  -9.292  -4.008
  594    HE   ARG  81           HE       ARG  81  14.397  -6.703  -3.410
  595   1HH1  ARG  81          1HH1      ARG  81  12.953  -9.462  -1.837
  596   2HH1  ARG  81          2HH1      ARG  81  13.667  -9.116  -0.297
  597   1HH2  ARG  81          1HH2      ARG  81  15.338  -6.246  -1.388
  598   2HH2  ARG  81          2HH2      ARG  81  15.021  -7.289  -0.042
  599    HA   PRO  82           HA       PRO  82   8.567  -9.969  -9.579
  600   1HB   PRO  82          2HB       PRO  82  10.371  -9.655 -11.707
  601   2HB   PRO  82          1HB       PRO  82   9.002  -8.604 -11.334
  602   1HG   PRO  82          2HG       PRO  82  11.887  -8.269 -10.668
  603   2HG   PRO  82          1HG       PRO  82  10.681  -7.043 -11.096
  604   1HD   PRO  82          2HD       PRO  82  11.488  -7.365  -8.568
  605   2HD   PRO  82          1HD       PRO  82   9.792  -6.992  -8.950
  606    H    GLU  83           H        GLU  83   8.543 -12.059 -10.245
  607    HA   GLU  83           HA       GLU  83  10.410 -13.875  -9.252
  608   1HB   GLU  83          2HB       GLU  83   8.103 -14.489  -9.784
  609   2HB   GLU  83          1HB       GLU  83   8.423 -14.249 -11.496
  610   1HG   GLU  83          2HG       GLU  83  10.039 -16.079 -11.452
  611   2HG   GLU  83          1HG       GLU  83   9.721 -16.316  -9.736
  612    H    GLU  84           H        GLU  84  10.469 -12.012 -12.133
  613    HA   GLU  84           HA       GLU  84  12.379 -13.739 -13.470
  614   1HB   GLU  84          2HB       GLU  84  10.698 -12.565 -14.805
  615   2HB   GLU  84          1HB       GLU  84  11.302 -11.017 -14.229
  616   1HG   GLU  84          2HG       GLU  84  13.444 -11.446 -15.324
  617   2HG   GLU  84          1HG       GLU  84  12.836 -12.996 -15.902
  618    H    ARG  85           H        ARG  85  12.327 -10.672 -11.741
  619    HA   ARG  85           HA       ARG  85  15.271 -10.716 -11.731
  620   1HB   ARG  85          2HB       ARG  85  14.466  -8.932 -13.217
  621   2HB   ARG  85          1HB       ARG  85  13.504  -8.268 -11.905
  622   1HG   ARG  85          2HG       ARG  85  15.532  -7.782 -10.647
  623   2HG   ARG  85          1HG       ARG  85  16.507  -8.472 -11.945
  624   1HD   ARG  85          2HD       ARG  85  16.463  -6.044 -12.099
  625   2HD   ARG  85          1HD       ARG  85  15.652  -6.771 -13.485
  626    HE   ARG  85           HE       ARG  85  13.732  -6.225 -11.527
  627   1HH1  ARG  85          1HH1      ARG  85  15.881  -4.512 -13.677
  628   2HH1  ARG  85          2HH1      ARG  85  14.853  -3.123 -13.802
  629   1HH2  ARG  85          1HH2      ARG  85  12.377  -4.400 -11.689
  630   2HH2  ARG  85          2HH2      ARG  85  12.864  -3.060 -12.673
  631    H    ILE  86           H        ILE  86  15.841 -11.263  -9.728
  632    HA   ILE  86           HA       ILE  86  14.418  -9.996  -7.477
  633    HB   ILE  86           HB       ILE  86  15.808 -12.680  -7.470
  634   1HG1  ILE  86          2HG1      ILE  86  12.858 -12.007  -7.425
  635   2HG1  ILE  86          1HG1      ILE  86  13.727 -12.708  -8.784
  636   1HG2  ILE  86          1HG2      ILE  86  15.637 -12.696  -5.251
  637   2HG2  ILE  86          2HG2      ILE  86  13.961 -12.150  -5.304
  638   3HG2  ILE  86          3HG2      ILE  86  15.273 -10.975  -5.349
  639   1HD1  ILE  86          1HD1      ILE  86  14.298 -14.450  -6.753
  640   2HD1  ILE  86          2HD1      ILE  86  13.047 -14.664  -7.976
  641   3HD1  ILE  86          3HD1      ILE  86  12.636 -13.973  -6.407
  Start of MODEL   14
    1    H    ARG   9           H        ARG   9  -6.295  -8.321 -13.033
    2    HA   ARG   9           HA       ARG   9  -8.950  -7.063 -13.203
    3   1HB   ARG   9          2HB       ARG   9  -8.926  -9.503 -13.525
    4   2HB   ARG   9          1HB       ARG   9  -8.154  -9.702 -11.958
    5   1HG   ARG   9          2HG       ARG   9 -10.503 -10.190 -11.783
    6   2HG   ARG   9          1HG       ARG   9 -10.134  -8.720 -10.881
    7   1HD   ARG   9          2HD       ARG   9 -10.944  -7.370 -12.757
    8   2HD   ARG   9          1HD       ARG   9 -11.315  -8.841 -13.656
    9    HE   ARG   9           HE       ARG   9 -12.935  -7.614 -11.689
   10   1HH1  ARG   9          1HH1      ARG   9 -11.964 -10.751 -12.872
   11   2HH1  ARG   9          2HH1      ARG   9 -13.385 -11.549 -12.288
   12   1HH2  ARG   9          1HH2      ARG   9 -14.805  -8.661 -10.926
   13   2HH2  ARG   9          2HH2      ARG   9 -14.999 -10.363 -11.185
   14    H    HIS  10           H        HIS  10 -10.027  -6.463 -11.267
   15    HA   HIS  10           HA       HIS  10  -8.194  -5.555  -9.193
   16   1HB   HIS  10          2HB       HIS  10 -11.140  -4.984  -9.591
   17   2HB   HIS  10          1HB       HIS  10 -10.096  -4.209  -8.403
   18    HD1  HIS  10           1HD      HIS  10 -11.277  -2.183 -10.042
   19    HD2  HIS  10           2HD      HIS  10  -7.995  -4.315 -11.442
   20    HE1  HIS  10           1HE      HIS  10 -10.270  -0.756 -11.852
   21    HE2  HIS  10           2HE      HIS  10  -8.241  -2.031 -12.630
   22    H    GLU  11           H        GLU  11  -9.166  -5.611  -6.881
   23    HA   GLU  11           HA       GLU  11 -10.919  -7.695  -6.150
   24   1HB   GLU  11          2HB       GLU  11  -9.094  -9.137  -6.913
   25   2HB   GLU  11          1HB       GLU  11  -7.978  -8.317  -5.830
   26   1HG   GLU  11          2HG       GLU  11  -9.255  -9.113  -3.907
   27   2HG   GLU  11          1HG       GLU  11 -10.375  -9.933  -4.993
   28    H    LEU  12           H        LEU  12  -8.183  -5.669  -5.212
   29    HA   LEU  12           HA       LEU  12  -9.439  -5.361  -2.566
   30   1HB   LEU  12          2HB       LEU  12  -7.286  -4.965  -1.586
   31   2HB   LEU  12          1HB       LEU  12  -7.242  -6.480  -2.462
   32    HG   LEU  12           HG       LEU  12  -6.138  -3.883  -3.533
   33   1HD1  LEU  12          1HD1      LEU  12  -4.897  -4.567  -1.557
   34   2HD1  LEU  12          2HD1      LEU  12  -3.935  -4.822  -3.012
   35   3HD1  LEU  12          3HD1      LEU  12  -4.711  -6.192  -2.218
   36   1HD2  LEU  12          1HD2      LEU  12  -6.447  -6.608  -4.598
   37   2HD2  LEU  12          2HD2      LEU  12  -4.860  -5.879  -4.832
   38   3HD2  LEU  12          3HD2      LEU  12  -6.301  -5.066  -5.443
   39    H    ILE  13           H        ILE  13  -9.764  -3.846  -5.159
   40    HA   ILE  13           HA       ILE  13  -8.711  -1.221  -4.456
   41    HB   ILE  13           HB       ILE  13 -10.373  -2.060  -6.838
   42   1HG1  ILE  13          2HG1      ILE  13  -7.399  -1.559  -6.565
   43   2HG1  ILE  13          1HG1      ILE  13  -8.166  -3.123  -6.821
   44   1HG2  ILE  13          1HG2      ILE  13 -10.727   0.244  -6.556
   45   2HG2  ILE  13          2HG2      ILE  13  -9.448   0.129  -7.764
   46   3HG2  ILE  13          3HG2      ILE  13  -9.050   0.532  -6.094
   47   1HD1  ILE  13          1HD1      ILE  13  -7.394  -1.118  -8.734
   48   2HD1  ILE  13          2HD1      ILE  13  -9.099  -1.535  -8.898
   49   3HD1  ILE  13          3HD1      ILE  13  -7.871  -2.797  -8.989
   50    H    GLY  14           H        GLY  14 -10.111   0.650  -4.322
   51   1HA   GLY  14          2HA       GLY  14 -12.236   1.671  -4.031
   52   2HA   GLY  14          1HA       GLY  14 -12.926   0.085  -3.729
   53    H    LEU  15           H        LEU  15 -10.667  -0.548  -1.865
   54    HA   LEU  15           HA       LEU  15 -11.898   0.584   0.494
   55   1HB   LEU  15          2HB       LEU  15 -10.338  -0.925   1.715
   56   2HB   LEU  15          1HB       LEU  15 -11.407  -1.743   0.593
   57    HG   LEU  15           HG       LEU  15  -9.541  -1.886  -1.037
   58   1HD1  LEU  15          1HD1      LEU  15  -8.107  -0.439   1.143
   59   2HD1  LEU  15          2HD1      LEU  15  -8.062  -0.178  -0.601
   60   3HD1  LEU  15          3HD1      LEU  15  -7.227  -1.560   0.106
   61   1HD2  LEU  15          1HD2      LEU  15  -8.139  -3.480   0.422
   62   2HD2  LEU  15          2HD2      LEU  15  -9.847  -3.841   0.175
   63   3HD2  LEU  15          3HD2      LEU  15  -9.311  -3.106   1.685
   64    H    SER  16           H        SER  16 -10.468   1.349   2.306
   65    HA   SER  16           HA       SER  16  -8.638   3.357   1.239
   66   1HB   SER  16          2HB       SER  16 -10.385   4.122   2.776
   67   2HB   SER  16          1HB       SER  16  -9.795   3.019   4.019
   68    HG   SER  16           HG       SER  16  -8.228   5.077   2.853
   69    H    VAL  17           H        VAL  17  -6.591   3.779   2.295
   70    HA   VAL  17           HA       VAL  17  -5.387   1.362   3.479
   71    HB   VAL  17           HB       VAL  17  -3.997   3.330   1.658
   72   1HG1  VAL  17          1HG1      VAL  17  -2.288   1.433   1.609
   73   2HG1  VAL  17          2HG1      VAL  17  -3.118   0.812   3.036
   74   3HG1  VAL  17          3HG1      VAL  17  -2.373   2.411   3.075
   75   1HG2  VAL  17          1HG2      VAL  17  -3.938   1.270   0.123
   76   2HG2  VAL  17          2HG2      VAL  17  -5.446   2.181   0.232
   77   3HG2  VAL  17          3HG2      VAL  17  -5.265   0.666   1.117
   78    H    ARG  18           H        ARG  18  -3.520   1.770   4.877
   79    HA   ARG  18           HA       ARG  18  -3.281   4.488   5.918
   80   1HB   ARG  18          2HB       ARG  18  -5.085   3.253   7.200
   81   2HB   ARG  18          1HB       ARG  18  -3.830   2.158   7.761
   82   1HG   ARG  18          2HG       ARG  18  -3.802   5.131   8.231
   83   2HG   ARG  18          1HG       ARG  18  -4.448   3.953   9.370
   84   1HD   ARG  18          2HD       ARG  18  -2.197   2.852   9.374
   85   2HD   ARG  18          1HD       ARG  18  -1.603   4.199   8.407
   86    HE   ARG  18           HE       ARG  18  -1.439   5.399  10.323
   87   1HH1  ARG  18          1HH1      ARG  18  -3.817   2.895  10.833
   88   2HH1  ARG  18          2HH1      ARG  18  -4.120   3.347  12.477
   89   1HH2  ARG  18          1HH2      ARG  18  -1.831   5.987  12.486
   90   2HH2  ARG  18          2HH2      ARG  18  -2.993   5.100  13.416
   91    H    ILE  19           H        ILE  19  -1.189   4.931   5.994
   92    HA   ILE  19           HA       ILE  19   0.774   2.793   6.065
   93    HB   ILE  19           HB       ILE  19   1.190   5.782   5.884
   94   1HG1  ILE  19          2HG1      ILE  19  -0.056   4.926   3.963
   95   2HG1  ILE  19          1HG1      ILE  19   1.581   5.374   3.488
   96   1HG2  ILE  19          1HG2      ILE  19   3.444   5.264   5.190
   97   2HG2  ILE  19          2HG2      ILE  19   3.114   3.536   5.296
   98   3HG2  ILE  19          3HG2      ILE  19   3.128   4.520   6.758
   99   1HD1  ILE  19          1HD1      ILE  19   2.245   3.015   3.558
  100   2HD1  ILE  19          2HD1      ILE  19   0.906   3.278   2.439
  101   3HD1  ILE  19          3HD1      ILE  19   0.606   2.568   4.027
  102    H    ALA  20           H        ALA  20   2.108   2.315   7.747
  103    HA   ALA  20           HA       ALA  20   1.714   3.856  10.222
  104   1HB   ALA  20          1HB       ALA  20   1.877   0.956   9.697
  105   2HB   ALA  20          2HB       ALA  20   0.928   1.842  10.890
  106   3HB   ALA  20          3HB       ALA  20   2.642   1.542  11.174
  107    H    ARG  21           H        ARG  21   4.042   2.422   8.085
  108    HA   ARG  21           HA       ARG  21   6.126   4.069   9.164
  109   1HB   ARG  21          2HB       ARG  21   6.423   1.064   9.268
  110   2HB   ARG  21          1HB       ARG  21   7.690   2.227   9.620
  111   1HG   ARG  21          2HG       ARG  21   6.378   3.066  11.518
  112   2HG   ARG  21          1HG       ARG  21   5.134   1.863  11.173
  113   1HD   ARG  21          2HD       ARG  21   6.763   0.071  11.537
  114   2HD   ARG  21          1HD       ARG  21   8.006   1.272  11.888
  115    HE   ARG  21           HE       ARG  21   6.069   0.277  13.688
  116   1HH1  ARG  21          1HH1      ARG  21   7.758   3.210  12.830
  117   2HH1  ARG  21          2HH1      ARG  21   7.567   3.922  14.396
  118   1HH2  ARG  21          1HH2      ARG  21   5.825   1.212  15.748
  119   2HH2  ARG  21          2HH2      ARG  21   6.474   2.789  16.053
  120    H    SER  22           H        SER  22   7.503   4.673   7.588
  121    HA   SER  22           HA       SER  22   7.752   2.987   5.205
  122   1HB   SER  22          2HB       SER  22   7.080   5.938   5.143
  123   2HB   SER  22          1HB       SER  22   7.465   4.952   3.733
  124    HG   SER  22           HG       SER  22   5.241   5.064   3.949
  125    H    VAL  23           H        VAL  23   9.541   3.704   3.770
  126    HA   VAL  23           HA       VAL  23  11.931   3.975   5.216
  127    HB   VAL  23           HB       VAL  23  11.924   2.878   3.070
  128   1HG1  VAL  23          1HG1      VAL  23  10.738   5.429   2.161
  129   2HG1  VAL  23          2HG1      VAL  23  10.415   3.778   1.638
  130   3HG1  VAL  23          3HG1      VAL  23  11.844   4.628   1.048
  131   1HG2  VAL  23          1HG2      VAL  23  13.828   4.046   1.972
  132   2HG2  VAL  23          2HG2      VAL  23  14.035   3.833   3.711
  133   3HG2  VAL  23          3HG2      VAL  23  13.569   5.406   3.065
  134    H    HIS  24           H        HIS  24   9.855   6.339   3.684
  135    HA   HIS  24           HA       HIS  24  11.672   8.460   4.621
  136   1HB   HIS  24          2HB       HIS  24   9.980   8.333   2.135
  137   2HB   HIS  24          1HB       HIS  24  10.512   9.870   2.804
  138    HD1  HIS  24           1HD      HIS  24  12.333   6.595   2.094
  139    HD2  HIS  24           2HD      HIS  24  12.668  10.677   1.412
  140    HE1  HIS  24           1HE      HIS  24  14.485   6.888   0.829
  141    HE2  HIS  24           2HE      HIS  24  14.614   9.355   0.337
  142    H    ARG  25           H        ARG  25  10.844  10.048   5.860
  143    HA   ARG  25           HA       ARG  25   8.398   9.605   7.193
  144   1HB   ARG  25          2HB       ARG  25  10.115  12.091   7.131
  145   2HB   ARG  25          1HB       ARG  25   8.849  11.748   8.304
  146   1HG   ARG  25          2HG       ARG  25  10.100   9.828   9.120
  147   2HG   ARG  25          1HG       ARG  25  11.357  10.126   7.918
  148   1HD   ARG  25          2HD       ARG  25  11.793  12.317   8.934
  149   2HD   ARG  25          1HD       ARG  25  10.552  11.995  10.145
  150    HE   ARG  25           HE       ARG  25  12.400   9.900  10.210
  151   1HH1  ARG  25          1HH1      ARG  25  12.260  13.314  10.917
  152   2HH1  ARG  25          2HH1      ARG  25  13.486  13.239  12.138
  153   1HH2  ARG  25          1HH2      ARG  25  14.013   9.799  11.815
  154   2HH2  ARG  25          2HH2      ARG  25  14.481  11.244  12.648
  155    H    ASP  26           H        ASP  26   9.072  11.146   4.225
  156    HA   ASP  26           HA       ASP  26   7.044  13.108   4.239
  157   1HB   ASP  26          2HB       ASP  26   7.327  13.164   1.801
  158   2HB   ASP  26          1HB       ASP  26   8.881  13.174   2.629
  159    H    ILE  27           H        ILE  27   6.849   9.724   4.100
  160    HA   ILE  27           HA       ILE  27   4.036   9.927   3.390
  161    HB   ILE  27           HB       ILE  27   4.073   7.867   2.110
  162   1HG1  ILE  27          2HG1      ILE  27   6.145   6.967   3.327
  163   2HG1  ILE  27          1HG1      ILE  27   6.001   6.611   1.611
  164   1HG2  ILE  27          1HG2      ILE  27   6.004   8.948   0.408
  165   2HG2  ILE  27          2HG2      ILE  27   5.348  10.314   1.308
  166   3HG2  ILE  27          3HG2      ILE  27   4.268   9.258   0.399
  167   1HD1  ILE  27          1HD1      ILE  27   7.691   8.818   2.771
  168   2HD1  ILE  27          2HD1      ILE  27   7.610   8.326   1.084
  169   3HD1  ILE  27          3HD1      ILE  27   8.283   7.230   2.289
  170    H    GLN  28           H        GLN  28   5.931   9.375   5.823
  171    HA   GLN  28           HA       GLN  28   4.950   6.812   6.697
  172   1HB   GLN  28          2HB       GLN  28   7.254   7.423   7.209
  173   2HB   GLN  28          1HB       GLN  28   6.700   8.844   8.084
  174   1HG   GLN  28          2HG       GLN  28   5.600   7.411   9.724
  175   2HG   GLN  28          1HG       GLN  28   6.149   5.986   8.844
  176   1HE2  GLN  28          1HE2      GLN  28   7.829   5.049   9.734
  177   2HE2  GLN  28          2HE2      GLN  28   9.105   5.833  10.596
  178    H    GLY  29           H        GLY  29   3.118   6.526   7.781
  179   1HA   GLY  29          2HA       GLY  29   1.487   6.898   9.392
  180   2HA   GLY  29          1HA       GLY  29   2.250   8.435   9.769
  181    H    ILE  30           H        ILE  30   1.637   8.006   6.447
  182    HA   ILE  30           HA       ILE  30  -0.575   9.882   6.629
  183    HB   ILE  30           HB       ILE  30   1.181   9.145   4.290
  184   1HG1  ILE  30          2HG1      ILE  30   1.915  11.503   4.456
  185   2HG1  ILE  30          1HG1      ILE  30   0.896  11.708   5.877
  186   1HG2  ILE  30          1HG2      ILE  30  -1.012   9.585   3.429
  187   2HG2  ILE  30          2HG2      ILE  30   0.006  10.986   3.097
  188   3HG2  ILE  30          3HG2      ILE  30  -1.160  11.038   4.418
  189   1HD1  ILE  30          1HD1      ILE  30   2.352  10.637   7.236
  190   2HD1  ILE  30          2HD1      ILE  30   3.509  11.143   6.005
  191   3HD1  ILE  30          3HD1      ILE  30   2.857   9.505   5.982
  192    H    SER  31           H        SER  31  -2.590   9.210   6.340
  193    HA   SER  31           HA       SER  31  -3.064   6.550   5.237
  194   1HB   SER  31          2HB       SER  31  -4.161   7.105   7.358
  195   2HB   SER  31          1HB       SER  31  -4.951   8.489   6.603
  196    HG   SER  31           HG       SER  31  -6.467   7.127   6.125
  197    H    GLY  32           H        GLY  32  -4.472   6.160   3.491
  198   1HA   GLY  32          2HA       GLY  32  -5.615   8.395   2.054
  199   2HA   GLY  32          1HA       GLY  32  -4.250   7.645   1.248
  200    H    ARG  33           H        ARG  33  -5.801   7.234  -0.448
  201    HA   ARG  33           HA       ARG  33  -7.469   4.894   0.115
  202   1HB   ARG  33          2HB       ARG  33  -8.605   7.067  -0.596
  203   2HB   ARG  33          1HB       ARG  33  -7.975   6.729  -2.196
  204   1HG   ARG  33          2HG       ARG  33  -9.471   5.083  -2.572
  205   2HG   ARG  33          1HG       ARG  33  -9.370   4.488  -0.915
  206   1HD   ARG  33          2HD       ARG  33 -10.849   6.970  -1.774
  207   2HD   ARG  33          1HD       ARG  33 -11.596   5.400  -1.489
  208    HE   ARG  33           HE       ARG  33 -10.155   6.122   0.796
  209   1HH1  ARG  33          1HH1      ARG  33 -12.972   7.154  -0.988
  210   2HH1  ARG  33          2HH1      ARG  33 -13.772   7.800   0.406
  211   1HH2  ARG  33          1HH2      ARG  33 -11.205   6.972   2.629
  212   2HH2  ARG  33          2HH2      ARG  33 -12.768   7.697   2.459
  213    H    VAL  34           H        VAL  34  -7.833   3.570  -2.035
  214    HA   VAL  34           HA       VAL  34  -5.113   2.905  -2.890
  215    HB   VAL  34           HB       VAL  34  -6.378   1.176  -1.705
  216   1HG1  VAL  34          1HG1      VAL  34  -8.150   0.994  -4.127
  217   2HG1  VAL  34          2HG1      VAL  34  -8.605   1.865  -2.663
  218   3HG1  VAL  34          3HG1      VAL  34  -8.302   0.130  -2.597
  219   1HG2  VAL  34          1HG2      VAL  34  -5.826   0.454  -4.581
  220   2HG2  VAL  34          2HG2      VAL  34  -5.866  -0.655  -3.209
  221   3HG2  VAL  34          3HG2      VAL  34  -4.609   0.578  -3.310
  222    H    VAL  35           H        VAL  35  -4.587   2.221  -4.992
  223    HA   VAL  35           HA       VAL  35  -6.549   2.725  -7.084
  224    HB   VAL  35           HB       VAL  35  -5.154   4.806  -6.913
  225   1HG1  VAL  35          1HG1      VAL  35  -3.052   3.400  -6.488
  226   2HG1  VAL  35          2HG1      VAL  35  -2.946   4.906  -7.383
  227   3HG1  VAL  35          3HG1      VAL  35  -2.951   3.365  -8.241
  228   1HG2  VAL  35          1HG2      VAL  35  -5.496   5.163  -9.104
  229   2HG2  VAL  35          2HG2      VAL  35  -6.178   3.537  -9.084
  230   3HG2  VAL  35          3HG2      VAL  35  -4.504   3.786  -9.575
  231    H    ASP  36           H        ASP  36  -3.242   1.585  -6.355
  232    HA   ASP  36           HA       ASP  36  -3.760  -0.886  -7.703
  233   1HB   ASP  36          2HB       ASP  36  -3.186   0.543  -9.619
  234   2HB   ASP  36          1HB       ASP  36  -1.675   0.992  -8.834
  235    H    GLU  37           H        GLU  37  -1.812  -2.348  -7.603
  236    HA   GLU  37           HA       GLU  37  -0.059  -1.643  -5.345
  237   1HB   GLU  37          2HB       GLU  37  -1.779  -3.223  -4.588
  238   2HB   GLU  37          1HB       GLU  37  -1.341  -4.332  -5.881
  239   1HG   GLU  37          2HG       GLU  37   0.877  -4.606  -4.906
  240   2HG   GLU  37          1HG       GLU  37   0.449  -3.485  -3.614
  241    H    THR  38           H        THR  38   2.072  -1.883  -5.752
  242    HA   THR  38           HA       THR  38   2.828  -3.465  -8.121
  243    HB   THR  38           HB       THR  38   4.240  -1.021  -7.043
  244    HG1  THR  38           1HG      THR  38   2.505  -1.291  -9.270
  245   1HG2  THR  38          1HG2      THR  38   4.726  -2.810  -9.362
  246   2HG2  THR  38          2HG2      THR  38   5.872  -2.041  -8.268
  247   3HG2  THR  38          3HG2      THR  38   5.072  -1.089  -9.517
  248    H    ARG  39           H        ARG  39   4.733  -4.680  -8.032
  249    HA   ARG  39           HA       ARG  39   5.263  -6.042  -5.699
  250   1HB   ARG  39          2HB       ARG  39   7.139  -7.026  -6.785
  251   2HB   ARG  39          1HB       ARG  39   5.892  -6.774  -7.996
  252   1HG   ARG  39          2HG       ARG  39   8.190  -4.889  -7.569
  253   2HG   ARG  39          1HG       ARG  39   8.226  -6.230  -8.712
  254   1HD   ARG  39          2HD       ARG  39   6.315  -3.902  -8.737
  255   2HD   ARG  39          1HD       ARG  39   7.652  -4.168  -9.849
  256    HE   ARG  39           HE       ARG  39   5.939  -6.390  -9.930
  257   1HH1  ARG  39          1HH1      ARG  39   6.019  -3.031 -10.870
  258   2HH1  ARG  39          2HH1      ARG  39   4.914  -3.243 -12.186
  259   1HH2  ARG  39          1HH2      ARG  39   4.485  -6.672 -11.660
  260   2HH2  ARG  39          2HH2      ARG  39   4.042  -5.311 -12.634
  261    H    ASN  40           H        ASN  40   6.464  -2.929  -6.609
  262    HA   ASN  40           HA       ASN  40   8.052  -2.924  -4.147
  263   1HB   ASN  40          2HB       ASN  40   9.905  -1.750  -5.234
  264   2HB   ASN  40          1HB       ASN  40   9.644  -3.337  -5.936
  265   1HD2  ASN  40          1HD2      ASN  40   7.207  -1.342  -7.055
  266   2HD2  ASN  40          2HD2      ASN  40   7.934  -0.854  -8.535
  267    H    THR  41           H        THR  41   5.462  -1.618  -5.362
  268    HA   THR  41           HA       THR  41   5.858   0.848  -3.940
  269    HB   THR  41           HB       THR  41   5.018   2.217  -5.939
  270    HG1  THR  41           1HG      THR  41   4.999   1.311  -7.823
  271   1HG2  THR  41          1HG2      THR  41   7.332   2.289  -4.987
  272   2HG2  THR  41          2HG2      THR  41   7.182   2.741  -6.684
  273   3HG2  THR  41          3HG2      THR  41   7.800   1.148  -6.248
  274    H    LEU  42           H        LEU  42   3.993   1.961  -3.446
  275    HA   LEU  42           HA       LEU  42   1.522   0.413  -3.832
  276   1HB   LEU  42          2HB       LEU  42   2.472   2.226  -1.648
  277   2HB   LEU  42          1HB       LEU  42   0.754   1.998  -1.900
  278    HG   LEU  42           HG       LEU  42   2.764  -0.143  -1.205
  279   1HD1  LEU  42          1HD1      LEU  42   0.946   1.561   0.338
  280   2HD1  LEU  42          2HD1      LEU  42   2.364   0.653   0.860
  281   3HD1  LEU  42          3HD1      LEU  42   0.807  -0.160   0.698
  282   1HD2  LEU  42          1HD2      LEU  42   0.749  -1.606  -1.022
  283   2HD2  LEU  42          2HD2      LEU  42   1.128  -1.112  -2.672
  284   3HD2  LEU  42          3HD2      LEU  42  -0.187  -0.328  -1.798
  285    H    ARG  43           H        ARG  43  -0.079   1.261  -5.012
  286    HA   ARG  43           HA       ARG  43   0.185   4.075  -5.795
  287   1HB   ARG  43          2HB       ARG  43  -0.021   1.871  -7.368
  288   2HB   ARG  43          1HB       ARG  43  -1.711   2.309  -7.230
  289   1HG   ARG  43          2HG       ARG  43  -1.181   4.563  -8.065
  290   2HG   ARG  43          1HG       ARG  43   0.510   4.091  -8.210
  291   1HD   ARG  43          2HD       ARG  43  -0.100   2.360  -9.821
  292   2HD   ARG  43          1HD       ARG  43  -1.799   2.802  -9.667
  293    HE   ARG  43           HE       ARG  43  -0.354   5.083 -10.402
  294   1HH1  ARG  43          1HH1      ARG  43  -1.282   1.992 -11.729
  295   2HH1  ARG  43          2HH1      ARG  43  -1.289   2.554 -13.366
  296   1HH2  ARG  43          1HH2      ARG  43  -0.363   5.826 -12.555
  297   2HH2  ARG  43          2HH2      ARG  43  -0.768   4.732 -13.836
  298    H    ILE  44           H        ILE  44  -1.309   5.499  -5.112
  299    HA   ILE  44           HA       ILE  44  -3.602   4.456  -3.580
  300    HB   ILE  44           HB       ILE  44  -1.961   6.962  -3.252
  301   1HG1  ILE  44          2HG1      ILE  44  -2.425   4.583  -1.448
  302   2HG1  ILE  44          1HG1      ILE  44  -0.959   4.923  -2.362
  303   1HG2  ILE  44          1HG2      ILE  44  -3.514   7.984  -2.048
  304   2HG2  ILE  44          2HG2      ILE  44  -3.859   6.530  -1.123
  305   3HG2  ILE  44          3HG2      ILE  44  -4.665   6.805  -2.665
  306   1HD1  ILE  44          1HD1      ILE  44  -0.267   5.805  -0.425
  307   2HD1  ILE  44          2HD1      ILE  44  -1.908   6.041   0.176
  308   3HD1  ILE  44          3HD1      ILE  44  -1.202   7.206  -0.946
  309    H    GLU  45           H        GLU  45  -5.614   4.863  -4.312
  310    HA   GLU  45           HA       GLU  45  -6.070   7.403  -5.678
  311   1HB   GLU  45          2HB       GLU  45  -6.163   5.955  -7.540
  312   2HB   GLU  45          1HB       GLU  45  -7.058   4.724  -6.658
  313   1HG   GLU  45          2HG       GLU  45  -8.997   6.231  -6.585
  314   2HG   GLU  45          1HG       GLU  45  -8.082   7.430  -7.499
  315    H    MET  46           H        MET  46  -7.884   8.398  -5.213
  316    HA   MET  46           HA       MET  46  -9.549   7.323  -3.044
  317   1HB   MET  46          2HB       MET  46  -8.793  10.147  -3.794
  318   2HB   MET  46          1HB       MET  46 -10.061   9.779  -2.640
  319   1HG   MET  46          2HG       MET  46  -7.963  10.371  -1.557
  320   2HG   MET  46          1HG       MET  46  -8.467   8.736  -1.162
  321   1HE   MET  46          1HE       MET  46  -5.877   9.892  -4.473
  322   2HE   MET  46          2HE       MET  46  -4.866  10.389  -3.118
  323   3HE   MET  46          3HE       MET  46  -6.511  11.006  -3.265
  324    H    ASP  47           H        ASP  47 -11.652   6.989  -3.452
  325    HA   ASP  47           HA       ASP  47 -12.823   6.972  -5.903
  326   1HB   ASP  47          2HB       ASP  47 -13.817   5.932  -3.917
  327   2HB   ASP  47          1HB       ASP  47 -14.221   7.523  -3.280
  328    H    ASP  48           H        ASP  48 -12.342   9.733  -3.880
  329    HA   ASP  48           HA       ASP  48 -14.241  11.474  -4.997
  330   1HB   ASP  48          2HB       ASP  48 -11.551  12.125  -3.775
  331   2HB   ASP  48          1HB       ASP  48 -12.843  13.285  -4.072
  332    H    GLY  49           H        GLY  49 -11.499  10.092  -6.404
  333   1HA   GLY  49          2HA       GLY  49 -11.082  10.343  -8.736
  334   2HA   GLY  49          1HA       GLY  49 -11.674  11.992  -8.633
  335    H    ARG  50           H        ARG  50  -9.534  10.855  -6.183
  336    HA   ARG  50           HA       ARG  50  -7.413  12.574  -7.287
  337   1HB   ARG  50          2HB       ARG  50  -7.848  11.609  -4.457
  338   2HB   ARG  50          1HB       ARG  50  -6.518  12.628  -4.979
  339   1HG   ARG  50          2HG       ARG  50  -9.423  13.394  -5.175
  340   2HG   ARG  50          1HG       ARG  50  -8.357  13.843  -3.842
  341   1HD   ARG  50          2HD       ARG  50  -8.395  15.700  -5.301
  342   2HD   ARG  50          1HD       ARG  50  -6.849  14.899  -5.572
  343    HE   ARG  50           HE       ARG  50  -8.749  13.925  -7.406
  344   1HH1  ARG  50          1HH1      ARG  50  -6.891  16.795  -6.713
  345   2HH1  ARG  50          2HH1      ARG  50  -6.872  17.332  -8.360
  346   1HH2  ARG  50          1HH2      ARG  50  -8.725  14.627  -9.571
  347   2HH2  ARG  50          2HH2      ARG  50  -7.915  16.100  -9.982
  348    H    GLU  51           H        GLU  51  -5.150  11.854  -6.911
  349    HA   GLU  51           HA       GLU  51  -4.777   9.002  -6.543
  350   1HB   GLU  51          2HB       GLU  51  -4.073  10.367  -9.142
  351   2HB   GLU  51          1HB       GLU  51  -3.586   8.736  -8.700
  352   1HG   GLU  51          2HG       GLU  51  -5.939   8.070  -8.593
  353   2HG   GLU  51          1HG       GLU  51  -6.414   9.703  -9.056
  354    H    ILE  52           H        ILE  52  -2.761   8.446  -5.883
  355    HA   ILE  52           HA       ILE  52  -0.494  10.204  -6.119
  356    HB   ILE  52           HB       ILE  52  -1.658  11.218  -4.204
  357   1HG1  ILE  52          2HG1      ILE  52   0.215  11.116  -2.588
  358   2HG1  ILE  52          1HG1      ILE  52   0.860   9.718  -3.446
  359   1HG2  ILE  52          1HG2      ILE  52  -2.346  10.098  -2.336
  360   2HG2  ILE  52          2HG2      ILE  52  -1.157   8.809  -2.534
  361   3HG2  ILE  52          3HG2      ILE  52  -2.592   8.852  -3.559
  362   1HD1  ILE  52          1HD1      ILE  52   0.564  12.512  -4.549
  363   2HD1  ILE  52          2HD1      ILE  52   1.145  11.117  -5.460
  364   3HD1  ILE  52          3HD1      ILE  52   2.070  11.720  -4.082
  365    H    THR  53           H        THR  53   1.497   9.171  -5.402
  366    HA   THR  53           HA       THR  53   1.194   6.253  -5.092
  367    HB   THR  53           HB       THR  53   3.424   7.787  -6.437
  368    HG1  THR  53           1HG      THR  53   2.587   6.789  -8.310
  369   1HG2  THR  53          1HG2      THR  53   4.257   5.641  -7.190
  370   2HG2  THR  53          2HG2      THR  53   3.013   4.813  -6.252
  371   3HG2  THR  53          3HG2      THR  53   4.270   5.736  -5.429
  372    H    VAL  54           H        VAL  54   2.762   5.116  -3.824
  373    HA   VAL  54           HA       VAL  54   4.465   6.705  -2.064
  374    HB   VAL  54           HB       VAL  54   2.429   4.761  -0.965
  375   1HG1  VAL  54          1HG1      VAL  54   4.594   4.851   0.256
  376   2HG1  VAL  54          2HG1      VAL  54   3.223   5.409   1.217
  377   3HG1  VAL  54          3HG1      VAL  54   4.338   6.578   0.507
  378   1HG2  VAL  54          1HG2      VAL  54   2.539   7.773  -0.824
  379   2HG2  VAL  54          2HG2      VAL  54   1.423   6.759   0.090
  380   3HG2  VAL  54          3HG2      VAL  54   1.336   6.801  -1.672
  381    HA   PRO  55           HA       PRO  55   7.051   3.145  -2.839
  382   1HB   PRO  55          2HB       PRO  55   8.857   4.066  -0.758
  383   2HB   PRO  55          1HB       PRO  55   9.083   4.079  -2.507
  384   1HG   PRO  55          2HG       PRO  55   8.765   6.339  -1.029
  385   2HG   PRO  55          1HG       PRO  55   8.272   6.208  -2.726
  386   1HD   PRO  55          2HD       PRO  55   6.601   6.030  -0.246
  387   2HD   PRO  55          1HD       PRO  55   6.253   6.843  -1.787
  388    H    LYS  56           H        LYS  56   6.467   1.189  -2.118
  389    HA   LYS  56           HA       LYS  56   6.163   0.746   0.767
  390   1HB   LYS  56          2HB       LYS  56   4.914  -1.235   0.218
  391   2HB   LYS  56          1HB       LYS  56   4.282   0.118  -0.706
  392   1HG   LYS  56          2HG       LYS  56   5.348  -0.645  -2.696
  393   2HG   LYS  56          1HG       LYS  56   6.238  -1.881  -1.810
  394   1HD   LYS  56          2HD       LYS  56   3.235  -1.777  -2.093
  395   2HD   LYS  56          1HD       LYS  56   4.307  -2.790  -3.059
  396   1HE   LYS  56          2HE       LYS  56   5.066  -3.919  -1.016
  397   2HE   LYS  56          1HE       LYS  56   3.977  -2.916  -0.062
  398   1HZ   LYS  56          1HZ       LYS  56   2.178  -3.869  -1.606
  399   2HZ   LYS  56          2HZ       LYS  56   2.783  -4.850  -0.367
  400   3HZ   LYS  56          3HZ       LYS  56   3.317  -5.072  -1.957
  401    H    GLY  57           H        GLY  57   8.551   0.401  -1.504
  402   1HA   GLY  57          2HA       GLY  57   9.539  -2.149  -1.324
  403   2HA   GLY  57          1HA       GLY  57  10.561  -0.725  -1.433
  404    H    ILE  58           H        ILE  58   9.464   0.214   1.210
  405    HA   ILE  58           HA       ILE  58  10.435  -1.756   3.069
  406    HB   ILE  58           HB       ILE  58  11.734   0.965   3.011
  407   1HG1  ILE  58          2HG1      ILE  58  13.827  -0.453   2.455
  408   2HG1  ILE  58          1HG1      ILE  58  12.680  -1.685   1.936
  409   1HG2  ILE  58          1HG2      ILE  58  13.014   0.287   4.830
  410   2HG2  ILE  58          2HG2      ILE  58  12.674  -1.422   4.560
  411   3HG2  ILE  58          3HG2      ILE  58  11.416  -0.362   5.193
  412   1HD1  ILE  58          1HD1      ILE  58  12.593  -0.703  -0.038
  413   2HD1  ILE  58          2HD1      ILE  58  13.627   0.607   0.533
  414   3HD1  ILE  58          3HD1      ILE  58  11.877   0.717   0.723
  415    H    ALA  59           H        ALA  59   7.910  -1.192   3.099
  416    HA   ALA  59           HA       ALA  59   7.578   0.525   5.415
  417   1HB   ALA  59          1HB       ALA  59   7.339   2.040   3.508
  418   2HB   ALA  59          2HB       ALA  59   5.841   1.892   4.424
  419   3HB   ALA  59          3HB       ALA  59   6.024   1.039   2.891
  420    H    VAL  60           H        VAL  60   5.858   0.057   6.714
  421    HA   VAL  60           HA       VAL  60   4.303  -2.329   5.996
  422    HB   VAL  60           HB       VAL  60   5.521  -2.436   8.134
  423   1HG1  VAL  60          1HG1      VAL  60   3.782  -0.596   9.578
  424   2HG1  VAL  60          2HG1      VAL  60   4.831   0.207   8.413
  425   3HG1  VAL  60          3HG1      VAL  60   5.529  -0.814   9.669
  426   1HG2  VAL  60          1HG2      VAL  60   2.719  -2.254   9.055
  427   2HG2  VAL  60          2HG2      VAL  60   3.872  -3.584   9.177
  428   3HG2  VAL  60          3HG2      VAL  60   3.022  -3.289   7.659
  429    H    PHE  61           H        PHE  61   2.019  -2.303   6.039
  430    HA   PHE  61           HA       PHE  61   0.660   0.129   6.816
  431   1HB   PHE  61          2HB       PHE  61  -0.375   0.430   4.547
  432   2HB   PHE  61          1HB       PHE  61   1.338   0.824   4.638
  433    HD1  PHE  61           1HD      PHE  61   2.849  -0.152   3.180
  434    HD2  PHE  61           2HD      PHE  61  -1.006  -1.887   3.664
  435    HE1  PHE  61           1HE      PHE  61   3.309  -1.683   1.312
  436    HE2  PHE  61           2HE      PHE  61  -0.553  -3.422   1.793
  437    HZ   PHE  61           HZ       PHE  61   1.608  -3.322   0.617
  438    H    HIS  62           H        HIS  62  -1.679  -0.012   6.620
  439    HA   HIS  62           HA       HIS  62  -2.664  -2.783   6.524
  440   1HB   HIS  62          2HB       HIS  62  -3.436  -0.649   8.526
  441   2HB   HIS  62          1HB       HIS  62  -4.172  -2.243   8.410
  442    HD1  HIS  62           1HD      HIS  62  -0.568  -1.019   8.694
  443    HD2  HIS  62           2HD      HIS  62  -3.162  -3.811  10.347
  444    HE1  HIS  62           1HE      HIS  62   0.784  -2.254  10.418
  445    HE2  HIS  62           2HE      HIS  62  -0.778  -4.007  11.331
  446    H    PHE  63           H        PHE  63  -4.421  -3.088   5.298
  447    HA   PHE  63           HA       PHE  63  -5.644  -0.756   4.040
  448   1HB   PHE  63          2HB       PHE  63  -5.631  -3.698   3.418
  449   2HB   PHE  63          1HB       PHE  63  -6.807  -2.627   2.670
  450    HD1  PHE  63           1HD      PHE  63  -3.409  -1.471   3.427
  451    HD2  PHE  63           2HD      PHE  63  -5.994  -3.083   0.454
  452    HE1  PHE  63           1HE      PHE  63  -1.772  -0.884   1.686
  453    HE2  PHE  63           2HE      PHE  63  -4.360  -2.499  -1.288
  454    HZ   PHE  63           HZ       PHE  63  -2.245  -1.398  -0.674
  455    H    ARG  64           H        ARG  64  -7.512   0.043   4.715
  456    HA   ARG  64           HA       ARG  64  -9.301  -1.690   6.291
  457   1HB   ARG  64          2HB       ARG  64  -8.195   0.244   7.496
  458   2HB   ARG  64          1HB       ARG  64  -9.115   1.322   6.458
  459   1HG   ARG  64          2HG       ARG  64 -10.343  -0.712   8.307
  460   2HG   ARG  64          1HG       ARG  64 -10.093   0.985   8.711
  461   1HD   ARG  64          2HD       ARG  64 -11.864  -0.148   6.550
  462   2HD   ARG  64          1HD       ARG  64 -12.363   0.700   8.008
  463    HE   ARG  64           HE       ARG  64 -11.614   1.881   5.551
  464   1HH1  ARG  64          1HH1      ARG  64 -11.389   2.346   9.004
  465   2HH1  ARG  64          2HH1      ARG  64 -11.200   4.062   8.884
  466   1HH2  ARG  64          1HH2      ARG  64 -11.368   4.138   5.396
  467   2HH2  ARG  64          2HH2      ARG  64 -11.191   5.080   6.839
  468    H    THR  65           H        THR  65 -11.123  -2.197   5.270
  469    HA   THR  65           HA       THR  65 -11.969  -0.648   2.964
  470    HB   THR  65           HB       THR  65 -13.186  -3.160   4.124
  471    HG1  THR  65           1HG      THR  65 -11.699  -4.229   3.109
  472   1HG2  THR  65          1HG2      THR  65 -14.389  -3.438   2.186
  473   2HG2  THR  65          2HG2      THR  65 -13.354  -2.351   1.262
  474   3HG2  THR  65          3HG2      THR  65 -14.497  -1.696   2.433
  475    HA   PRO  66           HA       PRO  66 -14.890   1.970   5.012
  476   1HB   PRO  66          2HB       PRO  66 -16.559   1.345   2.615
  477   2HB   PRO  66          1HB       PRO  66 -16.171   2.910   3.337
  478   1HG   PRO  66          2HG       PRO  66 -14.939   2.114   1.125
  479   2HG   PRO  66          1HG       PRO  66 -14.047   2.965   2.399
  480   1HD   PRO  66          2HD       PRO  66 -14.032   0.072   1.682
  481   2HD   PRO  66          1HD       PRO  66 -12.715   1.090   2.299
  482    H    GLN  67           H        GLN  67 -15.904  -1.143   3.694
  483    HA   GLN  67           HA       GLN  67 -18.433  -1.253   4.931
  484   1HB   GLN  67          2HB       GLN  67 -18.391  -3.628   4.467
  485   2HB   GLN  67          1HB       GLN  67 -17.742  -2.747   3.092
  486   1HG   GLN  67          2HG       GLN  67 -15.471  -3.278   3.838
  487   2HG   GLN  67          1HG       GLN  67 -16.139  -4.184   5.189
  488   1HE2  GLN  67          1HE2      GLN  67 -18.240  -4.702   2.724
  489   2HE2  GLN  67          2HE2      GLN  67 -17.563  -6.145   2.064
  490    H    GLY  68           H        GLY  68 -15.343  -1.345   6.311
  491   1HA   GLY  68          2HA       GLY  68 -15.129  -1.246   8.696
  492   2HA   GLY  68          1HA       GLY  68 -16.515  -2.316   8.827
  493    H    GLU  69           H        GLU  69 -13.476  -2.522   6.980
  494    HA   GLU  69           HA       GLU  69 -12.896  -5.032   8.412
  495   1HB   GLU  69          2HB       GLU  69 -12.547  -4.465   5.464
  496   2HB   GLU  69          1HB       GLU  69 -11.881  -5.873   6.280
  497   1HG   GLU  69          2HG       GLU  69 -14.805  -5.189   6.110
  498   2HG   GLU  69          1HG       GLU  69 -13.971  -6.359   5.092
  499    H    LEU  70           H        LEU  70 -10.729  -5.483   8.839
  500    HA   LEU  70           HA       LEU  70  -8.849  -3.278   8.306
  501   1HB   LEU  70          2HB       LEU  70  -9.552  -3.244  10.641
  502   2HB   LEU  70          1HB       LEU  70  -9.097  -4.928  10.820
  503    HG   LEU  70           HG       LEU  70  -6.740  -4.333  10.436
  504   1HD1  LEU  70          1HD1      LEU  70  -7.748  -1.488  10.411
  505   2HD1  LEU  70          2HD1      LEU  70  -7.111  -2.367   9.020
  506   3HD1  LEU  70          3HD1      LEU  70  -6.058  -1.995  10.385
  507   1HD2  LEU  70          1HD2      LEU  70  -8.078  -2.715  12.605
  508   2HD2  LEU  70          2HD2      LEU  70  -6.375  -3.171  12.559
  509   3HD2  LEU  70          3HD2      LEU  70  -7.617  -4.414  12.716
  510    H    VAL  71           H        VAL  71  -7.183  -3.896   7.119
  511    HA   VAL  71           HA       VAL  71  -6.254  -6.687   7.326
  512    HB   VAL  71           HB       VAL  71  -6.152  -4.954   4.853
  513   1HG1  VAL  71          1HG1      VAL  71  -4.623  -7.162   5.530
  514   2HG1  VAL  71          2HG1      VAL  71  -4.862  -6.507   3.910
  515   3HG1  VAL  71          3HG1      VAL  71  -5.888  -7.818   4.491
  516   1HG2  VAL  71          1HG2      VAL  71  -7.851  -6.606   3.988
  517   2HG2  VAL  71          2HG2      VAL  71  -8.435  -5.477   5.210
  518   3HG2  VAL  71          3HG2      VAL  71  -8.057  -7.140   5.656
  519    H    GLU  72           H        GLU  72  -4.054  -7.033   7.432
  520    HA   GLU  72           HA       GLU  72  -2.374  -4.617   7.589
  521   1HB   GLU  72          2HB       GLU  72  -1.055  -5.672   9.323
  522   2HB   GLU  72          1HB       GLU  72  -2.744  -5.650   9.804
  523   1HG   GLU  72          2HG       GLU  72  -1.364  -8.037   8.603
  524   2HG   GLU  72          1HG       GLU  72  -1.544  -7.756  10.333
  525    H    ILE  73           H        ILE  73  -0.586  -4.558   6.371
  526    HA   ILE  73           HA       ILE  73   0.398  -7.070   5.200
  527    HB   ILE  73           HB       ILE  73   0.052  -4.478   3.684
  528   1HG1  ILE  73          2HG1      ILE  73  -1.519  -5.885   2.279
  529   2HG1  ILE  73          1HG1      ILE  73  -1.453  -7.093   3.558
  530   1HG2  ILE  73          1HG2      ILE  73   0.634  -6.081   1.736
  531   2HG2  ILE  73          2HG2      ILE  73   1.338  -7.089   3.002
  532   3HG2  ILE  73          3HG2      ILE  73   1.934  -5.449   2.748
  533   1HD1  ILE  73          1HD1      ILE  73  -2.978  -6.007   4.747
  534   2HD1  ILE  73          2HD1      ILE  73  -3.204  -4.940   3.361
  535   3HD1  ILE  73          3HD1      ILE  73  -2.074  -4.498   4.640
  536    H    ASP  74           H        ASP  74   2.624  -7.159   4.865
  537    HA   ASP  74           HA       ASP  74   4.122  -5.000   6.178
  538   1HB   ASP  74          2HB       ASP  74   4.900  -7.885   5.709
  539   2HB   ASP  74          1HB       ASP  74   5.897  -6.684   6.524
  540    H    GLY  75           H        GLY  75   4.643  -3.592   4.597
  541   1HA   GLY  75          2HA       GLY  75   5.718  -4.573   2.066
  542   2HA   GLY  75          1HA       GLY  75   5.308  -2.907   2.444
  543    H    ARG  76           H        ARG  76   6.871  -3.578   5.100
  544    HA   ARG  76           HA       ARG  76   9.371  -2.591   4.062
  545   1HB   ARG  76          2HB       ARG  76   9.941  -2.117   6.391
  546   2HB   ARG  76          1HB       ARG  76   8.380  -1.431   5.965
  547   1HG   ARG  76          2HG       ARG  76   7.232  -3.214   7.103
  548   2HG   ARG  76          1HG       ARG  76   8.760  -4.036   7.424
  549   1HD   ARG  76          2HD       ARG  76   9.487  -2.128   8.785
  550   2HD   ARG  76          1HD       ARG  76   7.946  -1.328   8.475
  551    HE   ARG  76           HE       ARG  76   7.376  -3.821   9.561
  552   1HH1  ARG  76          1HH1      ARG  76   8.980  -0.878  10.532
  553   2HH1  ARG  76          2HH1      ARG  76   8.585  -1.068  12.207
  554   1HH2  ARG  76          1HH2      ARG  76   6.856  -4.073  11.764
  555   2HH2  ARG  76          2HH2      ARG  76   7.380  -2.882  12.907
  556    H    ALA  77           H        ALA  77   8.113  -5.345   5.776
  557    HA   ALA  77           HA       ALA  77  10.750  -6.564   5.854
  558   1HB   ALA  77          1HB       ALA  77   9.282  -8.329   7.199
  559   2HB   ALA  77          2HB       ALA  77   8.275  -6.898   7.423
  560   3HB   ALA  77          3HB       ALA  77   9.959  -6.881   7.944
  561    H    LEU  78           H        LEU  78   8.185  -6.564   3.743
  562    HA   LEU  78           HA       LEU  78   8.907  -9.266   2.822
  563   1HB   LEU  78          2HB       LEU  78   6.136  -8.089   2.669
  564   2HB   LEU  78          1HB       LEU  78   6.624  -9.685   2.140
  565    HG   LEU  78           HG       LEU  78   6.571  -8.705   4.996
  566   1HD1  LEU  78          1HD1      LEU  78   4.800 -10.389   5.263
  567   2HD1  LEU  78          2HD1      LEU  78   4.851 -10.700   3.528
  568   3HD1  LEU  78          3HD1      LEU  78   4.350  -9.118   4.127
  569   1HD2  LEU  78          1HD2      LEU  78   8.160 -10.255   5.294
  570   2HD2  LEU  78          2HD2      LEU  78   7.872 -10.998   3.720
  571   3HD2  LEU  78          3HD2      LEU  78   6.847 -11.414   5.093
  572    H    VAL  79           H        VAL  79  10.171  -7.002   1.855
  573    HA   VAL  79           HA       VAL  79   8.910  -6.033  -0.509
  574    HB   VAL  79           HB       VAL  79  10.604  -4.693   0.632
  575   1HG1  VAL  79          1HG1      VAL  79  12.711  -5.357   1.100
  576   2HG1  VAL  79          2HG1      VAL  79  12.859  -6.304  -0.380
  577   3HG1  VAL  79          3HG1      VAL  79  11.985  -6.962   1.004
  578   1HG2  VAL  79          1HG2      VAL  79  12.030  -5.198  -1.885
  579   2HG2  VAL  79          2HG2      VAL  79  11.282  -3.720  -1.279
  580   3HG2  VAL  79          3HG2      VAL  79  10.290  -4.955  -2.054
  581    H    ALA  80           H        ALA  80   8.386  -7.571  -1.978
  582    HA   ALA  80           HA       ALA  80  10.498  -9.435  -2.832
  583   1HB   ALA  80          1HB       ALA  80   8.807 -10.857  -2.307
  584   2HB   ALA  80          2HB       ALA  80   8.336 -10.499  -3.968
  585   3HB   ALA  80          3HB       ALA  80   7.551  -9.661  -2.629
  586    H    ARG  81           H        ARG  81  11.574  -8.552  -4.489
  587    HA   ARG  81           HA       ARG  81   9.991  -7.382  -6.682
  588   1HB   ARG  81          2HB       ARG  81  12.848  -6.756  -5.913
  589   2HB   ARG  81          1HB       ARG  81  11.951  -6.020  -7.235
  590   1HG   ARG  81          2HG       ARG  81  10.371  -5.070  -5.624
  591   2HG   ARG  81          1HG       ARG  81  11.297  -5.788  -4.305
  592   1HD   ARG  81          2HD       ARG  81  11.879  -3.438  -4.588
  593   2HD   ARG  81          1HD       ARG  81  13.257  -4.474  -4.968
  594    HE   ARG  81           HE       ARG  81  11.864  -3.942  -7.337
  595   1HH1  ARG  81          1HH1      ARG  81  13.802  -2.269  -4.965
  596   2HH1  ARG  81          2HH1      ARG  81  14.384  -1.088  -6.089
  597   1HH2  ARG  81          1HH2      ARG  81  12.629  -2.387  -8.818
  598   2HH2  ARG  81          2HH2      ARG  81  13.717  -1.155  -8.277
  599    HA   PRO  82           HA       PRO  82  11.675 -10.672  -9.144
  600   1HB   PRO  82          2HB       PRO  82  10.897  -9.852 -11.574
  601   2HB   PRO  82          1HB       PRO  82   9.727 -10.400 -10.366
  602   1HG   PRO  82          2HG       PRO  82  10.476  -7.610 -11.149
  603   2HG   PRO  82          1HG       PRO  82   8.871  -8.287 -10.820
  604   1HD   PRO  82          2HD       PRO  82  10.319  -6.820  -9.008
  605   2HD   PRO  82          1HD       PRO  82   9.092  -8.020  -8.559
  606    H    GLU  83           H        GLU  83  12.662  -7.392  -9.439
  607    HA   GLU  83           HA       GLU  83  14.750  -7.990 -11.374
  608   1HB   GLU  83          2HB       GLU  83  14.061  -5.408  -9.962
  609   2HB   GLU  83          1HB       GLU  83  15.266  -5.581 -11.231
  610   1HG   GLU  83          2HG       GLU  83  13.523  -6.254 -12.800
  611   2HG   GLU  83          1HG       GLU  83  12.313  -6.086 -11.527
  612    H    GLU  84           H        GLU  84  14.334  -7.648  -7.973
  613    HA   GLU  84           HA       GLU  84  17.228  -7.523  -7.535
  614   1HB   GLU  84          2HB       GLU  84  15.866  -5.925  -6.276
  615   2HB   GLU  84          1HB       GLU  84  14.936  -7.244  -5.583
  616   1HG   GLU  84          2HG       GLU  84  16.540  -6.430  -3.983
  617   2HG   GLU  84          1HG       GLU  84  16.956  -8.072  -4.471
  618    H    ARG  85           H        ARG  85  14.608  -9.719  -7.532
  619    HA   ARG  85           HA       ARG  85  14.452 -11.939  -7.084
  620   1HB   ARG  85          2HB       ARG  85  17.462 -11.773  -6.836
  621   2HB   ARG  85          1HB       ARG  85  16.530 -13.259  -6.953
  622   1HG   ARG  85          2HG       ARG  85  15.767 -12.607  -9.181
  623   2HG   ARG  85          1HG       ARG  85  16.703 -11.117  -9.062
  624   1HD   ARG  85          2HD       ARG  85  17.818 -13.919  -8.990
  625   2HD   ARG  85          1HD       ARG  85  17.890 -12.813 -10.361
  626    HE   ARG  85           HE       ARG  85  19.044 -11.551  -8.149
  627   1HH1  ARG  85          1HH1      ARG  85  19.663 -14.242 -10.282
  628   2HH1  ARG  85          2HH1      ARG  85  21.383 -14.143 -10.112
  629   1HH2  ARG  85          1HH2      ARG  85  21.307 -11.419  -7.924
  630   2HH2  ARG  85          2HH2      ARG  85  22.317 -12.541  -8.772
  631    H    ILE  86           H        ILE  86  13.466 -10.899  -5.079
  632    HA   ILE  86           HA       ILE  86  14.942 -11.794  -2.688
  633    HB   ILE  86           HB       ILE  86  12.837  -9.629  -2.815
  634   1HG1  ILE  86          2HG1      ILE  86  15.838  -9.415  -2.479
  635   2HG1  ILE  86          1HG1      ILE  86  14.930  -8.944  -3.912
  636   1HG2  ILE  86          1HG2      ILE  86  13.612 -11.183  -0.668
  637   2HG2  ILE  86          2HG2      ILE  86  12.811  -9.615  -0.583
  638   3HG2  ILE  86          3HG2      ILE  86  14.569  -9.715  -0.480
  639   1HD1  ILE  86          1HD1      ILE  86  15.429  -7.482  -1.472
  640   2HD1  ILE  86          2HD1      ILE  86  13.710  -7.550  -1.860
  641   3HD1  ILE  86          3HD1      ILE  86  14.856  -6.910  -3.038
  Start of MODEL   15
    1    H    ARG   9           H        ARG   9  -6.467 -16.497  -5.902
    2    HA   ARG   9           HA       ARG   9  -5.575 -13.767  -5.700
    3   1HB   ARG   9          2HB       ARG   9  -7.371 -15.113  -7.725
    4   2HB   ARG   9          1HB       ARG   9  -6.725 -13.483  -7.869
    5   1HG   ARG   9          2HG       ARG   9  -4.458 -14.378  -7.923
    6   2HG   ARG   9          1HG       ARG   9  -5.097 -16.015  -7.760
    7   1HD   ARG   9          2HD       ARG   9  -4.555 -15.499 -10.086
    8   2HD   ARG   9          1HD       ARG   9  -6.283 -15.779  -9.874
    9    HE   ARG   9           HE       ARG   9  -6.634 -13.669 -10.641
   10   1HH1  ARG   9          1HH1      ARG   9  -3.379 -13.824  -9.390
   11   2HH1  ARG   9          2HH1      ARG   9  -3.011 -12.181  -9.799
   12   1HH2  ARG   9          1HH2      ARG   9  -6.150 -11.512 -11.183
   13   2HH2  ARG   9          2HH2      ARG   9  -4.583 -10.871 -10.817
   14    H    HIS  10           H        HIS  10  -6.581 -12.585  -4.173
   15    HA   HIS  10           HA       HIS  10  -9.525 -12.491  -4.267
   16   1HB   HIS  10          2HB       HIS  10  -9.423 -11.813  -1.857
   17   2HB   HIS  10          1HB       HIS  10  -8.885 -13.460  -2.171
   18    HD1  HIS  10           1HD      HIS  10  -7.154 -10.062  -1.987
   19    HD2  HIS  10           2HD      HIS  10  -6.672 -13.997  -0.742
   20    HE1  HIS  10           1HE      HIS  10  -5.005 -10.097  -0.681
   21    HE2  HIS  10           2HE      HIS  10  -4.789 -12.465   0.148
   22    H    GLU  11           H        GLU  11  -6.593 -10.711  -4.478
   23    HA   GLU  11           HA       GLU  11  -6.138  -8.525  -4.904
   24   1HB   GLU  11          2HB       GLU  11  -9.084  -8.417  -5.578
   25   2HB   GLU  11          1HB       GLU  11  -7.901  -7.182  -5.990
   26   1HG   GLU  11          2HG       GLU  11  -6.705  -8.791  -7.384
   27   2HG   GLU  11          1HG       GLU  11  -7.892 -10.028  -6.971
   28    H    LEU  12           H        LEU  12  -6.414  -6.328  -4.104
   29    HA   LEU  12           HA       LEU  12  -7.977  -6.196  -1.612
   30   1HB   LEU  12          2HB       LEU  12  -5.169  -5.194  -2.071
   31   2HB   LEU  12          1HB       LEU  12  -6.136  -4.797  -0.664
   32    HG   LEU  12           HG       LEU  12  -6.232  -7.216  -0.098
   33   1HD1  LEU  12          1HD1      LEU  12  -4.108  -8.332  -1.404
   34   2HD1  LEU  12          2HD1      LEU  12  -4.884  -7.402  -2.686
   35   3HD1  LEU  12          3HD1      LEU  12  -5.804  -8.612  -1.792
   36   1HD2  LEU  12          1HD2      LEU  12  -4.639  -6.292   1.211
   37   2HD2  LEU  12          2HD2      LEU  12  -3.781  -5.573  -0.151
   38   3HD2  LEU  12          3HD2      LEU  12  -3.570  -7.283   0.220
   39    H    ILE  13           H        ILE  13  -8.479  -5.182  -4.380
   40    HA   ILE  13           HA       ILE  13  -8.247  -2.302  -4.090
   41    HB   ILE  13           HB       ILE  13  -9.662  -3.847  -6.267
   42   1HG1  ILE  13          2HG1      ILE  13  -6.835  -2.764  -6.183
   43   2HG1  ILE  13          1HG1      ILE  13  -7.284  -4.467  -6.143
   44   1HG2  ILE  13          1HG2      ILE  13  -8.931  -0.978  -5.853
   45   2HG2  ILE  13          2HG2      ILE  13 -10.443  -1.677  -6.432
   46   3HG2  ILE  13          3HG2      ILE  13  -9.034  -1.633  -7.489
   47   1HD1  ILE  13          1HD1      ILE  13  -6.513  -3.349  -8.364
   48   2HD1  ILE  13          2HD1      ILE  13  -8.182  -2.780  -8.425
   49   3HD1  ILE  13          3HD1      ILE  13  -7.841  -4.509  -8.364
   50    H    GLY  14           H        GLY  14  -9.947  -0.881  -3.813
   51   1HA   GLY  14          2HA       GLY  14 -12.295  -0.371  -3.666
   52   2HA   GLY  14          1HA       GLY  14 -12.590  -2.054  -3.259
   53    H    LEU  15           H        LEU  15  -9.979  -1.504  -1.507
   54    HA   LEU  15           HA       LEU  15 -11.525  -0.554   0.807
   55   1HB   LEU  15          2HB       LEU  15  -9.783  -1.788   2.154
   56   2HB   LEU  15          1HB       LEU  15 -10.887  -2.779   1.223
   57    HG   LEU  15           HG       LEU  15  -9.155  -3.146  -0.472
   58   1HD1  LEU  15          1HD1      LEU  15  -7.566  -1.299   1.279
   59   2HD1  LEU  15          2HD1      LEU  15  -7.846  -1.209  -0.460
   60   3HD1  LEU  15          3HD1      LEU  15  -6.792  -2.458   0.197
   61   1HD2  LEU  15          1HD2      LEU  15  -7.477  -4.307   1.127
   62   2HD2  LEU  15          2HD2      LEU  15  -9.156  -4.849   1.089
   63   3HD2  LEU  15          3HD2      LEU  15  -8.599  -3.798   2.391
   64    H    SER  16           H        SER  16 -10.165   0.491   2.534
   65    HA   SER  16           HA       SER  16  -8.567   2.571   1.283
   66   1HB   SER  16          2HB       SER  16  -9.450   2.231   4.164
   67   2HB   SER  16          1HB       SER  16  -8.651   3.657   3.499
   68    HG   SER  16           HG       SER  16 -10.440   3.996   2.177
   69    H    VAL  17           H        VAL  17  -6.479   3.214   2.179
   70    HA   VAL  17           HA       VAL  17  -5.018   0.992   3.431
   71    HB   VAL  17           HB       VAL  17  -4.434   0.890   1.111
   72   1HG1  VAL  17          1HG1      VAL  17  -5.136   3.046   0.343
   73   2HG1  VAL  17          2HG1      VAL  17  -3.428   2.851  -0.052
   74   3HG1  VAL  17          3HG1      VAL  17  -3.905   3.850   1.319
   75   1HG2  VAL  17          1HG2      VAL  17  -2.111   2.392   2.239
   76   2HG2  VAL  17          2HG2      VAL  17  -2.131   0.911   1.285
   77   3HG2  VAL  17          3HG2      VAL  17  -2.618   0.875   2.979
   78    H    ARG  18           H        ARG  18  -4.077   1.595   5.251
   79    HA   ARG  18           HA       ARG  18  -3.364   4.433   5.601
   80   1HB   ARG  18          2HB       ARG  18  -4.010   2.416   7.758
   81   2HB   ARG  18          1HB       ARG  18  -3.681   4.126   7.993
   82   1HG   ARG  18          2HG       ARG  18  -5.706   4.638   6.642
   83   2HG   ARG  18          1HG       ARG  18  -6.058   2.907   6.608
   84   1HD   ARG  18          2HD       ARG  18  -5.875   4.673   9.044
   85   2HD   ARG  18          1HD       ARG  18  -7.333   3.946   8.370
   86    HE   ARG  18           HE       ARG  18  -5.560   1.881   8.943
   87   1HH1  ARG  18          1HH1      ARG  18  -7.352   4.326  10.670
   88   2HH1  ARG  18          2HH1      ARG  18  -7.494   3.379  12.114
   89   1HH2  ARG  18          1HH2      ARG  18  -5.745   0.635  10.839
   90   2HH2  ARG  18          2HH2      ARG  18  -6.577   1.285  12.210
   91    H    ILE  19           H        ILE  19  -1.270   4.885   5.807
   92    HA   ILE  19           HA       ILE  19   0.632   2.698   6.021
   93    HB   ILE  19           HB       ILE  19   1.164   5.650   5.650
   94   1HG1  ILE  19          2HG1      ILE  19  -0.152   4.751   3.794
   95   2HG1  ILE  19          1HG1      ILE  19   1.498   5.092   3.277
   96   1HG2  ILE  19          1HG2      ILE  19   3.316   4.542   4.623
   97   2HG2  ILE  19          2HG2      ILE  19   2.888   3.223   5.712
   98   3HG2  ILE  19          3HG2      ILE  19   3.186   4.838   6.357
   99   1HD1  ILE  19          1HD1      ILE  19   0.232   2.416   3.805
  100   2HD1  ILE  19          2HD1      ILE  19   1.978   2.628   3.682
  101   3HD1  ILE  19          3HD1      ILE  19   0.943   3.018   2.305
  102    H    ALA  20           H        ALA  20   1.935   2.290   7.726
  103    HA   ALA  20           HA       ALA  20   1.475   3.867  10.157
  104   1HB   ALA  20          1HB       ALA  20   2.844   1.718  11.037
  105   2HB   ALA  20          2HB       ALA  20   2.055   1.030   9.618
  106   3HB   ALA  20          3HB       ALA  20   1.087   1.770  10.893
  107    H    ARG  21           H        ARG  21   3.867   3.021   7.839
  108    HA   ARG  21           HA       ARG  21   5.695   4.955   8.840
  109   1HB   ARG  21          2HB       ARG  21   6.224   3.059  10.341
  110   2HB   ARG  21          1HB       ARG  21   6.566   2.067   8.934
  111   1HG   ARG  21          2HG       ARG  21   8.627   2.843   9.886
  112   2HG   ARG  21          1HG       ARG  21   8.381   3.609   8.315
  113   1HD   ARG  21          2HD       ARG  21   7.564   5.629   9.421
  114   2HD   ARG  21          1HD       ARG  21   7.783   4.863  10.994
  115    HE   ARG  21           HE       ARG  21  10.217   4.814   9.583
  116   1HH1  ARG  21          1HH1      ARG  21   8.086   7.048  11.208
  117   2HH1  ARG  21          2HH1      ARG  21   9.351   8.159  11.609
  118   1HH2  ARG  21          1HH2      ARG  21  11.883   6.274  10.108
  119   2HH2  ARG  21          2HH2      ARG  21  11.507   7.720  10.984
  120    H    SER  22           H        SER  22   7.268   5.491   7.334
  121    HA   SER  22           HA       SER  22   7.312   3.966   4.834
  122   1HB   SER  22          2HB       SER  22   6.783   6.941   4.998
  123   2HB   SER  22          1HB       SER  22   7.064   6.040   3.509
  124    HG   SER  22           HG       SER  22   5.005   5.348   5.315
  125    H    VAL  23           H        VAL  23   9.057   4.691   3.355
  126    HA   VAL  23           HA       VAL  23  11.537   4.733   4.656
  127    HB   VAL  23           HB       VAL  23  11.272   3.889   2.378
  128   1HG1  VAL  23          1HG1      VAL  23  10.738   6.773   1.680
  129   2HG1  VAL  23          2HG1      VAL  23   9.649   5.399   1.479
  130   3HG1  VAL  23          3HG1      VAL  23  11.107   5.522   0.493
  131   1HG2  VAL  23          1HG2      VAL  23  13.214   6.154   2.768
  132   2HG2  VAL  23          2HG2      VAL  23  13.230   5.138   1.327
  133   3HG2  VAL  23          3HG2      VAL  23  13.503   4.421   2.915
  134    H    HIS  24           H        HIS  24   9.520   7.314   3.397
  135    HA   HIS  24           HA       HIS  24  11.484   9.281   4.370
  136   1HB   HIS  24          2HB       HIS  24   9.346   9.602   2.255
  137   2HB   HIS  24          1HB       HIS  24  10.390  10.891   2.836
  138    HD1  HIS  24           1HD      HIS  24  10.697  10.605  -0.006
  139    HD2  HIS  24           2HD      HIS  24  12.714   8.052   2.578
  140    HE1  HIS  24           1HE      HIS  24  12.621   9.683  -1.339
  141    HE2  HIS  24           2HE      HIS  24  13.768   8.065   0.216
  142    H    ARG  25           H        ARG  25  10.879  10.767   5.860
  143    HA   ARG  25           HA       ARG  25   8.627  10.225   7.465
  144   1HB   ARG  25          2HB       ARG  25   9.285  12.236   8.722
  145   2HB   ARG  25          1HB       ARG  25  10.646  11.167   8.413
  146   1HG   ARG  25          2HG       ARG  25  11.362  12.606   6.575
  147   2HG   ARG  25          1HG       ARG  25   9.993  13.676   6.879
  148   1HD   ARG  25          2HD       ARG  25  12.029  14.563   7.885
  149   2HD   ARG  25          1HD       ARG  25  10.848  14.138   9.122
  150    HE   ARG  25           HE       ARG  25  12.549  11.949   8.729
  151   1HH1  ARG  25          1HH1      ARG  25  12.656  15.204   9.987
  152   2HH1  ARG  25          2HH1      ARG  25  13.940  14.864  11.099
  153   1HH2  ARG  25          1HH2      ARG  25  14.238  11.503  10.191
  154   2HH2  ARG  25          2HH2      ARG  25  14.838  12.764  11.215
  155    H    ASP  26           H        ASP  26   9.017  12.281   4.723
  156    HA   ASP  26           HA       ASP  26   6.776  13.953   5.363
  157   1HB   ASP  26          2HB       ASP  26   7.104  14.928   3.132
  158   2HB   ASP  26          1HB       ASP  26   8.606  14.877   4.049
  159    H    ILE  27           H        ILE  27   6.871  10.819   4.479
  160    HA   ILE  27           HA       ILE  27   4.295  11.018   3.128
  161    HB   ILE  27           HB       ILE  27   4.843   9.039   1.773
  162   1HG1  ILE  27          2HG1      ILE  27   7.606   9.417   2.944
  163   2HG1  ILE  27          1HG1      ILE  27   6.536   8.051   3.227
  164   1HG2  ILE  27          1HG2      ILE  27   5.087  11.043   0.611
  165   2HG2  ILE  27          2HG2      ILE  27   6.619  10.215   0.337
  166   3HG2  ILE  27          3HG2      ILE  27   6.518  11.512   1.527
  167   1HD1  ILE  27          1HD1      ILE  27   6.965   7.113   1.197
  168   2HD1  ILE  27          2HD1      ILE  27   8.500   7.939   1.471
  169   3HD1  ILE  27          3HD1      ILE  27   7.282   8.665   0.422
  170    H    GLN  28           H        GLN  28   6.148   9.624   5.624
  171    HA   GLN  28           HA       GLN  28   4.778   7.196   5.999
  172   1HB   GLN  28          2HB       GLN  28   5.708   7.235   8.269
  173   2HB   GLN  28          1HB       GLN  28   6.924   7.656   7.070
  174   1HG   GLN  28          2HG       GLN  28   6.654  10.015   7.610
  175   2HG   GLN  28          1HG       GLN  28   5.411   9.607   8.792
  176   1HE2  GLN  28          1HE2      GLN  28   6.117   9.655  10.789
  177   2HE2  GLN  28          2HE2      GLN  28   7.706   9.243  11.326
  178    H    GLY  29           H        GLY  29   3.269   6.653   7.719
  179   1HA   GLY  29          2HA       GLY  29   1.288   6.931   8.846
  180   2HA   GLY  29          1HA       GLY  29   1.830   8.567   9.193
  181    H    ILE  30           H        ILE  30   1.627   7.729   5.873
  182    HA   ILE  30           HA       ILE  30  -0.474   9.645   5.490
  183    HB   ILE  30           HB       ILE  30   1.473   9.519   3.970
  184   1HG1  ILE  30          2HG1      ILE  30  -0.643  10.550   3.222
  185   2HG1  ILE  30          1HG1      ILE  30   0.251   9.825   1.891
  186   1HG2  ILE  30          1HG2      ILE  30   1.833   7.758   2.464
  187   2HG2  ILE  30          2HG2      ILE  30   0.266   7.030   2.806
  188   3HG2  ILE  30          3HG2      ILE  30   1.540   6.989   4.022
  189   1HD1  ILE  30          1HD1      ILE  30  -2.336   8.997   3.117
  190   2HD1  ILE  30          2HD1      ILE  30  -1.316   7.774   2.360
  191   3HD1  ILE  30          3HD1      ILE  30  -1.888   9.149   1.418
  192    H    SER  31           H        SER  31  -2.524   9.092   5.769
  193    HA   SER  31           HA       SER  31  -3.390   6.357   5.175
  194   1HB   SER  31          2HB       SER  31  -4.047   7.244   7.365
  195   2HB   SER  31          1HB       SER  31  -4.825   8.623   6.589
  196    HG   SER  31           HG       SER  31  -6.312   7.207   5.662
  197    H    GLY  32           H        GLY  32  -4.784   5.887   3.497
  198   1HA   GLY  32          2HA       GLY  32  -6.346   7.919   2.229
  199   2HA   GLY  32          1HA       GLY  32  -4.911   7.534   1.296
  200    H    ARG  33           H        ARG  33  -6.428   6.939  -0.333
  201    HA   ARG  33           HA       ARG  33  -7.710   4.348   0.095
  202   1HB   ARG  33          2HB       ARG  33  -8.582   6.731  -1.173
  203   2HB   ARG  33          1HB       ARG  33  -8.534   5.450  -2.357
  204   1HG   ARG  33          2HG       ARG  33  -9.835   5.009   0.282
  205   2HG   ARG  33          1HG       ARG  33 -10.694   5.834  -1.021
  206   1HD   ARG  33          2HD       ARG  33  -9.476   3.076  -1.156
  207   2HD   ARG  33          1HD       ARG  33 -11.194   3.446  -1.007
  208    HE   ARG  33           HE       ARG  33 -10.287   4.773  -3.262
  209   1HH1  ARG  33          1HH1      ARG  33 -10.579   1.472  -2.178
  210   2HH1  ARG  33          2HH1      ARG  33 -10.797   0.843  -3.775
  211   1HH2  ARG  33          1HH2      ARG  33 -10.578   3.943  -5.358
  212   2HH2  ARG  33          2HH2      ARG  33 -10.800   2.240  -5.578
  213    H    VAL  34           H        VAL  34  -7.824   3.023  -2.042
  214    HA   VAL  34           HA       VAL  34  -5.025   2.687  -2.863
  215    HB   VAL  34           HB       VAL  34  -6.097   0.813  -1.702
  216   1HG1  VAL  34          1HG1      VAL  34  -7.699  -0.007  -4.016
  217   2HG1  VAL  34          2HG1      VAL  34  -8.316   1.396  -3.145
  218   3HG1  VAL  34          3HG1      VAL  34  -8.047  -0.123  -2.291
  219   1HG2  VAL  34          1HG2      VAL  34  -5.426   0.188  -4.576
  220   2HG2  VAL  34          2HG2      VAL  34  -5.360  -0.934  -3.217
  221   3HG2  VAL  34          3HG2      VAL  34  -4.250   0.436  -3.286
  222    H    VAL  35           H        VAL  35  -4.410   2.081  -4.992
  223    HA   VAL  35           HA       VAL  35  -6.448   2.315  -7.051
  224    HB   VAL  35           HB       VAL  35  -5.131   4.559  -6.792
  225   1HG1  VAL  35          1HG1      VAL  35  -3.185   4.702  -8.226
  226   2HG1  VAL  35          2HG1      VAL  35  -3.215   2.958  -8.459
  227   3HG1  VAL  35          3HG1      VAL  35  -2.904   3.629  -6.863
  228   1HG2  VAL  35          1HG2      VAL  35  -5.602   5.051  -9.050
  229   2HG2  VAL  35          2HG2      VAL  35  -6.762   3.808  -8.587
  230   3HG2  VAL  35          3HG2      VAL  35  -5.347   3.379  -9.545
  231    H    ASP  36           H        ASP  36  -2.999   1.710  -6.411
  232    HA   ASP  36           HA       ASP  36  -3.146  -0.848  -7.694
  233   1HB   ASP  36          2HB       ASP  36  -2.873   0.598  -9.653
  234   2HB   ASP  36          1HB       ASP  36  -1.445   1.327  -8.928
  235    H    GLU  37           H        GLU  37  -1.120  -2.069  -7.489
  236    HA   GLU  37           HA       GLU  37   0.675  -0.977  -5.423
  237   1HB   GLU  37          2HB       GLU  37  -0.410  -3.797  -5.582
  238   2HB   GLU  37          1HB       GLU  37   0.829  -3.259  -4.456
  239   1HG   GLU  37          2HG       GLU  37  -1.281  -3.356  -3.328
  240   2HG   GLU  37          1HG       GLU  37  -0.783  -1.672  -3.482
  241    H    THR  38           H        THR  38   2.768  -1.006  -5.998
  242    HA   THR  38           HA       THR  38   3.592  -2.886  -8.116
  243    HB   THR  38           HB       THR  38   4.681  -0.107  -7.648
  244    HG1  THR  38           1HG      THR  38   3.140   0.567  -8.876
  245   1HG2  THR  38          1HG2      THR  38   6.182  -1.826  -8.768
  246   2HG2  THR  38          2HG2      THR  38   5.894  -0.314  -9.630
  247   3HG2  THR  38          3HG2      THR  38   5.035  -1.779 -10.106
  248    H    ARG  39           H        ARG  39   5.746  -3.676  -8.022
  249    HA   ARG  39           HA       ARG  39   6.617  -4.491  -5.516
  250   1HB   ARG  39          2HB       ARG  39   7.994  -4.367  -8.181
  251   2HB   ARG  39          1HB       ARG  39   8.822  -4.968  -6.753
  252   1HG   ARG  39          2HG       ARG  39   7.921  -6.803  -8.037
  253   2HG   ARG  39          1HG       ARG  39   7.095  -6.683  -6.482
  254   1HD   ARG  39          2HD       ARG  39   5.220  -5.556  -7.547
  255   2HD   ARG  39          1HD       ARG  39   6.053  -5.606  -9.100
  256    HE   ARG  39           HE       ARG  39   5.846  -8.219  -8.127
  257   1HH1  ARG  39          1HH1      ARG  39   3.783  -5.666  -9.307
  258   2HH1  ARG  39          2HH1      ARG  39   2.580  -6.751  -9.919
  259   1HH2  ARG  39          1HH2      ARG  39   4.267  -9.647  -8.930
  260   2HH2  ARG  39          2HH2      ARG  39   2.853  -9.012  -9.705
  261    H    ASN  40           H        ASN  40   7.256  -1.518  -7.176
  262    HA   ASN  40           HA       ASN  40   9.101  -0.797  -5.004
  263   1HB   ASN  40          2HB       ASN  40  10.376   0.604  -6.561
  264   2HB   ASN  40          1HB       ASN  40  10.403  -1.089  -7.024
  265   1HD2  ASN  40          1HD2      ASN  40   7.383   0.091  -7.824
  266   2HD2  ASN  40          2HD2      ASN  40   7.696   0.512  -9.461
  267    H    THR  41           H        THR  41   6.093  -0.229  -5.930
  268    HA   THR  41           HA       THR  41   6.091   2.370  -4.702
  269    HB   THR  41           HB       THR  41   4.789   3.428  -6.587
  270    HG1  THR  41           1HG      THR  41   5.976   1.403  -8.159
  271   1HG2  THR  41          1HG2      THR  41   6.681   4.154  -7.812
  272   2HG2  THR  41          2HG2      THR  41   7.607   2.729  -7.342
  273   3HG2  THR  41          3HG2      THR  41   7.174   3.938  -6.133
  274    H    LEU  42           H        LEU  42   3.935   3.249  -4.423
  275    HA   LEU  42           HA       LEU  42   1.756   1.296  -4.536
  276   1HB   LEU  42          2HB       LEU  42   2.809   1.067  -2.334
  277   2HB   LEU  42          1HB       LEU  42   2.626   2.781  -2.051
  278    HG   LEU  42           HG       LEU  42   0.990   1.443  -0.805
  279   1HD1  LEU  42          1HD1      LEU  42   0.529   3.783  -1.872
  280   2HD1  LEU  42          2HD1      LEU  42  -0.789   2.873  -1.130
  281   3HD1  LEU  42          3HD1      LEU  42  -0.602   2.885  -2.884
  282   1HD2  LEU  42          1HD2      LEU  42   0.186  -0.388  -1.804
  283   2HD2  LEU  42          2HD2      LEU  42   0.630   0.193  -3.409
  284   3HD2  LEU  42          3HD2      LEU  42  -0.899   0.689  -2.685
  285    H    ARG  43           H        ARG  43   0.308   2.367  -5.771
  286    HA   ARG  43           HA       ARG  43   0.086   5.255  -5.412
  287   1HB   ARG  43          2HB       ARG  43   0.412   4.201  -7.681
  288   2HB   ARG  43          1HB       ARG  43  -1.217   3.573  -7.546
  289   1HG   ARG  43          2HG       ARG  43  -2.081   5.860  -7.386
  290   2HG   ARG  43          1HG       ARG  43  -0.434   6.480  -7.512
  291   1HD   ARG  43          2HD       ARG  43  -0.210   5.459  -9.720
  292   2HD   ARG  43          1HD       ARG  43  -1.849   4.825  -9.602
  293    HE   ARG  43           HE       ARG  43  -1.915   7.611  -9.251
  294   1HH1  ARG  43          1HH1      ARG  43  -1.329   5.227 -11.734
  295   2HH1  ARG  43          2HH1      ARG  43  -1.835   6.264 -13.024
  296   1HH2  ARG  43          1HH2      ARG  43  -2.579   8.976 -10.951
  297   2HH2  ARG  43          2HH2      ARG  43  -2.548   8.391 -12.582
  298    H    ILE  44           H        ILE  44  -1.631   6.231  -4.599
  299    HA   ILE  44           HA       ILE  44  -3.751   4.565  -3.439
  300    HB   ILE  44           HB       ILE  44  -2.515   7.196  -2.693
  301   1HG1  ILE  44          2HG1      ILE  44  -2.988   4.644  -1.149
  302   2HG1  ILE  44          1HG1      ILE  44  -1.463   5.146  -1.874
  303   1HG2  ILE  44          1HG2      ILE  44  -4.524   6.549  -0.789
  304   2HG2  ILE  44          2HG2      ILE  44  -5.268   6.687  -2.379
  305   3HG2  ILE  44          3HG2      ILE  44  -4.318   8.020  -1.736
  306   1HD1  ILE  44          1HD1      ILE  44  -1.998   7.288  -0.326
  307   2HD1  ILE  44          2HD1      ILE  44  -1.038   5.901   0.193
  308   3HD1  ILE  44          3HD1      ILE  44  -2.747   6.003   0.623
  309    H    GLU  45           H        GLU  45  -5.747   4.630  -4.339
  310    HA   GLU  45           HA       GLU  45  -6.570   7.193  -5.504
  311   1HB   GLU  45          2HB       GLU  45  -6.366   5.780  -7.385
  312   2HB   GLU  45          1HB       GLU  45  -7.140   4.430  -6.568
  313   1HG   GLU  45          2HG       GLU  45  -9.258   5.656  -6.581
  314   2HG   GLU  45          1HG       GLU  45  -8.468   7.003  -7.400
  315    H    MET  46           H        MET  46  -8.419   7.969  -4.932
  316    HA   MET  46           HA       MET  46  -9.948   6.669  -2.804
  317   1HB   MET  46          2HB       MET  46  -9.697   9.528  -3.734
  318   2HB   MET  46          1HB       MET  46 -10.913   9.021  -2.577
  319   1HG   MET  46          2HG       MET  46  -8.936  10.048  -1.543
  320   2HG   MET  46          1HG       MET  46  -9.236   8.408  -0.984
  321   1HE   MET  46          1HE       MET  46  -6.661   9.558  -4.335
  322   2HE   MET  46          2HE       MET  46  -5.847  10.357  -2.993
  323   3HE   MET  46          3HE       MET  46  -7.553  10.676  -3.307
  324    H    ASP  47           H        ASP  47 -12.033   6.098  -3.055
  325    HA   ASP  47           HA       ASP  47 -13.194   5.561  -5.454
  326   1HB   ASP  47          2HB       ASP  47 -14.635   6.312  -2.907
  327   2HB   ASP  47          1HB       ASP  47 -15.358   5.461  -4.269
  328    H    ASP  48           H        ASP  48 -13.119   8.622  -3.835
  329    HA   ASP  48           HA       ASP  48 -15.212   9.907  -5.208
  330   1HB   ASP  48          2HB       ASP  48 -12.691  11.089  -4.028
  331   2HB   ASP  48          1HB       ASP  48 -14.112  12.007  -4.514
  332    H    GLY  49           H        GLY  49 -12.225   8.786  -6.334
  333   1HA   GLY  49          2HA       GLY  49 -11.734   8.773  -8.664
  334   2HA   GLY  49          1HA       GLY  49 -12.580  10.306  -8.818
  335    H    ARG  50           H        ARG  50 -10.407   9.831  -6.176
  336    HA   ARG  50           HA       ARG  50  -8.547  11.743  -7.429
  337   1HB   ARG  50          2HB       ARG  50  -8.968  11.072  -4.514
  338   2HB   ARG  50          1HB       ARG  50  -7.788  12.223  -5.120
  339   1HG   ARG  50          2HG       ARG  50  -9.592  13.598  -6.024
  340   2HG   ARG  50          1HG       ARG  50 -10.776  12.438  -5.419
  341   1HD   ARG  50          2HD       ARG  50 -10.012  12.855  -3.129
  342   2HD   ARG  50          1HD       ARG  50  -8.833  14.018  -3.735
  343    HE   ARG  50           HE       ARG  50 -11.571  14.504  -3.225
  344   1HH1  ARG  50          1HH1      ARG  50  -9.007  15.322  -5.450
  345   2HH1  ARG  50          2HH1      ARG  50  -9.736  16.815  -5.936
  346   1HH2  ARG  50          1HH2      ARG  50 -12.526  16.473  -3.858
  347   2HH2  ARG  50          2HH2      ARG  50 -11.730  17.471  -5.030
  348    H    GLU  51           H        GLU  51  -6.272  11.413  -7.248
  349    HA   GLU  51           HA       GLU  51  -5.447   8.710  -6.484
  350   1HB   GLU  51          2HB       GLU  51  -4.319   8.329  -8.520
  351   2HB   GLU  51          1HB       GLU  51  -5.901   8.955  -8.958
  352   1HG   GLU  51          2HG       GLU  51  -3.341  10.531  -8.917
  353   2HG   GLU  51          1HG       GLU  51  -4.152   9.903 -10.349
  354    H    ILE  52           H        ILE  52  -3.358   8.508  -5.717
  355    HA   ILE  52           HA       ILE  52  -1.484  10.702  -5.835
  356    HB   ILE  52           HB       ILE  52  -2.911  11.424  -3.979
  357   1HG1  ILE  52          2HG1      ILE  52  -0.192  10.431  -3.090
  358   2HG1  ILE  52          1HG1      ILE  52  -0.514  11.954  -3.917
  359   1HG2  ILE  52          1HG2      ILE  52  -3.433  10.159  -2.135
  360   2HG2  ILE  52          2HG2      ILE  52  -2.034   9.101  -2.329
  361   3HG2  ILE  52          3HG2      ILE  52  -3.424   8.929  -3.401
  362   1HD1  ILE  52          1HD1      ILE  52  -1.517  11.193  -1.172
  363   2HD1  ILE  52          2HD1      ILE  52  -1.830  12.718  -1.997
  364   3HD1  ILE  52          3HD1      ILE  52  -0.184  12.297  -1.520
  365    H    THR  53           H        THR  53   0.394   9.720  -6.228
  366    HA   THR  53           HA       THR  53   0.825   6.957  -5.642
  367    HB   THR  53           HB       THR  53   1.743   7.939  -7.657
  368    HG1  THR  53           1HG      THR  53   2.942   6.241  -6.908
  369   1HG2  THR  53          1HG2      THR  53   3.689   9.443  -7.558
  370   2HG2  THR  53          2HG2      THR  53   3.425   9.629  -5.825
  371   3HG2  THR  53          3HG2      THR  53   2.205  10.192  -6.968
  372    H    VAL  54           H        VAL  54   2.323   5.992  -4.290
  373    HA   VAL  54           HA       VAL  54   3.865   7.587  -2.425
  374    HB   VAL  54           HB       VAL  54   1.766   5.671  -1.394
  375   1HG1  VAL  54          1HG1      VAL  54   2.470   6.418   0.823
  376   2HG1  VAL  54          2HG1      VAL  54   3.705   7.445   0.095
  377   3HG1  VAL  54          3HG1      VAL  54   3.820   5.692  -0.052
  378   1HG2  VAL  54          1HG2      VAL  54   0.754   7.701  -0.387
  379   2HG2  VAL  54          2HG2      VAL  54   0.717   7.709  -2.151
  380   3HG2  VAL  54          3HG2      VAL  54   1.907   8.684  -1.288
  381    HA   PRO  55           HA       PRO  55   6.381   3.934  -3.014
  382   1HB   PRO  55          2HB       PRO  55   8.294   4.881  -1.097
  383   2HB   PRO  55          1HB       PRO  55   8.383   4.957  -2.856
  384   1HG   PRO  55          2HG       PRO  55   8.127   7.147  -1.201
  385   2HG   PRO  55          1HG       PRO  55   7.675   7.118  -2.913
  386   1HD   PRO  55          2HD       PRO  55   5.945   6.871  -0.487
  387   2HD   PRO  55          1HD       PRO  55   5.629   7.704  -2.026
  388    H    LYS  56           H        LYS  56   5.594   2.080  -2.118
  389    HA   LYS  56           HA       LYS  56   5.547   1.857   0.807
  390   1HB   LYS  56          2HB       LYS  56   4.008   0.090   0.616
  391   2HB   LYS  56          1HB       LYS  56   3.487   1.288  -0.557
  392   1HG   LYS  56          2HG       LYS  56   4.407  -0.009  -2.366
  393   2HG   LYS  56          1HG       LYS  56   5.122  -1.153  -1.229
  394   1HD   LYS  56          2HD       LYS  56   2.881  -1.774  -0.453
  395   2HD   LYS  56          1HD       LYS  56   2.171  -0.645  -1.606
  396   1HE   LYS  56          2HE       LYS  56   3.894  -3.014  -2.320
  397   2HE   LYS  56          1HE       LYS  56   2.133  -2.978  -2.403
  398   1HZ   LYS  56          1HZ       LYS  56   3.922  -1.165  -3.926
  399   2HZ   LYS  56          2HZ       LYS  56   2.241  -1.279  -4.070
  400   3HZ   LYS  56          3HZ       LYS  56   3.220  -2.569  -4.555
  401    H    GLY  57           H        GLY  57   7.661   1.164  -1.636
  402   1HA   GLY  57          2HA       GLY  57   8.475  -1.443  -1.356
  403   2HA   GLY  57          1HA       GLY  57   9.585  -0.112  -1.651
  404    H    ILE  58           H        ILE  58   8.731   1.086   0.976
  405    HA   ILE  58           HA       ILE  58   9.792  -0.783   2.901
  406    HB   ILE  58           HB       ILE  58  11.008   1.962   2.582
  407   1HG1  ILE  58          2HG1      ILE  58  13.118   0.595   2.058
  408   2HG1  ILE  58          1HG1      ILE  58  12.027  -0.758   1.765
  409   1HG2  ILE  58          1HG2      ILE  58  10.786   0.673   4.874
  410   2HG2  ILE  58          2HG2      ILE  58  12.239   1.583   4.465
  411   3HG2  ILE  58          3HG2      ILE  58  12.211  -0.170   4.270
  412   1HD1  ILE  58          1HD1      ILE  58  11.043   1.455   0.312
  413   2HD1  ILE  58          2HD1      ILE  58  11.734  -0.048  -0.302
  414   3HD1  ILE  58          3HD1      ILE  58  12.778   1.339   0.014
  415    H    ALA  59           H        ALA  59   7.261  -0.280   2.961
  416    HA   ALA  59           HA       ALA  59   6.950   1.625   5.146
  417   1HB   ALA  59          1HB       ALA  59   5.109   2.784   4.151
  418   2HB   ALA  59          2HB       ALA  59   5.132   1.708   2.753
  419   3HB   ALA  59          3HB       ALA  59   6.472   2.825   3.031
  420    H    VAL  60           H        VAL  60   5.981   0.624   6.785
  421    HA   VAL  60           HA       VAL  60   4.357  -1.723   6.397
  422    HB   VAL  60           HB       VAL  60   5.727  -1.523   8.420
  423   1HG1  VAL  60          1HG1      VAL  60   4.878   1.101   8.457
  424   2HG1  VAL  60          2HG1      VAL  60   5.782   0.284   9.732
  425   3HG1  VAL  60          3HG1      VAL  60   4.022   0.375   9.818
  426   1HG2  VAL  60          1HG2      VAL  60   3.829  -2.949   8.620
  427   2HG2  VAL  60          2HG2      VAL  60   2.744  -1.579   8.861
  428   3HG2  VAL  60          3HG2      VAL  60   3.921  -2.003  10.105
  429    H    PHE  61           H        PHE  61   2.126  -1.855   6.410
  430    HA   PHE  61           HA       PHE  61   0.571   0.447   7.219
  431   1HB   PHE  61          2HB       PHE  61  -0.573   0.655   5.023
  432   2HB   PHE  61          1HB       PHE  61   1.125   1.113   4.973
  433    HD1  PHE  61           1HD      PHE  61  -1.006  -1.910   4.447
  434    HD2  PHE  61           2HD      PHE  61   2.383   0.354   3.225
  435    HE1  PHE  61           1HE      PHE  61  -0.629  -3.481   2.594
  436    HE2  PHE  61           2HE      PHE  61   2.764  -1.212   1.370
  437    HZ   PHE  61           HZ       PHE  61   1.256  -3.132   1.050
  438    H    HIS  62           H        HIS  62  -1.741   0.076   7.123
  439    HA   HIS  62           HA       HIS  62  -2.431  -2.787   7.213
  440   1HB   HIS  62          2HB       HIS  62  -3.510  -0.586   8.990
  441   2HB   HIS  62          1HB       HIS  62  -3.956  -2.287   9.063
  442    HD1  HIS  62           1HD      HIS  62  -1.594  -3.856   9.414
  443    HD2  HIS  62           2HD      HIS  62  -1.730   0.019  10.905
  444    HE1  HIS  62           1HE      HIS  62   0.189  -3.753  11.184
  445    HE2  HIS  62           2HE      HIS  62   0.142  -1.377  12.016
  446    H    PHE  63           H        PHE  63  -4.074  -3.371   5.930
  447    HA   PHE  63           HA       PHE  63  -5.535  -1.283   4.511
  448   1HB   PHE  63          2HB       PHE  63  -5.080  -4.209   4.051
  449   2HB   PHE  63          1HB       PHE  63  -6.423  -3.399   3.255
  450    HD1  PHE  63           1HD      PHE  63  -5.548  -3.814   1.058
  451    HD2  PHE  63           2HD      PHE  63  -3.273  -1.647   3.928
  452    HE1  PHE  63           1HE      PHE  63  -4.045  -3.041  -0.726
  453    HE2  PHE  63           2HE      PHE  63  -1.765  -0.869   2.145
  454    HZ   PHE  63           HZ       PHE  63  -2.149  -1.566  -0.184
  455    H    ARG  64           H        ARG  64  -7.538  -0.717   4.961
  456    HA   ARG  64           HA       ARG  64  -9.103  -2.403   6.790
  457   1HB   ARG  64          2HB       ARG  64  -9.139   0.549   6.205
  458   2HB   ARG  64          1HB       ARG  64 -10.487  -0.240   7.010
  459   1HG   ARG  64          2HG       ARG  64  -7.647  -0.255   8.005
  460   2HG   ARG  64          1HG       ARG  64  -8.915   0.836   8.568
  461   1HD   ARG  64          2HD       ARG  64 -10.254  -1.238   9.140
  462   2HD   ARG  64          1HD       ARG  64  -8.776  -2.156   8.853
  463    HE   ARG  64           HE       ARG  64  -8.088  -1.526  10.925
  464   1HH1  ARG  64          1HH1      ARG  64 -10.390   0.843   9.793
  465   2HH1  ARG  64          2HH1      ARG  64 -10.333   1.776  11.249
  466   1HH2  ARG  64          1HH2      ARG  64  -8.019  -0.301  12.844
  467   2HH2  ARG  64          2HH2      ARG  64  -8.988   1.128  12.980
  468    H    THR  65           H        THR  65 -10.651  -3.593   5.887
  469    HA   THR  65           HA       THR  65 -11.624  -2.987   3.233
  470    HB   THR  65           HB       THR  65 -12.456  -5.185   5.134
  471    HG1  THR  65           1HG      THR  65 -10.613  -5.250   2.980
  472   1HG2  THR  65          1HG2      THR  65 -13.921  -4.535   3.067
  473   2HG2  THR  65          2HG2      THR  65 -13.584  -6.224   3.448
  474   3HG2  THR  65          3HG2      THR  65 -12.669  -5.405   2.181
  475    HA   PRO  66           HA       PRO  66 -15.109  -0.463   4.233
  476   1HB   PRO  66          2HB       PRO  66 -16.902  -1.775   2.484
  477   2HB   PRO  66          1HB       PRO  66 -15.939  -0.338   2.136
  478   1HG   PRO  66          2HG       PRO  66 -15.405  -3.186   1.469
  479   2HG   PRO  66          1HG       PRO  66 -14.977  -1.717   0.571
  480   1HD   PRO  66          2HD       PRO  66 -13.133  -3.092   1.931
  481   2HD   PRO  66          1HD       PRO  66 -13.100  -1.316   1.884
  482    H    GLN  67           H        GLN  67 -15.601  -3.968   3.999
  483    HA   GLN  67           HA       GLN  67 -18.016  -4.078   5.431
  484   1HB   GLN  67          2HB       GLN  67 -15.843  -6.167   5.202
  485   2HB   GLN  67          1HB       GLN  67 -17.478  -6.464   5.776
  486   1HG   GLN  67          2HG       GLN  67 -16.716  -5.533   3.017
  487   2HG   GLN  67          1HG       GLN  67 -17.198  -7.168   3.466
  488   1HE2  GLN  67          1HE2      GLN  67 -19.206  -7.633   2.979
  489   2HE2  GLN  67          2HE2      GLN  67 -20.534  -6.529   2.932
  490    H    GLY  68           H        GLY  68 -14.848  -3.393   6.475
  491   1HA   GLY  68          2HA       GLY  68 -14.488  -2.500   8.668
  492   2HA   GLY  68          1HA       GLY  68 -15.743  -3.574   9.268
  493    H    GLU  69           H        GLU  69 -12.867  -4.169   7.255
  494    HA   GLU  69           HA       GLU  69 -12.039  -6.176   9.257
  495   1HB   GLU  69          2HB       GLU  69 -11.395  -6.147   6.305
  496   2HB   GLU  69          1HB       GLU  69 -10.951  -7.399   7.454
  497   1HG   GLU  69          2HG       GLU  69 -13.751  -6.664   6.631
  498   2HG   GLU  69          1HG       GLU  69 -12.847  -8.082   6.104
  499    H    LEU  70           H        LEU  70  -9.756  -6.487   9.582
  500    HA   LEU  70           HA       LEU  70  -8.150  -4.107   8.925
  501   1HB   LEU  70          2HB       LEU  70  -8.772  -4.007  11.256
  502   2HB   LEU  70          1HB       LEU  70  -8.239  -5.656  11.512
  503    HG   LEU  70           HG       LEU  70  -6.710  -3.860  12.400
  504   1HD1  LEU  70          1HD1      LEU  70  -6.124  -6.303  11.549
  505   2HD1  LEU  70          2HD1      LEU  70  -4.881  -5.190  12.119
  506   3HD1  LEU  70          3HD1      LEU  70  -5.155  -5.394  10.389
  507   1HD2  LEU  70          1HD2      LEU  70  -7.034  -2.777   9.862
  508   2HD2  LEU  70          2HD2      LEU  70  -5.392  -3.420   9.857
  509   3HD2  LEU  70          3HD2      LEU  70  -5.880  -2.258  11.090
  510    H    VAL  71           H        VAL  71  -6.694  -4.724   7.479
  511    HA   VAL  71           HA       VAL  71  -5.396  -7.347   7.797
  512    HB   VAL  71           HB       VAL  71  -5.504  -5.598   5.334
  513   1HG1  VAL  71          1HG1      VAL  71  -4.429  -8.380   5.769
  514   2HG1  VAL  71          2HG1      VAL  71  -3.510  -6.938   5.337
  515   3HG1  VAL  71          3HG1      VAL  71  -4.655  -7.632   4.188
  516   1HG2  VAL  71          1HG2      VAL  71  -7.701  -6.464   5.817
  517   2HG2  VAL  71          2HG2      VAL  71  -7.050  -8.087   6.044
  518   3HG2  VAL  71          3HG2      VAL  71  -7.020  -7.342   4.446
  519    H    GLU  72           H        GLU  72  -3.084  -7.473   7.404
  520    HA   GLU  72           HA       GLU  72  -1.672  -4.922   7.777
  521   1HB   GLU  72          2HB       GLU  72  -1.840  -5.976   9.960
  522   2HB   GLU  72          1HB       GLU  72  -1.188  -7.476   9.317
  523   1HG   GLU  72          2HG       GLU  72   0.937  -6.374   8.871
  524   2HG   GLU  72          1HG       GLU  72   0.284  -4.855   9.481
  525    H    ILE  73           H        ILE  73   0.146  -4.658   6.626
  526    HA   ILE  73           HA       ILE  73   1.525  -6.946   5.482
  527    HB   ILE  73           HB       ILE  73   0.394  -4.770   3.719
  528   1HG1  ILE  73          2HG1      ILE  73  -0.256  -7.720   3.883
  529   2HG1  ILE  73          1HG1      ILE  73  -1.304  -6.401   4.400
  530   1HG2  ILE  73          1HG2      ILE  73   1.385  -5.989   1.868
  531   2HG2  ILE  73          2HG2      ILE  73   2.045  -7.184   2.986
  532   3HG2  ILE  73          3HG2      ILE  73   2.627  -5.520   3.028
  533   1HD1  ILE  73          1HD1      ILE  73  -1.455  -5.614   2.095
  534   2HD1  ILE  73          2HD1      ILE  73  -1.984  -7.290   2.237
  535   3HD1  ILE  73          3HD1      ILE  73  -0.391  -6.921   1.576
  536    H    ASP  74           H        ASP  74   3.598  -6.596   5.890
  537    HA   ASP  74           HA       ASP  74   4.552  -3.975   6.550
  538   1HB   ASP  74          2HB       ASP  74   6.762  -5.187   6.828
  539   2HB   ASP  74          1HB       ASP  74   5.440  -5.737   7.852
  540    H    GLY  75           H        GLY  75   4.680  -2.604   4.870
  541   1HA   GLY  75          2HA       GLY  75   5.500  -3.267   2.257
  542   2HA   GLY  75          1HA       GLY  75   5.439  -1.647   2.927
  543    H    ARG  76           H        ARG  76   7.326  -2.955   5.104
  544    HA   ARG  76           HA       ARG  76   9.737  -2.277   3.651
  545   1HB   ARG  76          2HB       ARG  76   9.333  -1.013   5.695
  546   2HB   ARG  76          1HB       ARG  76   9.250  -2.502   6.616
  547   1HG   ARG  76          2HG       ARG  76  11.720  -1.930   5.065
  548   2HG   ARG  76          1HG       ARG  76  11.428  -1.029   6.551
  549   1HD   ARG  76          2HD       ARG  76  11.348  -4.039   6.418
  550   2HD   ARG  76          1HD       ARG  76  12.818  -3.135   6.759
  551    HE   ARG  76           HE       ARG  76  11.990  -2.591   8.849
  552   1HH1  ARG  76          1HH1      ARG  76   9.583  -4.350   7.031
  553   2HH1  ARG  76          2HH1      ARG  76   8.515  -4.523   8.380
  554   1HH2  ARG  76          1HH2      ARG  76  10.589  -2.827  10.619
  555   2HH2  ARG  76          2HH2      ARG  76   9.084  -3.661  10.415
  556    H    ALA  77           H        ALA  77   8.201  -4.891   5.299
  557    HA   ALA  77           HA       ALA  77  10.571  -6.552   5.012
  558   1HB   ALA  77          1HB       ALA  77   8.723  -8.113   6.296
  559   2HB   ALA  77          2HB       ALA  77   8.345  -6.492   6.881
  560   3HB   ALA  77          3HB       ALA  77   9.971  -7.142   7.076
  561    H    LEU  78           H        LEU  78   7.921  -5.805   3.199
  562    HA   LEU  78           HA       LEU  78   7.789  -8.513   2.043
  563   1HB   LEU  78          2HB       LEU  78   5.691  -7.305   3.095
  564   2HB   LEU  78          1HB       LEU  78   5.660  -6.476   1.553
  565    HG   LEU  78           HG       LEU  78   4.140  -8.348   1.487
  566   1HD1  LEU  78          1HD1      LEU  78   6.629  -8.908  -0.115
  567   2HD1  LEU  78          2HD1      LEU  78   5.292  -7.857  -0.585
  568   3HD1  LEU  78          3HD1      LEU  78   5.035  -9.595  -0.427
  569   1HD2  LEU  78          1HD2      LEU  78   4.936 -10.655   1.751
  570   2HD2  LEU  78          2HD2      LEU  78   5.116  -9.715   3.232
  571   3HD2  LEU  78          3HD2      LEU  78   6.523 -10.042   2.220
  572    H    VAL  79           H        VAL  79   9.838  -6.736   1.362
  573    HA   VAL  79           HA       VAL  79   9.154  -5.359  -1.054
  574    HB   VAL  79           HB       VAL  79  11.899  -6.014   0.014
  575   1HG1  VAL  79          1HG1      VAL  79  11.514  -3.581  -1.563
  576   2HG1  VAL  79          2HG1      VAL  79  11.218  -5.068  -2.463
  577   3HG1  VAL  79          3HG1      VAL  79  12.770  -4.815  -1.664
  578   1HG2  VAL  79          1HG2      VAL  79   9.912  -3.966   0.767
  579   2HG2  VAL  79          2HG2      VAL  79  11.574  -3.408   0.576
  580   3HG2  VAL  79          3HG2      VAL  79  11.202  -4.701   1.718
  581    H    ALA  80           H        ALA  80   8.491  -6.677  -2.672
  582    HA   ALA  80           HA       ALA  80  10.222  -8.947  -3.390
  583   1HB   ALA  80          1HB       ALA  80   7.311  -8.535  -3.457
  584   2HB   ALA  80          2HB       ALA  80   8.246 -10.017  -3.261
  585   3HB   ALA  80          3HB       ALA  80   7.990  -9.343  -4.870
  586    H    ARG  81           H        ARG  81  11.402  -8.801  -5.192
  587    HA   ARG  81           HA       ARG  81  10.950  -6.530  -6.966
  588   1HB   ARG  81          2HB       ARG  81  13.257  -8.428  -6.592
  589   2HB   ARG  81          1HB       ARG  81  13.173  -7.335  -7.965
  590   1HG   ARG  81          2HG       ARG  81  14.553  -6.444  -6.158
  591   2HG   ARG  81          1HG       ARG  81  13.151  -5.423  -6.485
  592   1HD   ARG  81          2HD       ARG  81  11.990  -6.373  -4.566
  593   2HD   ARG  81          1HD       ARG  81  13.348  -7.457  -4.262
  594    HE   ARG  81           HE       ARG  81  14.340  -5.751  -3.137
  595   1HH1  ARG  81          1HH1      ARG  81  12.059  -4.361  -5.386
  596   2HH1  ARG  81          2HH1      ARG  81  12.400  -2.730  -4.915
  597   1HH2  ARG  81          1HH2      ARG  81  14.780  -3.606  -2.512
  598   2HH2  ARG  81          2HH2      ARG  81  13.942  -2.302  -3.284
  599    HA   PRO  82           HA       PRO  82   8.925  -8.794 -10.168
  600   1HB   PRO  82          2HB       PRO  82  10.148  -7.506 -12.327
  601   2HB   PRO  82          1HB       PRO  82   8.678  -6.980 -11.503
  602   1HG   PRO  82          2HG       PRO  82  11.483  -6.037 -11.160
  603   2HG   PRO  82          1HG       PRO  82   9.969  -5.121 -11.077
  604   1HD   PRO  82          2HD       PRO  82  11.331  -5.800  -8.869
  605   2HD   PRO  82          1HD       PRO  82   9.555  -5.771  -8.894
  606    H    GLU  83           H        GLU  83   9.868  -9.439 -12.649
  607    HA   GLU  83           HA       GLU  83  11.740 -11.548 -12.002
  608   1HB   GLU  83          2HB       GLU  83  10.247 -10.914 -14.548
  609   2HB   GLU  83          1HB       GLU  83  11.283 -12.316 -14.328
  610   1HG   GLU  83          2HG       GLU  83   8.986 -12.954 -14.050
  611   2HG   GLU  83          1HG       GLU  83   9.825 -13.084 -12.506
  612    H    GLU  84           H        GLU  84  12.181  -8.405 -12.903
  613    HA   GLU  84           HA       GLU  84  14.267  -8.824 -14.855
  614   1HB   GLU  84          2HB       GLU  84  14.602  -6.393 -14.709
  615   2HB   GLU  84          1HB       GLU  84  12.912  -6.801 -14.973
  616   1HG   GLU  84          2HG       GLU  84  12.451  -6.451 -12.610
  617   2HG   GLU  84          1HG       GLU  84  14.145  -6.053 -12.331
  618    H    ARG  85           H        ARG  85  14.061  -7.986 -11.426
  619    HA   ARG  85           HA       ARG  85  16.902  -8.692 -11.165
  620   1HB   ARG  85          2HB       ARG  85  16.657  -6.231 -11.096
  621   2HB   ARG  85          1HB       ARG  85  15.528  -6.393  -9.759
  622   1HG   ARG  85          2HG       ARG  85  17.591  -5.795  -8.805
  623   2HG   ARG  85          1HG       ARG  85  17.391  -7.516  -8.481
  624   1HD   ARG  85          2HD       ARG  85  18.999  -6.382 -10.765
  625   2HD   ARG  85          1HD       ARG  85  19.682  -6.882  -9.221
  626    HE   ARG  85           HE       ARG  85  19.008  -8.563 -11.391
  627   1HH1  ARG  85          1HH1      ARG  85  18.995  -8.445  -7.903
  628   2HH1  ARG  85          2HH1      ARG  85  19.070 -10.165  -7.721
  629   1HH2  ARG  85          1HH2      ARG  85  19.113 -10.824 -11.154
  630   2HH2  ARG  85          2HH2      ARG  85  19.141 -11.516  -9.567
  631    H    ILE  86           H        ILE  86  16.476 -10.708 -10.304
  632    HA   ILE  86           HA       ILE  86  14.838 -10.805  -7.864
  633    HB   ILE  86           HB       ILE  86  15.792 -13.106  -9.577
  634   1HG1  ILE  86          2HG1      ILE  86  13.346 -13.285 -10.164
  635   2HG1  ILE  86          1HG1      ILE  86  13.112 -11.716  -9.402
  636   1HG2  ILE  86          1HG2      ILE  86  15.504 -13.908  -7.377
  637   2HG2  ILE  86          2HG2      ILE  86  14.035 -14.351  -8.245
  638   3HG2  ILE  86          3HG2      ILE  86  14.029 -12.971  -7.147
  639   1HD1  ILE  86          1HD1      ILE  86  13.925 -10.616 -11.163
  640   2HD1  ILE  86          2HD1      ILE  86  13.634 -12.122 -12.034
  641   3HD1  ILE  86          3HD1      ILE  86  15.241 -11.767 -11.402
  Start of MODEL   16
    1    H    ARG   9           H        ARG   9 -17.275  -9.347  -6.014
    2    HA   ARG   9           HA       ARG   9 -15.471 -10.541  -5.313
    3   1HB   ARG   9          2HB       ARG   9 -14.751 -10.511  -8.251
    4   2HB   ARG   9          1HB       ARG   9 -14.039 -11.565  -7.037
    5   1HG   ARG   9          2HG       ARG   9 -16.930 -11.543  -7.880
    6   2HG   ARG   9          1HG       ARG   9 -15.717 -12.734  -8.351
    7   1HD   ARG   9          2HD       ARG   9 -15.439 -13.370  -5.999
    8   2HD   ARG   9          1HD       ARG   9 -16.654 -12.180  -5.535
    9    HE   ARG   9           HE       ARG   9 -18.242 -13.715  -6.070
   10   1HH1  ARG   9          1HH1      ARG   9 -15.335 -14.528  -7.823
   11   2HH1  ARG   9          2HH1      ARG   9 -16.022 -15.938  -8.556
   12   1HH2  ARG   9          1HH2      ARG   9 -19.144 -15.571  -7.030
   13   2HH2  ARG   9          2HH2      ARG   9 -18.182 -16.531  -8.105
   14    H    HIS  10           H        HIS  10 -14.330  -9.178  -4.046
   15    HA   HIS  10           HA       HIS  10 -12.306  -7.482  -5.355
   16   1HB   HIS  10          2HB       HIS  10 -12.385  -6.050  -3.362
   17   2HB   HIS  10          1HB       HIS  10 -13.970  -6.179  -4.116
   18    HD1  HIS  10           1HD      HIS  10 -14.357  -5.295  -1.442
   19    HD2  HIS  10           2HD      HIS  10 -13.637  -9.322  -2.174
   20    HE1  HIS  10           1HE      HIS  10 -15.213  -6.511   0.587
   21    HE2  HIS  10           2HE      HIS  10 -14.849  -8.952   0.081
   22    H    GLU  11           H        GLU  11 -10.584  -6.922  -3.428
   23    HA   GLU  11           HA       GLU  11  -9.854  -9.037  -1.711
   24   1HB   GLU  11          2HB       GLU  11  -7.904  -9.915  -2.884
   25   2HB   GLU  11          1HB       GLU  11  -9.366 -10.202  -3.817
   26   1HG   GLU  11          2HG       GLU  11  -7.386  -7.990  -4.316
   27   2HG   GLU  11          1HG       GLU  11  -7.479  -9.504  -5.212
   28    H    LEU  12           H        LEU  12  -8.678  -6.378  -3.726
   29    HA   LEU  12           HA       LEU  12  -7.227  -5.356  -1.385
   30   1HB   LEU  12          2HB       LEU  12  -5.597  -6.381  -2.883
   31   2HB   LEU  12          1HB       LEU  12  -6.201  -5.425  -4.223
   32    HG   LEU  12           HG       LEU  12  -5.445  -3.369  -3.076
   33   1HD1  LEU  12          1HD1      LEU  12  -4.709  -3.318  -0.973
   34   2HD1  LEU  12          2HD1      LEU  12  -3.688  -4.737  -1.204
   35   3HD1  LEU  12          3HD1      LEU  12  -5.397  -4.933  -0.814
   36   1HD2  LEU  12          1HD2      LEU  12  -4.017  -4.525  -4.715
   37   2HD2  LEU  12          2HD2      LEU  12  -3.273  -5.436  -3.401
   38   3HD2  LEU  12          3HD2      LEU  12  -3.080  -3.684  -3.480
   39    H    ILE  13           H        ILE  13  -8.529  -4.598  -4.599
   40    HA   ILE  13           HA       ILE  13  -8.545  -1.770  -4.135
   41    HB   ILE  13           HB       ILE  13 -10.005  -3.359  -6.252
   42   1HG1  ILE  13          2HG1      ILE  13  -7.588  -3.723  -6.355
   43   2HG1  ILE  13          1HG1      ILE  13  -8.120  -2.736  -7.713
   44   1HG2  ILE  13          1HG2      ILE  13 -10.182  -1.286  -7.465
   45   2HG2  ILE  13          2HG2      ILE  13  -9.280  -0.433  -6.214
   46   3HG2  ILE  13          3HG2      ILE  13 -10.884  -1.077  -5.861
   47   1HD1  ILE  13          1HD1      ILE  13  -7.281  -0.749  -6.652
   48   2HD1  ILE  13          2HD1      ILE  13  -6.009  -1.967  -6.712
   49   3HD1  ILE  13          3HD1      ILE  13  -6.864  -1.658  -5.200
   50    H    GLY  14           H        GLY  14 -10.126  -0.512  -3.324
   51   1HA   GLY  14          2HA       GLY  14 -12.548  -0.103  -3.127
   52   2HA   GLY  14          1HA       GLY  14 -12.714  -1.804  -2.716
   53    H    LEU  15           H        LEU  15 -10.229  -1.646  -1.049
   54    HA   LEU  15           HA       LEU  15 -11.533  -0.549   1.329
   55   1HB   LEU  15          2HB       LEU  15  -9.732  -1.845   2.543
   56   2HB   LEU  15          1HB       LEU  15 -10.919  -2.791   1.668
   57    HG   LEU  15           HG       LEU  15  -9.312  -3.137  -0.155
   58   1HD1  LEU  15          1HD1      LEU  15  -7.590  -1.379   1.551
   59   2HD1  LEU  15          2HD1      LEU  15  -7.928  -1.270  -0.177
   60   3HD1  LEU  15          3HD1      LEU  15  -6.882  -2.550   0.438
   61   1HD2  LEU  15          1HD2      LEU  15  -8.454  -3.883   2.626
   62   2HD2  LEU  15          2HD2      LEU  15  -7.653  -4.501   1.181
   63   3HD2  LEU  15          3HD2      LEU  15  -9.358  -4.852   1.462
   64    H    SER  16           H        SER  16 -10.063   0.440   2.994
   65    HA   SER  16           HA       SER  16  -8.391   2.438   1.666
   66   1HB   SER  16          2HB       SER  16 -10.143   3.272   3.158
   67   2HB   SER  16          1HB       SER  16  -9.473   2.335   4.494
   68    HG   SER  16           HG       SER  16  -8.671   4.741   3.466
   69    H    VAL  17           H        VAL  17  -6.345   3.084   2.632
   70    HA   VAL  17           HA       VAL  17  -5.025   0.966   4.179
   71    HB   VAL  17           HB       VAL  17  -4.402   0.613   1.852
   72   1HG1  VAL  17          1HG1      VAL  17  -3.055   2.373   0.678
   73   2HG1  VAL  17          2HG1      VAL  17  -3.561   3.502   1.934
   74   3HG1  VAL  17          3HG1      VAL  17  -4.765   2.754   0.884
   75   1HG2  VAL  17          1HG2      VAL  17  -2.477  -0.045   2.752
   76   2HG2  VAL  17          2HG2      VAL  17  -2.539   1.235   3.964
   77   3HG2  VAL  17          3HG2      VAL  17  -1.825   1.551   2.383
   78    H    ARG  18           H        ARG  18  -3.781   1.690   5.805
   79    HA   ARG  18           HA       ARG  18  -3.314   4.593   5.964
   80   1HB   ARG  18          2HB       ARG  18  -3.593   2.577   8.199
   81   2HB   ARG  18          1HB       ARG  18  -3.265   4.292   8.414
   82   1HG   ARG  18          2HG       ARG  18  -5.420   4.835   7.401
   83   2HG   ARG  18          1HG       ARG  18  -5.749   3.115   7.184
   84   1HD   ARG  18          2HD       ARG  18  -5.640   2.789   9.606
   85   2HD   ARG  18          1HD       ARG  18  -5.303   4.506   9.824
   86    HE   ARG  18           HE       ARG  18  -7.689   4.245   8.385
   87   1HH1  ARG  18          1HH1      ARG  18  -6.435   3.612  11.579
   88   2HH1  ARG  18          2HH1      ARG  18  -7.968   3.816  12.358
   89   1HH2  ARG  18          1HH2      ARG  18  -9.707   4.516   9.407
   90   2HH2  ARG  18          2HH2      ARG  18  -9.825   4.329  11.126
   91    H    ILE  19           H        ILE  19  -1.290   5.345   6.193
   92    HA   ILE  19           HA       ILE  19   0.887   3.402   6.121
   93    HB   ILE  19           HB       ILE  19   0.992   6.404   5.783
   94   1HG1  ILE  19          2HG1      ILE  19  -0.328   5.348   4.011
   95   2HG1  ILE  19          1HG1      ILE  19   1.213   5.928   3.380
   96   1HG2  ILE  19          1HG2      ILE  19   3.039   4.230   5.493
   97   2HG2  ILE  19          2HG2      ILE  19   3.140   5.732   6.410
   98   3HG2  ILE  19          3HG2      ILE  19   3.200   5.770   4.649
   99   1HD1  ILE  19          1HD1      ILE  19   2.057   3.539   3.719
  100   2HD1  ILE  19          2HD1      ILE  19   0.915   3.815   2.402
  101   3HD1  ILE  19          3HD1      ILE  19   0.361   3.097   3.914
  102    H    ALA  20           H        ALA  20   2.193   2.999   7.797
  103    HA   ALA  20           HA       ALA  20   1.886   4.651  10.203
  104   1HB   ALA  20          1HB       ALA  20   1.611   1.967   9.963
  105   2HB   ALA  20          2HB       ALA  20   2.029   2.795  11.463
  106   3HB   ALA  20          3HB       ALA  20   3.299   2.092  10.460
  107    H    ARG  21           H        ARG  21   4.200   3.385   7.946
  108    HA   ARG  21           HA       ARG  21   6.138   5.340   8.725
  109   1HB   ARG  21          2HB       ARG  21   6.795   2.407   9.050
  110   2HB   ARG  21          1HB       ARG  21   7.960   3.719   9.147
  111   1HG   ARG  21          2HG       ARG  21   6.769   4.617  11.095
  112   2HG   ARG  21          1HG       ARG  21   5.635   3.267  11.008
  113   1HD   ARG  21          2HD       ARG  21   7.352   2.843  12.684
  114   2HD   ARG  21          1HD       ARG  21   7.481   1.695  11.352
  115    HE   ARG  21           HE       ARG  21   9.177   3.858  10.826
  116   1HH1  ARG  21          1HH1      ARG  21   8.887   1.192  13.061
  117   2HH1  ARG  21          2HH1      ARG  21  10.593   1.069  13.331
  118   1HH2  ARG  21          1HH2      ARG  21  11.421   3.697  11.180
  119   2HH2  ARG  21          2HH2      ARG  21  12.031   2.491  12.262
  120    H    SER  22           H        SER  22   7.376   5.925   7.014
  121    HA   SER  22           HA       SER  22   7.565   4.097   4.733
  122   1HB   SER  22          2HB       SER  22   5.652   5.552   4.258
  123   2HB   SER  22          1HB       SER  22   6.654   6.976   4.534
  124    HG   SER  22           HG       SER  22   7.103   5.017   2.529
  125    H    VAL  23           H        VAL  23   9.183   4.802   3.127
  126    HA   VAL  23           HA       VAL  23  11.647   5.371   4.326
  127    HB   VAL  23           HB       VAL  23  11.511   4.154   2.227
  128   1HG1  VAL  23          1HG1      VAL  23  10.916   5.196   0.139
  129   2HG1  VAL  23          2HG1      VAL  23  10.696   6.755   0.934
  130   3HG1  VAL  23          3HG1      VAL  23   9.595   5.421   1.287
  131   1HG2  VAL  23          1HG2      VAL  23  13.352   5.173   1.068
  132   2HG2  VAL  23          2HG2      VAL  23  13.572   5.430   2.798
  133   3HG2  VAL  23          3HG2      VAL  23  12.987   6.745   1.780
  134    H    HIS  24           H        HIS  24   9.492   7.441   2.404
  135    HA   HIS  24           HA       HIS  24  11.164   9.757   3.050
  136   1HB   HIS  24          2HB       HIS  24   8.840   9.492   1.130
  137   2HB   HIS  24          1HB       HIS  24   9.808  10.945   1.361
  138    HD1  HIS  24           1HD      HIS  24  12.576  10.259   1.028
  139    HD2  HIS  24           2HD      HIS  24   9.655   8.178  -1.071
  140    HE1  HIS  24           1HE      HIS  24  13.766   9.218  -0.926
  141    HE2  HIS  24           2HE      HIS  24  11.995   7.896  -2.137
  142    H    ARG  25           H        ARG  25  10.488  11.403   4.325
  143    HA   ARG  25           HA       ARG  25   8.294  10.916   6.083
  144   1HB   ARG  25          2HB       ARG  25  10.147  13.273   5.757
  145   2HB   ARG  25          1HB       ARG  25   8.888  13.203   6.980
  146   1HG   ARG  25          2HG       ARG  25  11.031  12.598   7.925
  147   2HG   ARG  25          1HG       ARG  25   9.936  11.218   7.947
  148   1HD   ARG  25          2HD       ARG  25  11.024  10.269   6.013
  149   2HD   ARG  25          1HD       ARG  25  12.050  11.694   5.848
  150    HE   ARG  25           HE       ARG  25  12.516   9.462   7.517
  151   1HH1  ARG  25          1HH1      ARG  25  12.852  12.935   7.440
  152   2HH1  ARG  25          2HH1      ARG  25  14.142  12.960   8.595
  153   1HH2  ARG  25          1HH2      ARG  25  14.214   9.494   9.032
  154   2HH2  ARG  25          2HH2      ARG  25  14.916  11.007   9.496
  155    H    ASP  26           H        ASP  26   8.406  12.200   2.993
  156    HA   ASP  26           HA       ASP  26   6.439  14.240   3.312
  157   1HB   ASP  26          2HB       ASP  26   6.402  14.266   0.826
  158   2HB   ASP  26          1HB       ASP  26   8.015  14.447   1.504
  159    H    ILE  27           H        ILE  27   6.255  10.857   3.182
  160    HA   ILE  27           HA       ILE  27   3.384  11.056   2.763
  161    HB   ILE  27           HB       ILE  27   3.207   9.226   1.318
  162   1HG1  ILE  27          2HG1      ILE  27   4.822   7.737   2.475
  163   2HG1  ILE  27          1HG1      ILE  27   5.001   7.699   0.726
  164   1HG2  ILE  27          1HG2      ILE  27   5.705  10.284   0.133
  165   2HG2  ILE  27          2HG2      ILE  27   4.422  11.436   0.502
  166   3HG2  ILE  27          3HG2      ILE  27   4.104  10.081  -0.580
  167   1HD1  ILE  27          1HD1      ILE  27   6.734   9.689   1.830
  168   2HD1  ILE  27          2HD1      ILE  27   7.136   8.255   0.893
  169   3HD1  ILE  27          3HD1      ILE  27   6.983   8.150   2.647
  170    H    GLN  28           H        GLN  28   5.529  10.485   4.980
  171    HA   GLN  28           HA       GLN  28   4.760   7.906   5.948
  172   1HB   GLN  28          2HB       GLN  28   7.006   8.879   6.345
  173   2HB   GLN  28          1HB       GLN  28   6.269  10.116   7.351
  174   1HG   GLN  28          2HG       GLN  28   6.105   7.169   7.926
  175   2HG   GLN  28          1HG       GLN  28   7.330   8.242   8.598
  176   1HE2  GLN  28          1HE2      GLN  28   4.561   6.740   9.307
  177   2HE2  GLN  28          2HE2      GLN  28   3.905   7.824  10.482
  178    H    GLY  29           H        GLY  29   3.284   7.400   7.491
  179   1HA   GLY  29          2HA       GLY  29   1.569   7.650   9.003
  180   2HA   GLY  29          1HA       GLY  29   2.157   9.279   9.299
  181    H    ILE  30           H        ILE  30   1.434   8.544   6.031
  182    HA   ILE  30           HA       ILE  30  -0.913  10.250   6.190
  183    HB   ILE  30           HB       ILE  30   0.647   9.381   3.758
  184   1HG1  ILE  30          2HG1      ILE  30   1.966  10.832   5.222
  185   2HG1  ILE  30          1HG1      ILE  30   1.509  11.688   3.751
  186   1HG2  ILE  30          1HG2      ILE  30  -1.739  11.143   4.141
  187   2HG2  ILE  30          2HG2      ILE  30  -1.457   9.886   2.936
  188   3HG2  ILE  30          3HG2      ILE  30  -0.622  11.434   2.808
  189   1HD1  ILE  30          1HD1      ILE  30   0.178  11.964   6.441
  190   2HD1  ILE  30          2HD1      ILE  30  -0.283  12.821   4.971
  191   3HD1  ILE  30          3HD1      ILE  30   1.292  13.117   5.708
  192    H    SER  31           H        SER  31  -2.895   9.427   6.027
  193    HA   SER  31           HA       SER  31  -3.209   6.631   5.250
  194   1HB   SER  31          2HB       SER  31  -4.281   7.335   7.331
  195   2HB   SER  31          1HB       SER  31  -5.178   8.585   6.469
  196    HG   SER  31           HG       SER  31  -5.386   5.877   5.713
  197    H    GLY  32           H        GLY  32  -4.935   5.989   3.776
  198   1HA   GLY  32          2HA       GLY  32  -6.355   7.784   2.157
  199   2HA   GLY  32          1HA       GLY  32  -4.844   7.400   1.346
  200    H    ARG  33           H        ARG  33  -6.258   6.499  -0.310
  201    HA   ARG  33           HA       ARG  33  -7.160   3.821   0.429
  202   1HB   ARG  33          2HB       ARG  33  -8.384   5.715  -1.520
  203   2HB   ARG  33          1HB       ARG  33  -8.703   3.988  -1.583
  204   1HG   ARG  33          2HG       ARG  33  -9.335   4.132   0.843
  205   2HG   ARG  33          1HG       ARG  33  -9.309   5.885   0.659
  206   1HD   ARG  33          2HD       ARG  33 -11.046   5.765  -1.020
  207   2HD   ARG  33          1HD       ARG  33 -11.004   4.005  -0.986
  208    HE   ARG  33           HE       ARG  33 -12.416   4.093   0.793
  209   1HH1  ARG  33          1HH1      ARG  33 -10.734   7.147   0.611
  210   2HH1  ARG  33          2HH1      ARG  33 -11.562   7.825   1.971
  211   1HH2  ARG  33          1HH2      ARG  33 -13.508   4.988   2.580
  212   2HH2  ARG  33          2HH2      ARG  33 -13.136   6.602   3.087
  213    H    VAL  34           H        VAL  34  -7.335   2.378  -1.580
  214    HA   VAL  34           HA       VAL  34  -4.605   2.300  -2.653
  215    HB   VAL  34           HB       VAL  34  -6.596   0.047  -2.441
  216   1HG1  VAL  34          1HG1      VAL  34  -5.125  -0.599  -4.117
  217   2HG1  VAL  34          2HG1      VAL  34  -4.390  -1.282  -2.667
  218   3HG1  VAL  34          3HG1      VAL  34  -3.751   0.208  -3.361
  219   1HG2  VAL  34          1HG2      VAL  34  -4.227   0.705  -0.694
  220   2HG2  VAL  34          2HG2      VAL  34  -5.272  -0.706  -0.541
  221   3HG2  VAL  34          3HG2      VAL  34  -5.921   0.907  -0.247
  222    H    VAL  35           H        VAL  35  -4.141   1.554  -4.793
  223    HA   VAL  35           HA       VAL  35  -6.393   1.529  -6.638
  224    HB   VAL  35           HB       VAL  35  -5.138   3.839  -6.640
  225   1HG1  VAL  35          1HG1      VAL  35  -3.362   2.182  -8.407
  226   2HG1  VAL  35          2HG1      VAL  35  -2.897   3.007  -6.925
  227   3HG1  VAL  35          3HG1      VAL  35  -3.382   3.940  -8.336
  228   1HG2  VAL  35          1HG2      VAL  35  -6.926   2.862  -8.206
  229   2HG2  VAL  35          2HG2      VAL  35  -5.585   2.557  -9.309
  230   3HG2  VAL  35          3HG2      VAL  35  -5.948   4.205  -8.797
  231    H    ASP  36           H        ASP  36  -2.882   1.123  -6.309
  232    HA   ASP  36           HA       ASP  36  -3.010  -1.521  -7.393
  233   1HB   ASP  36          2HB       ASP  36  -2.997  -0.206  -9.467
  234   2HB   ASP  36          1HB       ASP  36  -1.534   0.617  -8.939
  235    H    GLU  37           H        GLU  37  -0.881  -2.597  -7.380
  236    HA   GLU  37           HA       GLU  37   0.967  -1.355  -5.442
  237   1HB   GLU  37          2HB       GLU  37   0.286  -4.289  -5.736
  238   2HB   GLU  37          1HB       GLU  37   1.462  -3.620  -4.613
  239   1HG   GLU  37          2HG       GLU  37  -0.320  -2.396  -3.478
  240   2HG   GLU  37          1HG       GLU  37  -1.497  -3.073  -4.601
  241    H    THR  38           H        THR  38   3.033  -1.161  -6.090
  242    HA   THR  38           HA       THR  38   3.860  -2.672  -8.481
  243    HB   THR  38           HB       THR  38   4.769   0.080  -7.643
  244    HG1  THR  38           1HG      THR  38   3.117  -0.661  -9.821
  245   1HG2  THR  38          1HG2      THR  38   5.645  -1.756  -9.768
  246   2HG2  THR  38          2HG2      THR  38   6.520  -0.469  -8.939
  247   3HG2  THR  38          3HG2      THR  38   5.394  -0.073 -10.237
  248    H    ARG  39           H        ARG  39   6.007  -3.364  -8.611
  249    HA   ARG  39           HA       ARG  39   7.093  -4.576  -6.420
  250   1HB   ARG  39          2HB       ARG  39   9.148  -4.828  -7.709
  251   2HB   ARG  39          1HB       ARG  39   7.735  -5.094  -8.723
  252   1HG   ARG  39          2HG       ARG  39   7.954  -2.830  -9.622
  253   2HG   ARG  39          1HG       ARG  39   9.378  -2.573  -8.611
  254   1HD   ARG  39          2HD       ARG  39  10.521  -4.405  -9.757
  255   2HD   ARG  39          1HD       ARG  39   9.096  -4.670 -10.760
  256    HE   ARG  39           HE       ARG  39   9.889  -2.002 -11.038
  257   1HH1  ARG  39          1HH1      ARG  39  11.039  -5.199 -11.827
  258   2HH1  ARG  39          2HH1      ARG  39  11.922  -4.674 -13.221
  259   1HH2  ARG  39          1HH2      ARG  39  11.046  -1.308 -12.871
  260   2HH2  ARG  39          2HH2      ARG  39  11.926  -2.465 -13.815
  261    H    ASN  40           H        ASN  40   7.547  -1.240  -7.401
  262    HA   ASN  40           HA       ASN  40   9.199  -0.878  -4.998
  263   1HB   ASN  40          2HB       ASN  40  10.624   0.731  -6.180
  264   2HB   ASN  40          1HB       ASN  40  10.717  -0.877  -6.880
  265   1HD2  ASN  40          1HD2      ASN  40   7.791   0.482  -7.796
  266   2HD2  ASN  40          2HD2      ASN  40   8.275   1.110  -9.323
  267    H    THR  41           H        THR  41   6.295  -0.157  -6.080
  268    HA   THR  41           HA       THR  41   6.188   2.256  -4.518
  269    HB   THR  41           HB       THR  41   6.871   3.157  -6.708
  270    HG1  THR  41           1HG      THR  41   4.172   3.786  -6.120
  271   1HG2  THR  41          1HG2      THR  41   5.257   3.188  -8.558
  272   2HG2  THR  41          2HG2      THR  41   4.280   1.999  -7.697
  273   3HG2  THR  41          3HG2      THR  41   5.905   1.580  -8.239
  274    H    LEU  42           H        LEU  42   4.007   3.040  -4.193
  275    HA   LEU  42           HA       LEU  42   1.920   1.046  -4.753
  276   1HB   LEU  42          2HB       LEU  42   2.720   0.695  -2.484
  277   2HB   LEU  42          1HB       LEU  42   2.498   2.384  -2.105
  278    HG   LEU  42           HG       LEU  42   0.773   0.960  -1.109
  279   1HD1  LEU  42          1HD1      LEU  42  -0.681   2.490  -3.215
  280   2HD1  LEU  42          2HD1      LEU  42   0.375   3.360  -2.101
  281   3HD1  LEU  42          3HD1      LEU  42  -0.972   2.405  -1.478
  282   1HD2  LEU  42          1HD2      LEU  42  -0.982   0.102  -2.833
  283   2HD2  LEU  42          2HD2      LEU  42   0.460  -0.859  -2.500
  284   3HD2  LEU  42          3HD2      LEU  42   0.377   0.133  -3.956
  285    H    ARG  43           H        ARG  43   0.383   2.035  -5.912
  286    HA   ARG  43           HA       ARG  43   0.062   4.916  -5.581
  287   1HB   ARG  43          2HB       ARG  43   0.326   3.942  -7.859
  288   2HB   ARG  43          1HB       ARG  43  -1.205   3.112  -7.646
  289   1HG   ARG  43          2HG       ARG  43  -2.395   5.183  -7.559
  290   2HG   ARG  43          1HG       ARG  43  -0.891   6.098  -7.479
  291   1HD   ARG  43          2HD       ARG  43  -2.002   6.086  -9.731
  292   2HD   ARG  43          1HD       ARG  43  -0.327   5.539  -9.721
  293    HE   ARG  43           HE       ARG  43  -1.910   3.279  -9.468
  294   1HH1  ARG  43          1HH1      ARG  43  -1.381   5.805 -11.814
  295   2HH1  ARG  43          2HH1      ARG  43  -1.759   4.797 -13.170
  296   1HH2  ARG  43          1HH2      ARG  43  -2.408   1.950 -11.247
  297   2HH2  ARG  43          2HH2      ARG  43  -2.342   2.608 -12.848
  298    H    ILE  44           H        ILE  44  -1.586   5.819  -4.618
  299    HA   ILE  44           HA       ILE  44  -3.574   4.113  -3.326
  300    HB   ILE  44           HB       ILE  44  -2.417   6.823  -2.774
  301   1HG1  ILE  44          2HG1      ILE  44  -2.814   4.356  -1.081
  302   2HG1  ILE  44          1HG1      ILE  44  -1.312   4.860  -1.848
  303   1HG2  ILE  44          1HG2      ILE  44  -5.158   6.298  -2.352
  304   2HG2  ILE  44          2HG2      ILE  44  -4.209   7.694  -1.849
  305   3HG2  ILE  44          3HG2      ILE  44  -4.359   6.301  -0.780
  306   1HD1  ILE  44          1HD1      ILE  44  -0.873   5.748   0.155
  307   2HD1  ILE  44          2HD1      ILE  44  -2.573   5.785   0.625
  308   3HD1  ILE  44          3HD1      ILE  44  -1.912   7.061  -0.396
  309    H    GLU  45           H        GLU  45  -5.656   4.059  -3.965
  310    HA   GLU  45           HA       GLU  45  -6.714   6.476  -5.229
  311   1HB   GLU  45          2HB       GLU  45  -6.464   5.002  -7.081
  312   2HB   GLU  45          1HB       GLU  45  -7.136   3.644  -6.192
  313   1HG   GLU  45          2HG       GLU  45  -9.314   4.744  -6.161
  314   2HG   GLU  45          1HG       GLU  45  -8.637   6.117  -7.034
  315    H    MET  46           H        MET  46  -8.618   7.093  -4.588
  316    HA   MET  46           HA       MET  46 -10.033   5.466  -2.592
  317   1HB   MET  46          2HB       MET  46 -10.707   7.578  -1.507
  318   2HB   MET  46          1HB       MET  46  -8.963   7.370  -1.524
  319   1HG   MET  46          2HG       MET  46  -9.129   8.789  -3.712
  320   2HG   MET  46          1HG       MET  46 -10.658   9.305  -3.002
  321   1HE   MET  46          1HE       MET  46  -6.824   9.298  -2.833
  322   2HE   MET  46          2HE       MET  46  -7.138   8.410  -1.337
  323   3HE   MET  46          3HE       MET  46  -6.460  10.037  -1.269
  324    H    ASP  47           H        ASP  47 -12.142   5.163  -2.800
  325    HA   ASP  47           HA       ASP  47 -13.475   5.204  -5.141
  326   1HB   ASP  47          2HB       ASP  47 -15.574   5.060  -3.858
  327   2HB   ASP  47          1HB       ASP  47 -14.309   4.039  -3.179
  328    H    ASP  48           H        ASP  48 -12.993   7.951  -3.090
  329    HA   ASP  48           HA       ASP  48 -15.070   9.600  -3.985
  330   1HB   ASP  48          2HB       ASP  48 -12.270  10.403  -3.156
  331   2HB   ASP  48          1HB       ASP  48 -13.655  11.486  -3.269
  332    H    GLY  49           H        GLY  49 -12.387   8.356  -5.658
  333   1HA   GLY  49          2HA       GLY  49 -12.249   8.507  -8.024
  334   2HA   GLY  49          1HA       GLY  49 -12.987  10.097  -7.938
  335    H    ARG  50           H        ARG  50 -10.570   9.453  -5.619
  336    HA   ARG  50           HA       ARG  50  -8.712  11.177  -7.127
  337   1HB   ARG  50          2HB       ARG  50  -8.848  10.656  -4.167
  338   2HB   ARG  50          1HB       ARG  50  -7.672  11.690  -4.951
  339   1HG   ARG  50          2HG       ARG  50 -10.645  12.148  -5.027
  340   2HG   ARG  50          1HG       ARG  50  -9.551  12.898  -3.866
  341   1HD   ARG  50          2HD       ARG  50  -9.871  14.484  -5.587
  342   2HD   ARG  50          1HD       ARG  50  -8.268  13.800  -5.844
  343    HE   ARG  50           HE       ARG  50 -10.162  12.372  -7.359
  344   1HH1  ARG  50          1HH1      ARG  50  -8.566  15.473  -7.259
  345   2HH1  ARG  50          2HH1      ARG  50  -8.689  15.730  -8.967
  346   1HH2  ARG  50          1HH2      ARG  50 -10.328  12.710  -9.605
  347   2HH2  ARG  50          2HH2      ARG  50  -9.690  14.162 -10.299
  348    H    GLU  51           H        GLU  51  -6.405  10.754  -6.934
  349    HA   GLU  51           HA       GLU  51  -5.643   8.086  -6.106
  350   1HB   GLU  51          2HB       GLU  51  -5.335   8.994  -8.973
  351   2HB   GLU  51          1HB       GLU  51  -4.674   7.509  -8.301
  352   1HG   GLU  51          2HG       GLU  51  -6.947   6.727  -7.831
  353   2HG   GLU  51          1HG       GLU  51  -7.593   8.204  -8.541
  354    H    ILE  52           H        ILE  52  -3.806   8.375  -4.993
  355    HA   ILE  52           HA       ILE  52  -1.818  10.305  -6.013
  356    HB   ILE  52           HB       ILE  52  -2.900  11.268  -4.044
  357   1HG1  ILE  52          2HG1      ILE  52  -0.087  10.295  -3.484
  358   2HG1  ILE  52          1HG1      ILE  52  -0.519  11.725  -4.421
  359   1HG2  ILE  52          1HG2      ILE  52  -3.653   9.253  -2.950
  360   2HG2  ILE  52          2HG2      ILE  52  -2.653  10.188  -1.839
  361   3HG2  ILE  52          3HG2      ILE  52  -1.989   8.764  -2.637
  362   1HD1  ILE  52          1HD1      ILE  52   0.191  12.330  -2.167
  363   2HD1  ILE  52          2HD1      ILE  52  -1.074  11.307  -1.483
  364   3HD1  ILE  52          3HD1      ILE  52  -1.509  12.737  -2.419
  365    H    THR  53           H        THR  53   0.253   9.569  -6.140
  366    HA   THR  53           HA       THR  53   0.723   6.770  -5.710
  367    HB   THR  53           HB       THR  53   1.669   7.869  -7.653
  368    HG1  THR  53           1HG      THR  53   3.032   6.302  -7.263
  369   1HG2  THR  53          1HG2      THR  53   2.054  10.099  -6.849
  370   2HG2  THR  53          2HG2      THR  53   3.570   9.414  -7.437
  371   3HG2  THR  53          3HG2      THR  53   3.262   9.514  -5.703
  372    H    VAL  54           H        VAL  54   2.221   5.787  -4.352
  373    HA   VAL  54           HA       VAL  54   3.642   7.355  -2.368
  374    HB   VAL  54           HB       VAL  54   1.602   5.309  -1.483
  375   1HG1  VAL  54          1HG1      VAL  54   3.772   5.630  -0.150
  376   2HG1  VAL  54          2HG1      VAL  54   2.247   5.753   0.727
  377   3HG1  VAL  54          3HG1      VAL  54   3.123   7.214   0.272
  378   1HG2  VAL  54          1HG2      VAL  54   0.465   7.301  -2.232
  379   2HG2  VAL  54          2HG2      VAL  54   1.562   8.322  -1.302
  380   3HG2  VAL  54          3HG2      VAL  54   0.435   7.250  -0.469
  381    HA   PRO  55           HA       PRO  55   6.380   3.913  -3.396
  382   1HB   PRO  55          2HB       PRO  55   8.095   5.117  -1.316
  383   2HB   PRO  55          1HB       PRO  55   8.445   4.802  -3.018
  384   1HG   PRO  55          2HG       PRO  55   8.056   7.290  -2.118
  385   2HG   PRO  55          1HG       PRO  55   7.483   6.786  -3.719
  386   1HD   PRO  55          2HD       PRO  55   5.941   7.114  -1.171
  387   2HD   PRO  55          1HD       PRO  55   5.494   7.577  -2.827
  388    H    LYS  56           H        LYS  56   5.922   1.945  -2.601
  389    HA   LYS  56           HA       LYS  56   5.664   1.610   0.298
  390   1HB   LYS  56          2HB       LYS  56   4.574  -0.536  -0.212
  391   2HB   LYS  56          1HB       LYS  56   3.757   0.830  -0.946
  392   1HG   LYS  56          2HG       LYS  56   3.748  -0.874  -2.564
  393   2HG   LYS  56          1HG       LYS  56   4.991   0.265  -3.078
  394   1HD   LYS  56          2HD       LYS  56   5.666  -2.097  -3.321
  395   2HD   LYS  56          1HD       LYS  56   6.729  -1.190  -2.247
  396   1HE   LYS  56          2HE       LYS  56   5.605  -2.135  -0.307
  397   2HE   LYS  56          1HE       LYS  56   4.469  -2.981  -1.357
  398   1HZ   LYS  56          1HZ       LYS  56   7.223  -3.537  -1.963
  399   2HZ   LYS  56          2HZ       LYS  56   5.931  -4.604  -1.731
  400   3HZ   LYS  56          3HZ       LYS  56   6.781  -4.004  -0.396
  401    H    GLY  57           H        GLY  57   8.059   1.276  -1.953
  402   1HA   GLY  57          2HA       GLY  57   9.180  -1.215  -1.634
  403   2HA   GLY  57          1HA       GLY  57  10.128   0.257  -1.807
  404    H    ILE  58           H        ILE  58   8.913   1.296   0.722
  405    HA   ILE  58           HA       ILE  58   9.891  -0.464   2.773
  406    HB   ILE  58           HB       ILE  58  11.094   2.292   2.488
  407   1HG1  ILE  58          2HG1      ILE  58  13.263   0.895   2.242
  408   2HG1  ILE  58          1HG1      ILE  58  12.188  -0.428   1.800
  409   1HG2  ILE  58          1HG2      ILE  58  12.123   0.209   4.352
  410   2HG2  ILE  58          2HG2      ILE  58  10.674   1.113   4.788
  411   3HG2  ILE  58          3HG2      ILE  58  12.183   1.967   4.476
  412   1HD1  ILE  58          1HD1      ILE  58  12.256   0.314  -0.278
  413   2HD1  ILE  58          2HD1      ILE  58  13.138   1.760   0.214
  414   3HD1  ILE  58          3HD1      ILE  58  11.374   1.747   0.251
  415    H    ALA  59           H        ALA  59   7.383  -0.057   2.661
  416    HA   ALA  59           HA       ALA  59   6.838   2.021   4.638
  417   1HB   ALA  59          1HB       ALA  59   4.896   1.698   2.405
  418   2HB   ALA  59          2HB       ALA  59   6.338   2.692   2.183
  419   3HB   ALA  59          3HB       ALA  59   5.184   3.088   3.455
  420    H    VAL  60           H        VAL  60   6.046   0.999   6.364
  421    HA   VAL  60           HA       VAL  60   4.462  -1.411   6.101
  422    HB   VAL  60           HB       VAL  60   6.023  -1.191   7.991
  423   1HG1  VAL  60          1HG1      VAL  60   4.314   0.663   9.494
  424   2HG1  VAL  60          2HG1      VAL  60   5.195   1.391   8.150
  425   3HG1  VAL  60          3HG1      VAL  60   6.072   0.542   9.424
  426   1HG2  VAL  60          1HG2      VAL  60   4.224  -2.699   8.335
  427   2HG2  VAL  60          2HG2      VAL  60   3.092  -1.385   8.660
  428   3HG2  VAL  60          3HG2      VAL  60   4.371  -1.754   9.817
  429    H    PHE  61           H        PHE  61   2.291  -1.483   5.976
  430    HA   PHE  61           HA       PHE  61   0.709   0.626   7.165
  431   1HB   PHE  61          2HB       PHE  61  -0.537   0.981   4.969
  432   2HB   PHE  61          1HB       PHE  61   1.056   1.714   5.112
  433    HD1  PHE  61           1HD      PHE  61  -0.319  -1.605   4.048
  434    HD2  PHE  61           2HD      PHE  61   2.313   1.636   3.220
  435    HE1  PHE  61           1HE      PHE  61   0.400  -2.719   1.976
  436    HE2  PHE  61           2HE      PHE  61   3.030   0.529   1.144
  437    HZ   PHE  61           HZ       PHE  61   2.073  -1.652   0.522
  438    H    HIS  62           H        HIS  62  -1.520   0.182   7.274
  439    HA   HIS  62           HA       HIS  62  -2.202  -2.653   6.861
  440   1HB   HIS  62          2HB       HIS  62  -3.068  -0.802   9.093
  441   2HB   HIS  62          1HB       HIS  62  -3.663  -2.442   8.861
  442    HD1  HIS  62           1HD      HIS  62  -0.185  -0.892   9.090
  443    HD2  HIS  62           2HD      HIS  62  -2.387  -4.095  10.559
  444    HE1  HIS  62           1HE      HIS  62   1.382  -2.146  10.605
  445    HE2  HIS  62           2HE      HIS  62  -0.003  -4.019  11.563
  446    H    PHE  63           H        PHE  63  -4.213  -3.113   5.994
  447    HA   PHE  63           HA       PHE  63  -5.634  -0.792   4.893
  448   1HB   PHE  63          2HB       PHE  63  -5.810  -3.686   4.032
  449   2HB   PHE  63          1HB       PHE  63  -6.537  -2.306   3.218
  450    HD1  PHE  63           1HD      PHE  63  -5.455  -1.512   1.361
  451    HD2  PHE  63           2HD      PHE  63  -3.172  -3.398   4.416
  452    HE1  PHE  63           1HE      PHE  63  -3.426  -1.252  -0.002
  453    HE2  PHE  63           2HE      PHE  63  -1.140  -3.137   3.062
  454    HZ   PHE  63           HZ       PHE  63  -1.261  -2.064   0.848
  455    H    ARG  64           H        ARG  64  -7.800  -0.493   5.169
  456    HA   ARG  64           HA       ARG  64  -9.078  -2.191   7.207
  457   1HB   ARG  64          2HB       ARG  64  -9.586   0.698   6.468
  458   2HB   ARG  64          1HB       ARG  64 -10.532  -0.209   7.639
  459   1HG   ARG  64          2HG       ARG  64  -7.575   0.307   7.871
  460   2HG   ARG  64          1HG       ARG  64  -8.830   1.271   8.654
  461   1HD   ARG  64          2HD       ARG  64  -8.343  -1.677   9.074
  462   2HD   ARG  64          1HD       ARG  64  -7.883  -0.388  10.184
  463    HE   ARG  64           HE       ARG  64 -10.639  -0.219   9.670
  464   1HH1  ARG  64          1HH1      ARG  64  -8.342  -2.263  11.318
  465   2HH1  ARG  64          2HH1      ARG  64  -9.490  -2.827  12.484
  466   1HH2  ARG  64          1HH2      ARG  64 -12.152  -0.960  11.202
  467   2HH2  ARG  64          2HH2      ARG  64 -11.654  -2.088  12.418
  468    H    THR  65           H        THR  65 -10.767  -3.388   6.612
  469    HA   THR  65           HA       THR  65 -11.983  -2.875   3.996
  470    HB   THR  65           HB       THR  65 -12.147  -5.336   5.741
  471    HG1  THR  65           1HG      THR  65 -10.629  -6.191   4.376
  472   1HG2  THR  65          1HG2      THR  65 -13.969  -5.615   4.398
  473   2HG2  THR  65          2HG2      THR  65 -12.709  -6.320   3.388
  474   3HG2  THR  65          3HG2      THR  65 -13.277  -4.680   3.073
  475    HA   PRO  66           HA       PRO  66 -15.537  -1.036   5.960
  476   1HB   PRO  66          2HB       PRO  66 -17.304  -1.733   3.899
  477   2HB   PRO  66          1HB       PRO  66 -16.377  -0.237   4.017
  478   1HG   PRO  66          2HG       PRO  66 -15.792  -2.714   2.467
  479   2HG   PRO  66          1HG       PRO  66 -15.479  -1.020   2.045
  480   1HD   PRO  66          2HD       PRO  66 -13.507  -2.633   2.854
  481   2HD   PRO  66          1HD       PRO  66 -13.550  -0.926   3.340
  482    H    GLN  67           H        GLN  67 -15.416  -4.339   4.817
  483    HA   GLN  67           HA       GLN  67 -17.897  -5.189   5.879
  484   1HB   GLN  67          2HB       GLN  67 -16.806  -6.506   4.196
  485   2HB   GLN  67          1HB       GLN  67 -15.365  -6.677   5.186
  486   1HG   GLN  67          2HG       GLN  67 -16.662  -7.994   6.806
  487   2HG   GLN  67          1HG       GLN  67 -18.068  -7.870   5.747
  488   1HE2  GLN  67          1HE2      GLN  67 -15.140  -9.465   6.395
  489   2HE2  GLN  67          2HE2      GLN  67 -15.174 -10.575   5.071
  490    H    GLY  68           H        GLY  68 -14.995  -4.268   7.377
  491   1HA   GLY  68          2HA       GLY  68 -14.926  -3.979   9.752
  492   2HA   GLY  68          1HA       GLY  68 -15.954  -5.395   9.916
  493    H    GLU  69           H        GLU  69 -13.018  -5.013   7.966
  494    HA   GLU  69           HA       GLU  69 -11.723  -7.017   9.702
  495   1HB   GLU  69          2HB       GLU  69 -11.548  -6.871   6.688
  496   2HB   GLU  69          1HB       GLU  69 -10.674  -8.002   7.709
  497   1HG   GLU  69          2HG       GLU  69 -13.664  -7.845   7.396
  498   2HG   GLU  69          1HG       GLU  69 -12.601  -9.055   6.675
  499    H    LEU  70           H        LEU  70  -9.402  -6.975   9.731
  500    HA   LEU  70           HA       LEU  70  -8.257  -4.382   8.924
  501   1HB   LEU  70          2HB       LEU  70  -8.702  -4.505  11.365
  502   2HB   LEU  70          1HB       LEU  70  -7.656  -5.906  11.463
  503    HG   LEU  70           HG       LEU  70  -6.729  -3.166  10.590
  504   1HD1  LEU  70          1HD1      LEU  70  -7.445  -3.081  12.903
  505   2HD1  LEU  70          2HD1      LEU  70  -5.683  -3.047  12.821
  506   3HD1  LEU  70          3HD1      LEU  70  -6.517  -4.535  13.271
  507   1HD2  LEU  70          1HD2      LEU  70  -4.505  -4.334  11.347
  508   2HD2  LEU  70          2HD2      LEU  70  -5.151  -4.606   9.728
  509   3HD2  LEU  70          3HD2      LEU  70  -5.402  -5.810  10.992
  510    H    VAL  71           H        VAL  71  -6.799  -4.734   7.392
  511    HA   VAL  71           HA       VAL  71  -5.248  -7.230   7.440
  512    HB   VAL  71           HB       VAL  71  -5.567  -5.256   5.175
  513   1HG1  VAL  71          1HG1      VAL  71  -4.235  -7.947   5.359
  514   2HG1  VAL  71          2HG1      VAL  71  -3.512  -6.405   4.903
  515   3HG1  VAL  71          3HG1      VAL  71  -4.670  -7.188   3.827
  516   1HG2  VAL  71          1HG2      VAL  71  -7.334  -6.419   4.383
  517   2HG2  VAL  71          2HG2      VAL  71  -7.537  -6.838   6.085
  518   3HG2  VAL  71          3HG2      VAL  71  -6.730  -7.961   4.991
  519    H    GLU  72           H        GLU  72  -2.959  -7.138   6.948
  520    HA   GLU  72           HA       GLU  72  -1.694  -4.542   7.473
  521   1HB   GLU  72          2HB       GLU  72  -0.108  -5.588   9.022
  522   2HB   GLU  72          1HB       GLU  72  -1.761  -5.739   9.603
  523   1HG   GLU  72          2HG       GLU  72  -1.836  -8.042   8.793
  524   2HG   GLU  72          1HG       GLU  72  -0.175  -7.892   8.219
  525    H    ILE  73           H        ILE  73   0.231  -4.186   6.434
  526    HA   ILE  73           HA       ILE  73   1.495  -6.376   4.978
  527    HB   ILE  73           HB       ILE  73   0.596  -3.843   3.594
  528   1HG1  ILE  73          2HG1      ILE  73  -1.254  -5.430   4.035
  529   2HG1  ILE  73          1HG1      ILE  73  -0.913  -5.259   2.316
  530   1HG2  ILE  73          1HG2      ILE  73   1.979  -6.273   2.464
  531   2HG2  ILE  73          2HG2      ILE  73   2.757  -4.727   2.805
  532   3HG2  ILE  73          3HG2      ILE  73   1.497  -4.828   1.576
  533   1HD1  ILE  73          1HD1      ILE  73  -1.344  -7.608   3.267
  534   2HD1  ILE  73          2HD1      ILE  73   0.297  -7.491   3.902
  535   3HD1  ILE  73          3HD1      ILE  73   0.014  -7.384   2.165
  536    H    ASP  74           H        ASP  74   3.641  -6.230   5.192
  537    HA   ASP  74           HA       ASP  74   4.762  -3.765   6.256
  538   1HB   ASP  74          2HB       ASP  74   5.979  -6.506   5.884
  539   2HB   ASP  74          1HB       ASP  74   6.808  -5.134   6.611
  540    H    GLY  75           H        GLY  75   5.043  -2.326   4.667
  541   1HA   GLY  75          2HA       GLY  75   5.881  -2.908   2.035
  542   2HA   GLY  75          1HA       GLY  75   5.876  -1.324   2.783
  543    H    ARG  76           H        ARG  76   7.656  -2.821   4.926
  544    HA   ARG  76           HA       ARG  76  10.123  -2.131   3.575
  545   1HB   ARG  76          2HB       ARG  76   9.722  -0.995   5.676
  546   2HB   ARG  76          1HB       ARG  76   9.520  -2.537   6.496
  547   1HG   ARG  76          2HG       ARG  76  11.861  -3.082   6.050
  548   2HG   ARG  76          1HG       ARG  76  12.063  -1.531   5.234
  549   1HD   ARG  76          2HD       ARG  76  11.311  -1.933   8.129
  550   2HD   ARG  76          1HD       ARG  76  12.895  -1.443   7.530
  551    HE   ARG  76           HE       ARG  76  10.991   0.365   6.571
  552   1HH1  ARG  76          1HH1      ARG  76  12.432  -0.601   9.597
  553   2HH1  ARG  76          2HH1      ARG  76  12.232   0.953  10.332
  554   1HH2  ARG  76          1HH2      ARG  76  10.727   2.411   7.535
  555   2HH2  ARG  76          2HH2      ARG  76  11.264   2.664   9.161
  556    H    ALA  77           H        ALA  77   8.575  -4.811   5.171
  557    HA   ALA  77           HA       ALA  77  10.931  -6.465   4.771
  558   1HB   ALA  77          1HB       ALA  77   9.455  -8.126   6.134
  559   2HB   ALA  77          2HB       ALA  77   8.562  -6.663   6.551
  560   3HB   ALA  77          3HB       ALA  77  10.278  -6.788   6.937
  561    H    LEU  78           H        LEU  78   8.081  -5.807   3.130
  562    HA   LEU  78           HA       LEU  78   8.224  -8.427   1.795
  563   1HB   LEU  78          2HB       LEU  78   5.790  -6.836   2.551
  564   2HB   LEU  78          1HB       LEU  78   5.743  -8.045   1.283
  565    HG   LEU  78           HG       LEU  78   4.919  -8.927   3.417
  566   1HD1  LEU  78          1HD1      LEU  78   7.538 -10.132   2.536
  567   2HD1  LEU  78          2HD1      LEU  78   5.949 -10.461   1.842
  568   3HD1  LEU  78          3HD1      LEU  78   6.305 -10.944   3.501
  569   1HD2  LEU  78          1HD2      LEU  78   7.542  -9.084   4.690
  570   2HD2  LEU  78          2HD2      LEU  78   5.967  -8.696   5.379
  571   3HD2  LEU  78          3HD2      LEU  78   6.909  -7.446   4.571
  572    H    VAL  79           H        VAL  79   9.747  -6.333   0.928
  573    HA   VAL  79           HA       VAL  79   8.523  -4.736  -1.053
  574    HB   VAL  79           HB       VAL  79  11.407  -5.620  -0.964
  575   1HG1  VAL  79          1HG1      VAL  79  10.612  -4.559  -3.070
  576   2HG1  VAL  79          2HG1      VAL  79  11.874  -3.646  -2.243
  577   3HG1  VAL  79          3HG1      VAL  79  10.194  -3.123  -2.136
  578   1HG2  VAL  79          1HG2      VAL  79  11.622  -3.285   0.154
  579   2HG2  VAL  79          2HG2      VAL  79  11.140  -4.674   1.127
  580   3HG2  VAL  79          3HG2      VAL  79   9.924  -3.525   0.567
  581    H    ALA  80           H        ALA  80   7.643  -5.407  -2.906
  582    HA   ALA  80           HA       ALA  80   7.914  -8.025  -3.914
  583   1HB   ALA  80          1HB       ALA  80   5.979  -7.222  -4.731
  584   2HB   ALA  80          2HB       ALA  80   6.984  -6.641  -6.057
  585   3HB   ALA  80          3HB       ALA  80   6.554  -5.556  -4.736
  586    H    ARG  81           H        ARG  81   9.743  -8.825  -4.712
  587    HA   ARG  81           HA       ARG  81  11.364  -7.114  -6.481
  588   1HB   ARG  81          2HB       ARG  81  12.284  -9.392  -4.720
  589   2HB   ARG  81          1HB       ARG  81  13.312  -8.464  -5.804
  590   1HG   ARG  81          2HG       ARG  81  12.851  -6.443  -4.512
  591   2HG   ARG  81          1HG       ARG  81  11.821  -7.373  -3.426
  592   1HD   ARG  81          2HD       ARG  81  13.749  -8.771  -2.816
  593   2HD   ARG  81          1HD       ARG  81  14.775  -7.804  -3.877
  594    HE   ARG  81           HE       ARG  81  14.012  -7.168  -1.230
  595   1HH1  ARG  81          1HH1      ARG  81  14.595  -5.697  -4.343
  596   2HH1  ARG  81          2HH1      ARG  81  14.952  -4.139  -3.679
  597   1HH2  ARG  81          1HH2      ARG  81  14.486  -5.120  -0.357
  598   2HH2  ARG  81          2HH2      ARG  81  14.892  -3.812  -1.416
  599    HA   PRO  82           HA       PRO  82  10.792 -10.135  -9.650
  600   1HB   PRO  82          2HB       PRO  82  12.874  -9.626 -11.249
  601   2HB   PRO  82          1HB       PRO  82  11.586  -8.440 -11.009
  602   1HG   PRO  82          2HG       PRO  82  14.310  -8.554  -9.784
  603   2HG   PRO  82          1HG       PRO  82  13.414  -7.152 -10.394
  604   1HD   PRO  82          2HD       PRO  82  13.585  -7.864  -7.733
  605   2HD   PRO  82          1HD       PRO  82  12.286  -6.877  -8.430
  606    H    GLU  83           H        GLU  83  12.885 -10.705  -7.252
  607    HA   GLU  83           HA       GLU  83  14.808 -12.443  -8.277
  608   1HB   GLU  83          2HB       GLU  83  13.430 -12.563  -5.593
  609   2HB   GLU  83          1HB       GLU  83  14.932 -13.377  -6.004
  610   1HG   GLU  83          2HG       GLU  83  14.517 -10.396  -5.982
  611   2HG   GLU  83          1HG       GLU  83  15.297 -11.333  -4.708
  612    H    GLU  84           H        GLU  84  11.540 -13.059  -7.161
  613    HA   GLU  84           HA       GLU  84  11.711 -15.787  -8.252
  614   1HB   GLU  84          2HB       GLU  84   9.745 -14.629  -6.267
  615   2HB   GLU  84          1HB       GLU  84   9.731 -16.284  -6.860
  616   1HG   GLU  84          2HG       GLU  84  11.927 -16.661  -5.859
  617   2HG   GLU  84          1HG       GLU  84  11.939 -15.002  -5.263
  618    H    ARG  85           H        ARG  85   9.506 -13.016  -8.000
  619    HA   ARG  85           HA       ARG  85   8.825 -12.715 -10.618
  620   1HB   ARG  85          2HB       ARG  85   8.013 -15.015 -10.675
  621   2HB   ARG  85          1HB       ARG  85   6.966 -14.705  -9.297
  622   1HG   ARG  85          2HG       ARG  85   5.654 -13.149 -10.618
  623   2HG   ARG  85          1HG       ARG  85   6.732 -13.389 -11.995
  624   1HD   ARG  85          2HD       ARG  85   5.032 -15.512 -10.689
  625   2HD   ARG  85          1HD       ARG  85   4.679 -14.704 -12.216
  626    HE   ARG  85           HE       ARG  85   7.225 -15.854 -12.385
  627   1HH1  ARG  85          1HH1      ARG  85   3.884 -16.833 -12.157
  628   2HH1  ARG  85          2HH1      ARG  85   4.131 -18.322 -13.004
  629   1HH2  ARG  85          1HH2      ARG  85   7.553 -17.810 -13.502
  630   2HH2  ARG  85          2HH2      ARG  85   6.216 -18.877 -13.769
  631    H    ILE  86           H        ILE  86   7.666 -10.881 -10.782
  632    HA   ILE  86           HA       ILE  86   6.421  -9.853  -8.332
  633    HB   ILE  86           HB       ILE  86   7.143  -8.362 -10.862
  634   1HG1  ILE  86          2HG1      ILE  86   8.560  -8.488  -8.192
  635   2HG1  ILE  86          1HG1      ILE  86   9.121  -9.227  -9.687
  636   1HG2  ILE  86          1HG2      ILE  86   6.607  -6.371  -9.736
  637   2HG2  ILE  86          2HG2      ILE  86   6.526  -7.178  -8.171
  638   3HG2  ILE  86          3HG2      ILE  86   5.274  -7.465  -9.377
  639   1HD1  ILE  86          1HD1      ILE  86   8.756  -6.594 -10.385
  640   2HD1  ILE  86          2HD1      ILE  86  10.290  -7.367  -9.986
  641   3HD1  ILE  86          3HD1      ILE  86   9.388  -6.503  -8.742
  Start of MODEL   17
    1    H    ARG   9           H        ARG   9  -8.382 -15.090  -2.090
    2    HA   ARG   9           HA       ARG   9  -7.128 -13.506  -1.043
    3   1HB   ARG   9          2HB       ARG   9  -5.123 -15.719  -1.366
    4   2HB   ARG   9          1HB       ARG   9  -4.639 -14.172  -0.691
    5   1HG   ARG   9          2HG       ARG   9  -5.156 -15.824   1.037
    6   2HG   ARG   9          1HG       ARG   9  -6.219 -14.420   1.118
    7   1HD   ARG   9          2HD       ARG   9  -7.001 -16.939  -0.322
    8   2HD   ARG   9          1HD       ARG   9  -7.281 -16.723   1.404
    9    HE   ARG   9           HE       ARG   9  -8.326 -14.517   0.009
   10   1HH1  ARG   9          1HH1      ARG   9  -8.943 -17.912   0.533
   11   2HH1  ARG   9          2HH1      ARG   9 -10.648 -17.771   0.265
   12   1HH2  ARG   9          1HH2      ARG   9 -10.567 -14.329  -0.342
   13   2HH2  ARG   9          2HH2      ARG   9 -11.571 -15.737  -0.232
   14    H    HIS  10           H        HIS  10  -4.814 -12.316  -1.333
   15    HA   HIS  10           HA       HIS  10  -3.571 -10.909  -2.613
   16   1HB   HIS  10          2HB       HIS  10  -2.852 -12.987  -3.756
   17   2HB   HIS  10          1HB       HIS  10  -4.205 -12.826  -4.869
   18    HD1  HIS  10           1HD      HIS  10  -4.123 -10.232  -6.074
   19    HD2  HIS  10           2HD      HIS  10  -0.588 -12.054  -4.868
   20    HE1  HIS  10           1HE      HIS  10  -2.301  -9.094  -7.379
   21    HE2  HIS  10           2HE      HIS  10  -0.164 -10.161  -6.578
   22    H    GLU  11           H        GLU  11  -5.425  -9.470  -2.185
   23    HA   GLU  11           HA       GLU  11  -6.165  -8.025  -4.456
   24   1HB   GLU  11          2HB       GLU  11  -7.639  -9.917  -4.946
   25   2HB   GLU  11          1HB       GLU  11  -8.376  -9.772  -3.357
   26   1HG   GLU  11          2HG       GLU  11  -9.228  -7.561  -3.953
   27   2HG   GLU  11          1HG       GLU  11  -8.491  -7.712  -5.548
   28    H    LEU  12           H        LEU  12  -5.339  -6.494  -2.914
   29    HA   LEU  12           HA       LEU  12  -7.135  -5.872  -0.681
   30   1HB   LEU  12          2HB       LEU  12  -4.333  -4.950  -1.309
   31   2HB   LEU  12          1HB       LEU  12  -5.284  -4.331   0.027
   32    HG   LEU  12           HG       LEU  12  -5.374  -6.592   1.004
   33   1HD1  LEU  12          1HD1      LEU  12  -3.778  -7.271  -1.441
   34   2HD1  LEU  12          2HD1      LEU  12  -5.211  -8.070  -0.792
   35   3HD1  LEU  12          3HD1      LEU  12  -3.660  -8.233   0.033
   36   1HD2  LEU  12          1HD2      LEU  12  -2.551  -5.735   0.395
   37   2HD2  LEU  12          2HD2      LEU  12  -3.111  -6.650   1.794
   38   3HD2  LEU  12          3HD2      LEU  12  -3.591  -4.966   1.594
   39    H    ILE  13           H        ILE  13  -7.700  -5.261  -3.536
   40    HA   ILE  13           HA       ILE  13  -7.545  -2.350  -3.622
   41    HB   ILE  13           HB       ILE  13  -8.763  -4.245  -5.637
   42   1HG1  ILE  13          2HG1      ILE  13  -6.365  -4.669  -5.364
   43   2HG1  ILE  13          1HG1      ILE  13  -6.687  -3.908  -6.919
   44   1HG2  ILE  13          1HG2      ILE  13  -8.327  -1.300  -5.548
   45   2HG2  ILE  13          2HG2      ILE  13  -9.692  -2.221  -6.179
   46   3HG2  ILE  13          3HG2      ILE  13  -8.189  -2.134  -7.097
   47   1HD1  ILE  13          1HD1      ILE  13  -6.073  -1.719  -5.821
   48   2HD1  ILE  13          2HD1      ILE  13  -4.761  -2.873  -6.065
   49   3HD1  ILE  13          3HD1      ILE  13  -5.479  -2.678  -4.465
   50    H    GLY  14           H        GLY  14  -9.312  -0.982  -3.546
   51   1HA   GLY  14          2HA       GLY  14 -11.666  -0.545  -3.570
   52   2HA   GLY  14          1HA       GLY  14 -11.943  -2.203  -3.063
   53    H    LEU  15           H        LEU  15  -9.628  -1.712  -1.067
   54    HA   LEU  15           HA       LEU  15 -11.313  -0.388   0.944
   55   1HB   LEU  15          2HB       LEU  15  -9.910  -1.675   2.614
   56   2HB   LEU  15          1HB       LEU  15 -11.041  -2.603   1.650
   57    HG   LEU  15           HG       LEU  15  -8.122  -2.403   0.928
   58   1HD1  LEU  15          1HD1      LEU  15  -8.767  -3.369   3.293
   59   2HD1  LEU  15          2HD1      LEU  15  -7.574  -4.171   2.273
   60   3HD1  LEU  15          3HD1      LEU  15  -9.229  -4.777   2.338
   61   1HD2  LEU  15          1HD2      LEU  15 -10.481  -3.757  -0.127
   62   2HD2  LEU  15          2HD2      LEU  15  -9.122  -4.845   0.155
   63   3HD2  LEU  15          3HD2      LEU  15  -8.923  -3.438  -0.887
   64    H    SER  16           H        SER  16 -10.220   0.816   2.638
   65    HA   SER  16           HA       SER  16  -8.284   2.606   1.533
   66   1HB   SER  16          2HB       SER  16 -10.017   3.422   3.054
   67   2HB   SER  16          1HB       SER  16  -9.390   2.398   4.345
   68    HG   SER  16           HG       SER  16  -8.196   4.061   4.798
   69    H    VAL  17           H        VAL  17  -6.229   3.147   2.544
   70    HA   VAL  17           HA       VAL  17  -4.986   0.973   4.056
   71    HB   VAL  17           HB       VAL  17  -4.413   0.477   1.767
   72   1HG1  VAL  17          1HG1      VAL  17  -4.244   3.348   1.540
   73   2HG1  VAL  17          2HG1      VAL  17  -4.394   2.126   0.279
   74   3HG1  VAL  17          3HG1      VAL  17  -2.801   2.571   0.892
   75   1HG2  VAL  17          1HG2      VAL  17  -1.953   0.632   1.876
   76   2HG2  VAL  17          2HG2      VAL  17  -2.664   0.093   3.398
   77   3HG2  VAL  17          3HG2      VAL  17  -2.104   1.756   3.228
   78    H    ARG  18           H        ARG  18  -4.359   1.928   5.876
   79    HA   ARG  18           HA       ARG  18  -3.540   4.710   5.905
   80   1HB   ARG  18          2HB       ARG  18  -4.976   3.865   7.699
   81   2HB   ARG  18          1HB       ARG  18  -3.752   2.682   8.137
   82   1HG   ARG  18          2HG       ARG  18  -2.225   4.485   8.753
   83   2HG   ARG  18          1HG       ARG  18  -3.452   5.672   8.312
   84   1HD   ARG  18          2HD       ARG  18  -4.946   4.771  10.022
   85   2HD   ARG  18          1HD       ARG  18  -3.731   3.571  10.459
   86    HE   ARG  18           HE       ARG  18  -3.851   6.251  11.352
   87   1HH1  ARG  18          1HH1      ARG  18  -1.577   3.776  10.405
   88   2HH1  ARG  18          2HH1      ARG  18  -0.272   4.450  11.321
   89   1HH2  ARG  18          1HH2      ARG  18  -2.137   7.134  12.560
   90   2HH2  ARG  18          2HH2      ARG  18  -0.590   6.354  12.547
   91    H    ILE  19           H        ILE  19  -1.502   5.472   6.240
   92    HA   ILE  19           HA       ILE  19   0.658   3.532   5.945
   93    HB   ILE  19           HB       ILE  19   0.741   6.547   5.778
   94   1HG1  ILE  19          2HG1      ILE  19  -0.574   5.541   3.969
   95   2HG1  ILE  19          1HG1      ILE  19   0.944   6.196   3.355
   96   1HG2  ILE  19          1HG2      ILE  19   2.823   4.449   5.657
   97   2HG2  ILE  19          2HG2      ILE  19   2.928   6.126   6.195
   98   3HG2  ILE  19          3HG2      ILE  19   2.937   5.750   4.471
   99   1HD1  ILE  19          1HD1      ILE  19   0.615   4.104   2.286
  100   2HD1  ILE  19          2HD1      ILE  19   0.232   3.306   3.814
  101   3HD1  ILE  19          3HD1      ILE  19   1.878   3.857   3.495
  102    H    ALA  20           H        ALA  20   1.473   2.742   7.773
  103    HA   ALA  20           HA       ALA  20   1.397   4.223  10.241
  104   1HB   ALA  20          1HB       ALA  20   2.067   1.471   9.425
  105   2HB   ALA  20          2HB       ALA  20   1.148   2.052  10.815
  106   3HB   ALA  20          3HB       ALA  20   2.911   2.084  10.849
  107    H    ARG  21           H        ARG  21   3.679   3.553   7.738
  108    HA   ARG  21           HA       ARG  21   5.456   5.572   8.619
  109   1HB   ARG  21          2HB       ARG  21   6.129   3.787  10.182
  110   2HB   ARG  21          1HB       ARG  21   6.465   2.736   8.815
  111   1HG   ARG  21          2HG       ARG  21   8.514   3.670   9.681
  112   2HG   ARG  21          1HG       ARG  21   8.201   4.287   8.057
  113   1HD   ARG  21          2HD       ARG  21   7.310   6.353   9.010
  114   2HD   ARG  21          1HD       ARG  21   7.600   5.736  10.636
  115    HE   ARG  21           HE       ARG  21  10.010   5.664   9.213
  116   1HH1  ARG  21          1HH1      ARG  21   7.773   7.995  10.531
  117   2HH1  ARG  21          2HH1      ARG  21   8.985   9.205  10.781
  118   1HH2  ARG  21          1HH2      ARG  21  11.607   7.255   9.540
  119   2HH2  ARG  21          2HH2      ARG  21  11.163   8.786  10.220
  120    H    SER  22           H        SER  22   6.898   6.164   7.045
  121    HA   SER  22           HA       SER  22   7.046   4.532   4.622
  122   1HB   SER  22          2HB       SER  22   5.185   6.127   4.285
  123   2HB   SER  22          1HB       SER  22   6.296   7.463   4.583
  124    HG   SER  22           HG       SER  22   7.419   6.916   2.737
  125    H    VAL  23           H        VAL  23   8.695   5.362   3.076
  126    HA   VAL  23           HA       VAL  23  11.164   5.736   4.372
  127    HB   VAL  23           HB       VAL  23  10.997   4.663   2.182
  128   1HG1  VAL  23          1HG1      VAL  23   9.200   6.143   1.300
  129   2HG1  VAL  23          2HG1      VAL  23  10.529   5.881   0.168
  130   3HG1  VAL  23          3HG1      VAL  23  10.416   7.399   1.059
  131   1HG2  VAL  23          1HG2      VAL  23  13.131   5.660   2.860
  132   2HG2  VAL  23          2HG2      VAL  23  12.664   7.178   2.093
  133   3HG2  VAL  23          3HG2      VAL  23  12.912   5.733   1.111
  134    H    HIS  24           H        HIS  24   9.102   7.997   2.563
  135    HA   HIS  24           HA       HIS  24  10.810  10.202   3.488
  136   1HB   HIS  24          2HB       HIS  24  10.461   9.960   1.029
  137   2HB   HIS  24          1HB       HIS  24   8.742  10.242   1.283
  138    HD1  HIS  24           1HD      HIS  24  11.737  12.135   2.672
  139    HD2  HIS  24           2HD      HIS  24   8.362  12.743   0.331
  140    HE1  HIS  24           1HE      HIS  24  11.700  14.601   2.177
  141    HE2  HIS  24           2HE      HIS  24   9.693  14.930   0.687
  142    H    ARG  25           H        ARG  25  10.030  11.804   4.745
  143    HA   ARG  25           HA       ARG  25   7.832  11.341   6.377
  144   1HB   ARG  25          2HB       ARG  25   9.709  12.765   7.024
  145   2HB   ARG  25          1HB       ARG  25   9.225  13.956   5.824
  146   1HG   ARG  25          2HG       ARG  25   7.127  14.317   7.024
  147   2HG   ARG  25          1HG       ARG  25   7.615  13.124   8.228
  148   1HD   ARG  25          2HD       ARG  25   9.557  14.499   8.803
  149   2HD   ARG  25          1HD       ARG  25   9.067  15.694   7.601
  150    HE   ARG  25           HE       ARG  25   8.084  15.457  10.242
  151   1HH1  ARG  25          1HH1      ARG  25   7.055  16.221   6.992
  152   2HH1  ARG  25          2HH1      ARG  25   5.704  17.170   7.512
  153   1HH2  ARG  25          1HH2      ARG  25   6.310  16.710  10.922
  154   2HH2  ARG  25          2HH2      ARG  25   5.281  17.451   9.740
  155    H    ASP  26           H        ASP  26   8.068  13.302   3.481
  156    HA   ASP  26           HA       ASP  26   5.667  14.680   3.659
  157   1HB   ASP  26          2HB       ASP  26   7.394  15.117   1.939
  158   2HB   ASP  26          1HB       ASP  26   6.933  13.622   1.131
  159    H    ILE  27           H        ILE  27   6.206  11.352   3.044
  160    HA   ILE  27           HA       ILE  27   3.397  10.997   2.334
  161    HB   ILE  27           HB       ILE  27   4.073   8.779   1.418
  162   1HG1  ILE  27          2HG1      ILE  27   6.863   9.884   1.820
  163   2HG1  ILE  27          1HG1      ILE  27   6.162   8.524   2.689
  164   1HG2  ILE  27          1HG2      ILE  27   5.059  11.361   0.288
  165   2HG2  ILE  27          2HG2      ILE  27   3.715  10.346  -0.234
  166   3HG2  ILE  27          3HG2      ILE  27   5.375   9.849  -0.563
  167   1HD1  ILE  27          1HD1      ILE  27   6.714   8.634  -0.269
  168   2HD1  ILE  27          2HD1      ILE  27   6.008   7.271   0.598
  169   3HD1  ILE  27          3HD1      ILE  27   7.666   7.770   0.938
  170    H    GLN  28           H        GLN  28   5.692  10.494   4.761
  171    HA   GLN  28           HA       GLN  28   4.621   8.099   5.873
  172   1HB   GLN  28          2HB       GLN  28   6.949   8.760   6.242
  173   2HB   GLN  28          1HB       GLN  28   6.414  10.202   7.091
  174   1HG   GLN  28          2HG       GLN  28   5.759   7.422   8.017
  175   2HG   GLN  28          1HG       GLN  28   7.205   8.291   8.522
  176   1HE2  GLN  28          1HE2      GLN  28   4.256   7.460   9.508
  177   2HE2  GLN  28          2HE2      GLN  28   3.875   8.789  10.545
  178    H    GLY  29           H        GLY  29   3.165   7.822   7.496
  179   1HA   GLY  29          2HA       GLY  29   1.610   8.348   9.118
  180   2HA   GLY  29          1HA       GLY  29   2.226   9.991   9.118
  181    H    ILE  30           H        ILE  30   1.386   8.975   5.999
  182    HA   ILE  30           HA       ILE  30  -1.086  10.509   6.182
  183    HB   ILE  30           HB       ILE  30   0.502   9.822   3.712
  184   1HG1  ILE  30          2HG1      ILE  30   0.361  12.351   5.365
  185   2HG1  ILE  30          1HG1      ILE  30   1.776  11.335   5.092
  186   1HG2  ILE  30          1HG2      ILE  30  -2.160  10.598   3.949
  187   2HG2  ILE  30          2HG2      ILE  30  -1.169  10.646   2.492
  188   3HG2  ILE  30          3HG2      ILE  30  -1.301  12.075   3.515
  189   1HD1  ILE  30          1HD1      ILE  30   0.343  12.994   3.025
  190   2HD1  ILE  30          2HD1      ILE  30   1.712  11.930   2.706
  191   3HD1  ILE  30          3HD1      ILE  30   1.914  13.339   3.750
  192    H    SER  31           H        SER  31  -2.989   9.549   5.946
  193    HA   SER  31           HA       SER  31  -3.058   6.735   5.162
  194   1HB   SER  31          2HB       SER  31  -5.371   6.773   6.034
  195   2HB   SER  31          1HB       SER  31  -4.220   7.354   7.236
  196    HG   SER  31           HG       SER  31  -5.153   9.234   7.199
  197    H    GLY  32           H        GLY  32  -4.545   5.961   3.540
  198   1HA   GLY  32          2HA       GLY  32  -6.003   7.825   1.924
  199   2HA   GLY  32          1HA       GLY  32  -4.508   7.317   1.155
  200    H    ARG  33           H        ARG  33  -6.043   6.547  -0.470
  201    HA   ARG  33           HA       ARG  33  -7.180   3.952   0.250
  202   1HB   ARG  33          2HB       ARG  33  -8.076   5.942  -1.789
  203   2HB   ARG  33          1HB       ARG  33  -8.549   4.258  -1.878
  204   1HG   ARG  33          2HG       ARG  33 -10.160   5.837  -0.733
  205   2HG   ARG  33          1HG       ARG  33  -9.747   4.348   0.112
  206   1HD   ARG  33          2HD       ARG  33  -8.295   5.494   1.595
  207   2HD   ARG  33          1HD       ARG  33  -8.362   6.971   0.637
  208    HE   ARG  33           HE       ARG  33 -10.955   6.319   1.479
  209   1HH1  ARG  33          1HH1      ARG  33  -7.917   7.395   2.818
  210   2HH1  ARG  33          2HH1      ARG  33  -8.655   8.227   4.145
  211   1HH2  ARG  33          1HH2      ARG  33 -11.926   7.415   3.223
  212   2HH2  ARG  33          2HH2      ARG  33 -10.929   8.240   4.375
  213    H    VAL  34           H        VAL  34  -7.361   2.478  -1.765
  214    HA   VAL  34           HA       VAL  34  -4.583   2.114  -2.638
  215    HB   VAL  34           HB       VAL  34  -5.587   0.342  -1.290
  216   1HG1  VAL  34          1HG1      VAL  34  -7.342  -1.061  -2.120
  217   2HG1  VAL  34          2HG1      VAL  34  -7.386  -0.182  -3.647
  218   3HG1  VAL  34          3HG1      VAL  34  -7.898   0.612  -2.158
  219   1HG2  VAL  34          1HG2      VAL  34  -5.028  -0.595  -4.100
  220   2HG2  VAL  34          2HG2      VAL  34  -4.813  -1.510  -2.608
  221   3HG2  VAL  34          3HG2      VAL  34  -3.786  -0.117  -2.943
  222    H    VAL  35           H        VAL  35  -4.002   1.229  -4.683
  223    HA   VAL  35           HA       VAL  35  -5.984   1.448  -6.841
  224    HB   VAL  35           HB       VAL  35  -3.178   2.325  -7.271
  225   1HG1  VAL  35          1HG1      VAL  35  -3.997   1.832  -9.335
  226   2HG1  VAL  35          2HG1      VAL  35  -4.477   3.524  -9.210
  227   3HG1  VAL  35          3HG1      VAL  35  -5.653   2.248  -8.891
  228   1HG2  VAL  35          1HG2      VAL  35  -3.526   4.300  -6.377
  229   2HG2  VAL  35          2HG2      VAL  35  -5.118   3.767  -5.877
  230   3HG2  VAL  35          3HG2      VAL  35  -4.902   4.542  -7.442
  231    H    ASP  36           H        ASP  36  -2.656   0.605  -6.039
  232    HA   ASP  36           HA       ASP  36  -2.971  -2.090  -6.937
  233   1HB   ASP  36          2HB       ASP  36  -2.624  -0.978  -9.095
  234   2HB   ASP  36          1HB       ASP  36  -1.139  -0.252  -8.490
  235    H    GLU  37           H        GLU  37  -0.996  -3.372  -6.617
  236    HA   GLU  37           HA       GLU  37   0.806  -2.151  -4.630
  237   1HB   GLU  37          2HB       GLU  37  -0.165  -5.017  -4.748
  238   2HB   GLU  37          1HB       GLU  37   1.001  -4.385  -3.592
  239   1HG   GLU  37          2HG       GLU  37  -0.705  -2.885  -2.693
  240   2HG   GLU  37          1HG       GLU  37  -1.872  -3.524  -3.847
  241    H    THR  38           H        THR  38   2.663  -1.766  -5.712
  242    HA   THR  38           HA       THR  38   3.590  -3.769  -7.642
  243    HB   THR  38           HB       THR  38   4.543  -0.936  -7.206
  244    HG1  THR  38           1HG      THR  38   2.734  -2.054  -9.072
  245   1HG2  THR  38          1HG2      THR  38   5.901  -1.099  -9.022
  246   2HG2  THR  38          2HG2      THR  38   4.968  -2.411  -9.743
  247   3HG2  THR  38          3HG2      THR  38   6.047  -2.737  -8.388
  248    H    ARG  39           H        ARG  39   5.697  -4.560  -7.599
  249    HA   ARG  39           HA       ARG  39   6.724  -5.330  -5.156
  250   1HB   ARG  39          2HB       ARG  39   8.752  -5.976  -6.391
  251   2HB   ARG  39          1HB       ARG  39   7.286  -6.456  -7.237
  252   1HG   ARG  39          2HG       ARG  39   7.515  -4.465  -8.684
  253   2HG   ARG  39          1HG       ARG  39   9.041  -4.096  -7.879
  254   1HD   ARG  39          2HD       ARG  39   9.947  -6.248  -8.613
  255   2HD   ARG  39          1HD       ARG  39   8.419  -6.618  -9.412
  256    HE   ARG  39           HE       ARG  39   9.401  -4.169 -10.382
  257   1HH1  ARG  39          1HH1      ARG  39  10.097  -7.586 -10.515
  258   2HH1  ARG  39          2HH1      ARG  39  10.860  -7.498 -12.067
  259   1HH2  ARG  39          1HH2      ARG  39  10.404  -4.051 -12.424
  260   2HH2  ARG  39          2HH2      ARG  39  11.034  -5.491 -13.150
  261    H    ASN  40           H        ASN  40   7.156  -2.315  -6.810
  262    HA   ASN  40           HA       ASN  40   8.941  -1.472  -4.650
  263   1HB   ASN  40          2HB       ASN  40  10.348  -0.210  -6.218
  264   2HB   ASN  40          1HB       ASN  40  10.397  -1.937  -6.525
  265   1HD2  ASN  40          1HD2      ASN  40   7.456  -0.790  -7.652
  266   2HD2  ASN  40          2HD2      ASN  40   7.899  -0.536  -9.295
  267    H    THR  41           H        THR  41   6.008  -0.978  -5.692
  268    HA   THR  41           HA       THR  41   6.001   1.758  -4.813
  269    HB   THR  41           HB       THR  41   4.686   2.509  -6.877
  270    HG1  THR  41           1HG      THR  41   4.874   1.351  -8.682
  271   1HG2  THR  41          1HG2      THR  41   7.031   3.194  -6.329
  272   2HG2  THR  41          2HG2      THR  41   6.593   3.244  -8.036
  273   3HG2  THR  41          3HG2      THR  41   7.573   1.917  -7.418
  274    H    LEU  42           H        LEU  42   3.916   2.615  -4.430
  275    HA   LEU  42           HA       LEU  42   1.739   0.638  -4.419
  276   1HB   LEU  42          2HB       LEU  42   2.819   0.725  -2.203
  277   2HB   LEU  42          1HB       LEU  42   2.503   2.442  -2.117
  278    HG   LEU  42           HG       LEU  42   0.947   1.119  -0.750
  279   1HD1  LEU  42          1HD1      LEU  42  -0.944   2.356  -1.269
  280   2HD1  LEU  42          2HD1      LEU  42  -0.673   2.239  -3.006
  281   3HD1  LEU  42          3HD1      LEU  42   0.338   3.302  -2.028
  282   1HD2  LEU  42          1HD2      LEU  42  -0.390   0.097  -3.214
  283   2HD2  LEU  42          2HD2      LEU  42  -0.424  -0.537  -1.569
  284   3HD2  LEU  42          3HD2      LEU  42   1.003  -0.776  -2.579
  285    H    ARG  43           H        ARG  43   0.224   1.473  -5.697
  286    HA   ARG  43           HA       ARG  43  -0.041   4.368  -5.896
  287   1HB   ARG  43          2HB       ARG  43   0.043   2.800  -7.898
  288   2HB   ARG  43          1HB       ARG  43  -1.575   2.291  -7.453
  289   1HG   ARG  43          2HG       ARG  43  -2.384   4.572  -7.749
  290   2HG   ARG  43          1HG       ARG  43  -0.753   5.105  -8.144
  291   1HD   ARG  43          2HD       ARG  43  -0.747   3.611 -10.090
  292   2HD   ARG  43          1HD       ARG  43  -2.384   3.091  -9.695
  293    HE   ARG  43           HE       ARG  43  -3.144   4.957 -10.746
  294   1HH1  ARG  43          1HH1      ARG  43   0.156   5.545  -9.772
  295   2HH1  ARG  43          2HH1      ARG  43   0.208   7.131 -10.465
  296   1HH2  ARG  43          1HH2      ARG  43  -3.073   7.041 -11.661
  297   2HH2  ARG  43          2HH2      ARG  43  -1.622   7.980 -11.538
  298    H    ILE  44           H        ILE  44  -1.495   5.473  -4.836
  299    HA   ILE  44           HA       ILE  44  -3.568   4.105  -3.297
  300    HB   ILE  44           HB       ILE  44  -2.368   6.867  -3.118
  301   1HG1  ILE  44          2HG1      ILE  44  -2.255   4.482  -1.262
  302   2HG1  ILE  44          1HG1      ILE  44  -0.952   5.054  -2.299
  303   1HG2  ILE  44          1HG2      ILE  44  -4.942   6.291  -2.335
  304   2HG2  ILE  44          2HG2      ILE  44  -3.945   7.624  -1.760
  305   3HG2  ILE  44          3HG2      ILE  44  -4.009   6.116  -0.849
  306   1HD1  ILE  44          1HD1      ILE  44  -0.256   6.141  -0.483
  307   2HD1  ILE  44          2HD1      ILE  44  -1.820   5.993   0.319
  308   3HD1  ILE  44          3HD1      ILE  44  -1.546   7.286  -0.849
  309    H    GLU  45           H        GLU  45  -5.623   4.056  -4.051
  310    HA   GLU  45           HA       GLU  45  -6.614   6.462  -5.409
  311   1HB   GLU  45          2HB       GLU  45  -6.488   4.987  -7.233
  312   2HB   GLU  45          1HB       GLU  45  -7.008   3.605  -6.285
  313   1HG   GLU  45          2HG       GLU  45  -9.260   4.564  -6.160
  314   2HG   GLU  45          1HG       GLU  45  -8.718   5.933  -7.127
  315    H    MET  46           H        MET  46  -8.488   7.173  -4.834
  316    HA   MET  46           HA       MET  46  -9.872   5.910  -2.584
  317   1HB   MET  46          2HB       MET  46  -9.791   8.742  -3.624
  318   2HB   MET  46          1HB       MET  46 -10.919   8.220  -2.386
  319   1HG   MET  46          2HG       MET  46  -9.005   9.346  -1.424
  320   2HG   MET  46          1HG       MET  46  -9.076   7.668  -0.911
  321   1HE   MET  46          1HE       MET  46  -6.636   9.355  -4.224
  322   2HE   MET  46          2HE       MET  46  -6.149  10.185  -2.751
  323   3HE   MET  46          3HE       MET  46  -7.842  10.181  -3.241
  324    H    ASP  47           H        ASP  47 -11.911   5.200  -2.760
  325    HA   ASP  47           HA       ASP  47 -13.122   4.556  -5.113
  326   1HB   ASP  47          2HB       ASP  47 -14.511   5.239  -2.518
  327   2HB   ASP  47          1HB       ASP  47 -15.228   4.330  -3.845
  328    H    ASP  48           H        ASP  48 -13.138   7.644  -3.558
  329    HA   ASP  48           HA       ASP  48 -15.378   8.785  -4.816
  330   1HB   ASP  48          2HB       ASP  48 -12.847  10.123  -3.834
  331   2HB   ASP  48          1HB       ASP  48 -14.344  10.956  -4.245
  332    H    GLY  49           H        GLY  49 -12.438   7.769  -6.141
  333   1HA   GLY  49          2HA       GLY  49 -12.124   7.734  -8.503
  334   2HA   GLY  49          1HA       GLY  49 -13.037   9.232  -8.616
  335    H    ARG  50           H        ARG  50 -10.650   8.889  -6.143
  336    HA   ARG  50           HA       ARG  50  -8.959  10.837  -7.563
  337   1HB   ARG  50          2HB       ARG  50  -9.135  10.189  -4.617
  338   2HB   ARG  50          1HB       ARG  50  -8.039  11.367  -5.320
  339   1HG   ARG  50          2HG       ARG  50  -9.919  12.703  -6.071
  340   2HG   ARG  50          1HG       ARG  50 -11.045  11.499  -5.443
  341   1HD   ARG  50          2HD       ARG  50 -10.821  13.383  -3.908
  342   2HD   ARG  50          1HD       ARG  50 -10.220  11.894  -3.182
  343    HE   ARG  50           HE       ARG  50  -8.074  13.227  -4.387
  344   1HH1  ARG  50          1HH1      ARG  50 -10.269  13.613  -1.702
  345   2HH1  ARG  50          2HH1      ARG  50  -9.144  14.524  -0.752
  346   1HH2  ARG  50          1HH2      ARG  50  -6.593  14.425  -3.138
  347   2HH2  ARG  50          2HH2      ARG  50  -7.058  14.986  -1.566
  348    H    GLU  51           H        GLU  51  -6.598  10.623  -7.310
  349    HA   GLU  51           HA       GLU  51  -5.648   7.975  -6.574
  350   1HB   GLU  51          2HB       GLU  51  -5.287   9.092  -9.358
  351   2HB   GLU  51          1HB       GLU  51  -4.495   7.651  -8.739
  352   1HG   GLU  51          2HG       GLU  51  -6.673   6.584  -8.438
  353   2HG   GLU  51          1HG       GLU  51  -7.464   8.029  -9.065
  354    H    ILE  52           H        ILE  52  -3.512   7.874  -6.048
  355    HA   ILE  52           HA       ILE  52  -1.672  10.022  -6.577
  356    HB   ILE  52           HB       ILE  52  -2.902  10.962  -4.677
  357   1HG1  ILE  52          2HG1      ILE  52  -0.118  10.020  -3.952
  358   2HG1  ILE  52          1HG1      ILE  52  -0.508  11.452  -4.905
  359   1HG2  ILE  52          1HG2      ILE  52  -1.887   8.887  -2.820
  360   2HG2  ILE  52          2HG2      ILE  52  -3.302   8.496  -3.797
  361   3HG2  ILE  52          3HG2      ILE  52  -3.333   9.891  -2.718
  362   1HD1  ILE  52          1HD1      ILE  52   0.055  12.052  -2.608
  363   2HD1  ILE  52          2HD1      ILE  52  -1.237  11.008  -2.009
  364   3HD1  ILE  52          3HD1      ILE  52  -1.631  12.438  -2.962
  365    H    THR  53           H        THR  53   0.435   9.302  -6.455
  366    HA   THR  53           HA       THR  53   0.775   6.468  -5.868
  367    HB   THR  53           HB       THR  53   1.649   7.288  -7.979
  368    HG1  THR  53           1HG      THR  53   3.027   5.767  -7.544
  369   1HG2  THR  53          1HG2      THR  53   3.936   8.736  -6.982
  370   2HG2  THR  53          2HG2      THR  53   2.420   9.552  -6.590
  371   3HG2  THR  53          3HG2      THR  53   2.801   9.155  -8.267
  372    H    VAL  54           H        VAL  54   2.298   5.608  -4.462
  373    HA   VAL  54           HA       VAL  54   3.874   7.362  -2.777
  374    HB   VAL  54           HB       VAL  54   1.795   5.552  -1.537
  375   1HG1  VAL  54          1HG1      VAL  54   2.559   6.820   0.557
  376   2HG1  VAL  54          2HG1      VAL  54   3.979   7.268  -0.386
  377   3HG1  VAL  54          3HG1      VAL  54   3.630   5.568  -0.073
  378   1HG2  VAL  54          1HG2      VAL  54   0.622   7.428  -2.343
  379   2HG2  VAL  54          2HG2      VAL  54   1.918   8.536  -1.895
  380   3HG2  VAL  54          3HG2      VAL  54   0.931   7.781  -0.643
  381    HA   PRO  55           HA       PRO  55   6.485   3.748  -3.422
  382   1HB   PRO  55          2HB       PRO  55   8.232   5.111  -1.464
  383   2HB   PRO  55          1HB       PRO  55   8.581   4.599  -3.119
  384   1HG   PRO  55          2HG       PRO  55   8.273   7.180  -2.515
  385   2HG   PRO  55          1HG       PRO  55   7.666   6.516  -4.046
  386   1HD   PRO  55          2HD       PRO  55   6.163   7.172  -1.535
  387   2HD   PRO  55          1HD       PRO  55   5.715   7.472  -3.228
  388    H    LYS  56           H        LYS  56   6.050   1.865  -2.430
  389    HA   LYS  56           HA       LYS  56   5.736   1.831   0.486
  390   1HB   LYS  56          2HB       LYS  56   4.698  -0.376   0.180
  391   2HB   LYS  56          1HB       LYS  56   3.873   0.883  -0.722
  392   1HG   LYS  56          2HG       LYS  56   4.812   0.134  -2.777
  393   2HG   LYS  56          1HG       LYS  56   5.909  -0.965  -1.941
  394   1HD   LYS  56          2HD       LYS  56   2.901  -1.186  -1.879
  395   2HD   LYS  56          1HD       LYS  56   3.943  -2.094  -2.975
  396   1HE   LYS  56          2HE       LYS  56   5.069  -3.116  -1.060
  397   2HE   LYS  56          1HE       LYS  56   4.041  -2.200   0.039
  398   1HZ   LYS  56          1HZ       LYS  56   2.187  -3.382  -1.416
  399   2HZ   LYS  56          2HZ       LYS  56   2.854  -4.105  -0.039
  400   3HZ   LYS  56          3HZ       LYS  56   3.411  -4.541  -1.576
  401    H    GLY  57           H        GLY  57   8.172   1.275  -1.696
  402   1HA   GLY  57          2HA       GLY  57   9.295  -1.162  -1.089
  403   2HA   GLY  57          1HA       GLY  57  10.239   0.277  -1.430
  404    H    ILE  58           H        ILE  58   9.014   1.579   0.984
  405    HA   ILE  58           HA       ILE  58  10.109   0.042   3.167
  406    HB   ILE  58           HB       ILE  58  11.079   2.850   2.624
  407   1HG1  ILE  58          2HG1      ILE  58  13.346   1.640   2.429
  408   2HG1  ILE  58          1HG1      ILE  58  12.398   0.177   2.185
  409   1HG2  ILE  58          1HG2      ILE  58  10.806   2.019   5.024
  410   2HG2  ILE  58          2HG2      ILE  58  12.364   2.704   4.569
  411   3HG2  ILE  58          3HG2      ILE  58  12.166   0.954   4.678
  412   1HD1  ILE  58          1HD1      ILE  58  12.248   0.666   0.040
  413   2HD1  ILE  58          2HD1      ILE  58  13.127   2.172   0.303
  414   3HD1  ILE  58          3HD1      ILE  58  11.369   2.140   0.443
  415    H    ALA  59           H        ALA  59   7.546   0.274   3.007
  416    HA   ALA  59           HA       ALA  59   6.878   2.280   4.998
  417   1HB   ALA  59          1HB       ALA  59   5.354   3.483   3.799
  418   2HB   ALA  59          2HB       ALA  59   5.024   2.157   2.681
  419   3HB   ALA  59          3HB       ALA  59   6.515   3.090   2.531
  420    H    VAL  60           H        VAL  60   5.887   1.231   6.586
  421    HA   VAL  60           HA       VAL  60   4.367  -1.184   6.070
  422    HB   VAL  60           HB       VAL  60   5.765  -1.081   8.083
  423   1HG1  VAL  60          1HG1      VAL  60   4.930   1.506   8.304
  424   2HG1  VAL  60          2HG1      VAL  60   5.751   0.595   9.573
  425   3HG1  VAL  60          3HG1      VAL  60   3.990   0.712   9.568
  426   1HG2  VAL  60          1HG2      VAL  60   3.984  -1.710   9.753
  427   2HG2  VAL  60          2HG2      VAL  60   3.920  -2.572   8.217
  428   3HG2  VAL  60          3HG2      VAL  60   2.791  -1.254   8.538
  429    H    PHE  61           H        PHE  61   2.178  -1.312   5.916
  430    HA   PHE  61           HA       PHE  61   0.533   0.790   7.020
  431   1HB   PHE  61          2HB       PHE  61  -0.625   1.109   4.752
  432   2HB   PHE  61          1HB       PHE  61   0.916   1.912   5.013
  433    HD1  PHE  61           1HD      PHE  61   2.272   1.951   3.195
  434    HD2  PHE  61           2HD      PHE  61  -0.201  -1.454   3.817
  435    HE1  PHE  61           1HE      PHE  61   3.160   0.939   1.138
  436    HE2  PHE  61           2HE      PHE  61   0.688  -2.475   1.760
  437    HZ   PHE  61           HZ       PHE  61   2.367  -1.278   0.420
  438    H    HIS  62           H        HIS  62  -1.666   0.314   7.120
  439    HA   HIS  62           HA       HIS  62  -2.295  -2.539   6.730
  440   1HB   HIS  62          2HB       HIS  62  -3.524  -0.635   8.733
  441   2HB   HIS  62          1HB       HIS  62  -3.762  -2.376   8.646
  442    HD1  HIS  62           1HD      HIS  62  -1.274  -3.708   8.898
  443    HD2  HIS  62           2HD      HIS  62  -1.758   0.028  10.645
  444    HE1  HIS  62           1HE      HIS  62   0.525  -3.546  10.645
  445    HE2  HIS  62           2HE      HIS  62   0.149  -1.318  11.757
  446    H    PHE  63           H        PHE  63  -4.175  -3.083   5.666
  447    HA   PHE  63           HA       PHE  63  -5.590  -0.859   4.393
  448   1HB   PHE  63          2HB       PHE  63  -5.615  -3.811   3.743
  449   2HB   PHE  63          1HB       PHE  63  -6.521  -2.582   2.871
  450    HD1  PHE  63           1HD      PHE  63  -3.001  -3.078   4.025
  451    HD2  PHE  63           2HD      PHE  63  -5.628  -1.963   0.869
  452    HE1  PHE  63           1HE      PHE  63  -1.072  -2.700   2.554
  453    HE2  PHE  63           2HE      PHE  63  -3.699  -1.583  -0.608
  454    HZ   PHE  63           HZ       PHE  63  -1.415  -1.953   0.234
  455    H    ARG  64           H        ARG  64  -7.449  -0.203   5.203
  456    HA   ARG  64           HA       ARG  64  -8.952  -2.005   6.959
  457   1HB   ARG  64          2HB       ARG  64  -9.342   0.962   6.514
  458   2HB   ARG  64          1HB       ARG  64 -10.080  -0.018   7.775
  459   1HG   ARG  64          2HG       ARG  64  -7.145   0.588   7.499
  460   2HG   ARG  64          1HG       ARG  64  -8.258   1.325   8.652
  461   1HD   ARG  64          2HD       ARG  64  -8.666  -0.894   9.638
  462   2HD   ARG  64          1HD       ARG  64  -7.504  -1.593   8.510
  463    HE   ARG  64           HE       ARG  64  -5.850  -0.905   9.912
  464   1HH1  ARG  64          1HH1      ARG  64  -8.662   1.076  10.516
  465   2HH1  ARG  64          2HH1      ARG  64  -7.907   1.974  11.788
  466   1HH2  ARG  64          1HH2      ARG  64  -4.861   0.275  11.588
  467   2HH2  ARG  64          2HH2      ARG  64  -5.752   1.520  12.398
  468    H    THR  65           H        THR  65 -10.745  -2.971   6.243
  469    HA   THR  65           HA       THR  65 -11.928  -2.032   3.733
  470    HB   THR  65           HB       THR  65 -12.343  -4.637   5.206
  471    HG1  THR  65           1HG      THR  65 -10.296  -4.616   4.375
  472   1HG2  THR  65          1HG2      THR  65 -13.474  -3.559   2.687
  473   2HG2  THR  65          2HG2      THR  65 -14.211  -4.594   3.910
  474   3HG2  THR  65          3HG2      THR  65 -13.057  -5.270   2.762
  475    HA   PRO  66           HA       PRO  66 -15.281  -0.003   5.854
  476   1HB   PRO  66          2HB       PRO  66 -16.747  -0.965   3.433
  477   2HB   PRO  66          1HB       PRO  66 -16.733   0.640   4.174
  478   1HG   PRO  66          2HG       PRO  66 -15.326   0.160   1.968
  479   2HG   PRO  66          1HG       PRO  66 -14.675   1.193   3.255
  480   1HD   PRO  66          2HD       PRO  66 -13.955  -1.600   2.518
  481   2HD   PRO  66          1HD       PRO  66 -12.940  -0.312   3.194
  482    H    GLN  67           H        GLN  67 -15.555  -3.232   4.477
  483    HA   GLN  67           HA       GLN  67 -17.983  -3.977   5.678
  484   1HB   GLN  67          2HB       GLN  67 -16.961  -5.258   3.859
  485   2HB   GLN  67          1HB       GLN  67 -15.621  -5.700   4.909
  486   1HG   GLN  67          2HG       GLN  67 -17.156  -6.924   6.358
  487   2HG   GLN  67          1HG       GLN  67 -18.500  -6.478   5.312
  488   1HE2  GLN  67          1HE2      GLN  67 -15.931  -6.942   3.303
  489   2HE2  GLN  67          2HE2      GLN  67 -16.175  -8.603   2.910
  490    H    GLY  68           H        GLY  68 -14.910  -3.415   7.039
  491   1HA   GLY  68          2HA       GLY  68 -14.680  -3.231   9.413
  492   2HA   GLY  68          1HA       GLY  68 -15.853  -4.529   9.590
  493    H    GLU  69           H        GLU  69 -12.963  -4.354   7.532
  494    HA   GLU  69           HA       GLU  69 -11.914  -6.685   9.010
  495   1HB   GLU  69          2HB       GLU  69 -11.499  -6.046   6.086
  496   2HB   GLU  69          1HB       GLU  69 -10.884  -7.453   6.937
  497   1HG   GLU  69          2HG       GLU  69 -13.788  -6.807   6.475
  498   2HG   GLU  69          1HG       GLU  69 -12.836  -7.998   5.589
  499    H    LEU  70           H        LEU  70  -9.628  -6.866   9.210
  500    HA   LEU  70           HA       LEU  70  -8.189  -4.316   8.879
  501   1HB   LEU  70          2HB       LEU  70  -8.792  -4.760  11.236
  502   2HB   LEU  70          1HB       LEU  70  -7.919  -6.277  11.160
  503    HG   LEU  70           HG       LEU  70  -6.677  -4.466  12.314
  504   1HD1  LEU  70          1HD1      LEU  70  -5.151  -5.081   9.825
  505   2HD1  LEU  70          2HD1      LEU  70  -5.651  -6.401  10.883
  506   3HD1  LEU  70          3HD1      LEU  70  -4.621  -5.112  11.507
  507   1HD2  LEU  70          1HD2      LEU  70  -6.576  -3.206   9.576
  508   2HD2  LEU  70          2HD2      LEU  70  -5.733  -2.639  11.018
  509   3HD2  LEU  70          3HD2      LEU  70  -7.496  -2.596  10.952
  510    H    VAL  71           H        VAL  71  -6.739  -4.607   7.312
  511    HA   VAL  71           HA       VAL  71  -5.297  -7.178   7.199
  512    HB   VAL  71           HB       VAL  71  -5.664  -5.158   4.985
  513   1HG1  VAL  71          1HG1      VAL  71  -4.803  -7.047   3.567
  514   2HG1  VAL  71          2HG1      VAL  71  -4.343  -7.861   5.062
  515   3HG1  VAL  71          3HG1      VAL  71  -3.617  -6.309   4.641
  516   1HG2  VAL  71          1HG2      VAL  71  -6.939  -7.322   4.086
  517   2HG2  VAL  71          2HG2      VAL  71  -7.747  -6.059   5.015
  518   3HG2  VAL  71          3HG2      VAL  71  -7.214  -7.539   5.814
  519    H    GLU  72           H        GLU  72  -3.018  -7.099   6.613
  520    HA   GLU  72           HA       GLU  72  -1.714  -4.545   7.254
  521   1HB   GLU  72          2HB       GLU  72  -1.647  -5.872   9.275
  522   2HB   GLU  72          1HB       GLU  72  -1.029  -7.259   8.390
  523   1HG   GLU  72          2HG       GLU  72   1.028  -6.008   7.900
  524   2HG   GLU  72          1HG       GLU  72   0.410  -4.653   8.844
  525    H    ILE  73           H        ILE  73   0.238  -4.136   6.261
  526    HA   ILE  73           HA       ILE  73   1.430  -6.141   4.523
  527    HB   ILE  73           HB       ILE  73   0.470  -3.490   3.434
  528   1HG1  ILE  73          2HG1      ILE  73  -1.344  -5.146   3.717
  529   2HG1  ILE  73          1HG1      ILE  73  -1.024  -4.799   2.021
  530   1HG2  ILE  73          1HG2      ILE  73   1.217  -4.900   1.270
  531   2HG2  ILE  73          2HG2      ILE  73   2.373  -5.514   2.452
  532   3HG2  ILE  73          3HG2      ILE  73   2.283  -3.785   2.124
  533   1HD1  ILE  73          1HD1      ILE  73   0.242  -7.153   3.366
  534   2HD1  ILE  73          2HD1      ILE  73  -0.058  -6.879   1.651
  535   3HD1  ILE  73          3HD1      ILE  73  -1.403  -7.237   2.736
  536    H    ASP  74           H        ASP  74   3.547  -6.043   4.925
  537    HA   ASP  74           HA       ASP  74   4.657  -3.637   6.107
  538   1HB   ASP  74          2HB       ASP  74   5.870  -6.363   5.645
  539   2HB   ASP  74          1HB       ASP  74   6.681  -5.034   6.463
  540    H    GLY  75           H        GLY  75   5.017  -2.118   4.612
  541   1HA   GLY  75          2HA       GLY  75   6.042  -2.609   2.007
  542   2HA   GLY  75          1HA       GLY  75   5.927  -1.046   2.793
  543    H    ARG  76           H        ARG  76   7.533  -2.591   5.042
  544    HA   ARG  76           HA       ARG  76  10.040  -1.509   4.253
  545   1HB   ARG  76          2HB       ARG  76   9.316  -1.388   6.570
  546   2HB   ARG  76          1HB       ARG  76   9.250  -3.142   6.660
  547   1HG   ARG  76          2HG       ARG  76  11.234  -2.451   7.751
  548   2HG   ARG  76          1HG       ARG  76  11.712  -3.173   6.214
  549   1HD   ARG  76          2HD       ARG  76  12.990  -1.171   6.549
  550   2HD   ARG  76          1HD       ARG  76  11.838  -0.894   5.243
  551    HE   ARG  76           HE       ARG  76  10.942   0.779   6.495
  552   1HH1  ARG  76          1HH1      ARG  76  12.592  -1.410   8.653
  553   2HH1  ARG  76          2HH1      ARG  76  12.249  -0.471  10.067
  554   1HH2  ARG  76          1HH2      ARG  76  10.495   2.017   8.352
  555   2HH2  ARG  76          2HH2      ARG  76  11.061   1.474   9.896
  556    H    ALA  77           H        ALA  77   9.286  -4.760   5.397
  557    HA   ALA  77           HA       ALA  77  11.532  -5.778   3.877
  558   1HB   ALA  77          1HB       ALA  77  11.858  -6.591   5.960
  559   2HB   ALA  77          2HB       ALA  77  10.869  -7.899   5.312
  560   3HB   ALA  77          3HB       ALA  77  10.131  -6.651   6.316
  561    H    LEU  78           H        LEU  78   8.213  -6.776   4.544
  562    HA   LEU  78           HA       LEU  78   8.025  -8.908   2.834
  563   1HB   LEU  78          2HB       LEU  78   5.906  -6.885   3.527
  564   2HB   LEU  78          1HB       LEU  78   5.579  -8.378   2.669
  565    HG   LEU  78           HG       LEU  78   6.648  -8.140   5.484
  566   1HD1  LEU  78          1HD1      LEU  78   4.445  -9.424   5.892
  567   2HD1  LEU  78          2HD1      LEU  78   3.965  -8.780   4.322
  568   3HD1  LEU  78          3HD1      LEU  78   4.382  -7.681   5.637
  569   1HD2  LEU  78          1HD2      LEU  78   6.393 -10.594   5.544
  570   2HD2  LEU  78          2HD2      LEU  78   7.633 -10.061   4.409
  571   3HD2  LEU  78          3HD2      LEU  78   6.057 -10.578   3.812
  572    H    VAL  79           H        VAL  79   8.225  -5.583   1.989
  573    HA   VAL  79           HA       VAL  79   7.021  -5.578  -0.528
  574    HB   VAL  79           HB       VAL  79   7.781  -3.527   0.580
  575   1HG1  VAL  79          1HG1      VAL  79   9.886  -3.127   1.228
  576   2HG1  VAL  79          2HG1      VAL  79  10.567  -3.737  -0.279
  577   3HG1  VAL  79          3HG1      VAL  79  10.130  -4.859   1.010
  578   1HG2  VAL  79          1HG2      VAL  79   7.851  -2.499  -1.397
  579   2HG2  VAL  79          2HG2      VAL  79   7.881  -4.103  -2.129
  580   3HG2  VAL  79          3HG2      VAL  79   9.391  -3.248  -1.818
  581    H    ALA  80           H        ALA  80   7.411  -7.232  -1.909
  582    HA   ALA  80           HA       ALA  80   9.812  -8.602  -2.259
  583   1HB   ALA  80          1HB       ALA  80   7.865  -8.202  -4.503
  584   2HB   ALA  80          2HB       ALA  80   7.457  -9.187  -3.099
  585   3HB   ALA  80          3HB       ALA  80   8.832  -9.625  -4.115
  586    H    ARG  81           H        ARG  81  11.369  -8.555  -3.987
  587    HA   ARG  81           HA       ARG  81  11.700  -5.827  -5.128
  588   1HB   ARG  81          2HB       ARG  81  13.841  -7.811  -4.329
  589   2HB   ARG  81          1HB       ARG  81  14.135  -6.245  -5.070
  590   1HG   ARG  81          2HG       ARG  81  13.154  -5.137  -3.128
  591   2HG   ARG  81          1HG       ARG  81  12.855  -6.709  -2.383
  592   1HD   ARG  81          2HD       ARG  81  14.882  -5.708  -1.479
  593   2HD   ARG  81          1HD       ARG  81  15.264  -7.167  -2.392
  594    HE   ARG  81           HE       ARG  81  16.557  -5.882  -3.748
  595   1HH1  ARG  81          1HH1      ARG  81  14.189  -3.803  -2.242
  596   2HH1  ARG  81          2HH1      ARG  81  14.790  -2.366  -2.997
  597   1HH2  ARG  81          1HH2      ARG  81  17.351  -3.992  -4.734
  598   2HH2  ARG  81          2HH2      ARG  81  16.586  -2.472  -4.409
  599    HA   PRO  82           HA       PRO  82  11.777  -7.068  -9.432
  600   1HB   PRO  82          2HB       PRO  82  14.761  -6.823  -9.187
  601   2HB   PRO  82          1HB       PRO  82  13.703  -6.284 -10.497
  602   1HG   PRO  82          2HG       PRO  82  14.627  -4.592  -8.596
  603   2HG   PRO  82          1HG       PRO  82  13.052  -4.385  -9.377
  604   1HD   PRO  82          2HD       PRO  82  13.656  -5.109  -6.612
  605   2HD   PRO  82          1HD       PRO  82  12.107  -4.625  -7.327
  606    H    GLU  83           H        GLU  83  14.131  -8.277  -7.228
  607    HA   GLU  83           HA       GLU  83  14.642 -10.841  -8.351
  608   1HB   GLU  83          2HB       GLU  83  14.941  -9.769  -5.556
  609   2HB   GLU  83          1HB       GLU  83  15.602 -11.295  -6.119
  610   1HG   GLU  83          2HG       GLU  83  17.016 -10.092  -7.713
  611   2HG   GLU  83          1HG       GLU  83  16.357  -8.563  -7.133
  612    H    GLU  84           H        GLU  84  11.835  -9.917  -7.892
  613    HA   GLU  84           HA       GLU  84  10.422 -10.725  -5.825
  614   1HB   GLU  84          2HB       GLU  84   9.649 -11.271  -8.691
  615   2HB   GLU  84          1HB       GLU  84   8.536 -11.254  -7.331
  616   1HG   GLU  84          2HG       GLU  84   9.042  -8.902  -6.937
  617   2HG   GLU  84          1HG       GLU  84  10.167  -8.916  -8.294
  618    H    ARG  85           H        ARG  85  12.231 -12.951  -7.732
  619    HA   ARG  85           HA       ARG  85  10.735 -15.267  -6.860
  620   1HB   ARG  85          2HB       ARG  85  13.598 -15.056  -7.868
  621   2HB   ARG  85          1HB       ARG  85  12.689 -16.547  -7.664
  622   1HG   ARG  85          2HG       ARG  85  11.128 -15.841  -9.401
  623   2HG   ARG  85          1HG       ARG  85  12.027 -14.336  -9.600
  624   1HD   ARG  85          2HD       ARG  85  14.015 -15.624 -10.245
  625   2HD   ARG  85          1HD       ARG  85  13.100 -17.118 -10.063
  626    HE   ARG  85           HE       ARG  85  12.274 -16.771 -12.153
  627   1HH1  ARG  85          1HH1      ARG  85  13.291 -13.684 -10.876
  628   2HH1  ARG  85          2HH1      ARG  85  12.874 -12.814 -12.314
  629   1HH2  ARG  85          1HH2      ARG  85  11.734 -15.627 -14.044
  630   2HH2  ARG  85          2HH2      ARG  85  11.994 -13.916 -14.112
  631    H    ILE  86           H        ILE  86  10.662 -14.085  -4.723
  632    HA   ILE  86           HA       ILE  86  12.815 -13.532  -3.110
  633    HB   ILE  86           HB       ILE  86  10.099 -14.519  -2.211
  634   1HG1  ILE  86          2HG1      ILE  86   9.897 -12.598  -3.693
  635   2HG1  ILE  86          1HG1      ILE  86   9.566 -12.105  -2.037
  636   1HG2  ILE  86          1HG2      ILE  86  11.007 -12.712  -0.355
  637   2HG2  ILE  86          2HG2      ILE  86  12.468 -13.608  -0.772
  638   3HG2  ILE  86          3HG2      ILE  86  11.043 -14.468  -0.184
  639   1HD1  ILE  86          1HD1      ILE  86  11.496 -11.086  -3.871
  640   2HD1  ILE  86          2HD1      ILE  86  12.318 -11.722  -2.445
  641   3HD1  ILE  86          3HD1      ILE  86  11.061 -10.498  -2.267
  Start of MODEL   18
    1    H    ARG   9           H        ARG   9 -12.170 -11.415  -9.457
    2    HA   ARG   9           HA       ARG   9  -9.957 -11.777  -9.087
    3   1HB   ARG   9          2HB       ARG   9  -9.582 -10.469 -11.789
    4   2HB   ARG   9          1HB       ARG   9  -8.360 -11.380 -10.913
    5   1HG   ARG   9          2HG       ARG   9  -9.734 -13.392 -11.082
    6   2HG   ARG   9          1HG       ARG   9 -10.964 -12.478 -11.954
    7   1HD   ARG   9          2HD       ARG   9  -9.360 -12.011 -13.738
    8   2HD   ARG   9          1HD       ARG   9  -8.118 -12.905 -12.861
    9    HE   ARG   9           HE       ARG   9 -10.109 -13.996 -14.545
   10   1HH1  ARG   9          1HH1      ARG   9  -8.373 -14.634 -11.585
   11   2HH1  ARG   9          2HH1      ARG   9  -8.595 -16.348 -11.678
   12   1HH2  ARG   9          1HH2      ARG   9 -10.396 -16.250 -14.672
   13   2HH2  ARG   9          2HH2      ARG   9  -9.740 -17.265 -13.431
   14    H    HIS  10           H        HIS  10  -8.508 -10.743  -7.847
   15    HA   HIS  10           HA       HIS  10  -7.433  -9.075  -6.736
   16   1HB   HIS  10          2HB       HIS  10  -7.953  -7.503  -9.267
   17   2HB   HIS  10          1HB       HIS  10  -6.850  -7.026  -7.980
   18    HD1  HIS  10           1HD      HIS  10  -5.035  -9.194  -7.486
   19    HD2  HIS  10           2HD      HIS  10  -6.580  -8.610 -11.298
   20    HE1  HIS  10           1HE      HIS  10  -3.443 -10.363  -9.043
   21    HE2  HIS  10           2HE      HIS  10  -4.349  -9.917 -11.351
   22    H    GLU  11           H        GLU  11  -9.073  -8.935  -5.166
   23    HA   GLU  11           HA       GLU  11 -11.013  -6.756  -5.527
   24   1HB   GLU  11          2HB       GLU  11 -10.976  -9.037  -3.543
   25   2HB   GLU  11          1HB       GLU  11 -12.186  -7.761  -3.576
   26   1HG   GLU  11          2HG       GLU  11 -13.053  -9.739  -4.631
   27   2HG   GLU  11          1HG       GLU  11 -12.845  -8.467  -5.833
   28    H    LEU  12           H        LEU  12  -8.214  -6.304  -4.925
   29    HA   LEU  12           HA       LEU  12  -8.069  -5.597  -2.127
   30   1HB   LEU  12          2HB       LEU  12  -6.077  -6.393  -3.275
   31   2HB   LEU  12          1HB       LEU  12  -6.183  -5.074  -4.424
   32    HG   LEU  12           HG       LEU  12  -5.814  -3.476  -2.544
   33   1HD1  LEU  12          1HD1      LEU  12  -5.905  -5.988  -1.023
   34   2HD1  LEU  12          2HD1      LEU  12  -6.279  -4.339  -0.523
   35   3HD1  LEU  12          3HD1      LEU  12  -4.602  -4.883  -0.584
   36   1HD2  LEU  12          1HD2      LEU  12  -3.385  -4.160  -2.204
   37   2HD2  LEU  12          2HD2      LEU  12  -3.931  -3.936  -3.867
   38   3HD2  LEU  12          3HD2      LEU  12  -3.759  -5.561  -3.206
   39    H    ILE  13           H        ILE  13  -9.006  -4.072  -5.075
   40    HA   ILE  13           HA       ILE  13  -8.599  -1.379  -4.119
   41    HB   ILE  13           HB       ILE  13 -10.171  -2.301  -6.527
   42   1HG1  ILE  13          2HG1      ILE  13  -7.883  -3.100  -6.690
   43   2HG1  ILE  13          1HG1      ILE  13  -8.112  -1.754  -7.802
   44   1HG2  ILE  13          1HG2      ILE  13  -9.457   0.065  -7.284
   45   2HG2  ILE  13          2HG2      ILE  13  -9.208   0.364  -5.564
   46   3HG2  ILE  13          3HG2      ILE  13 -10.803  -0.099  -6.156
   47   1HD1  ILE  13          1HD1      ILE  13  -6.785  -1.610  -5.105
   48   2HD1  ILE  13          2HD1      ILE  13  -7.016  -0.260  -6.217
   49   3HD1  ILE  13          3HD1      ILE  13  -5.973  -1.609  -6.670
   50    H    GLY  14           H        GLY  14 -10.343   0.178  -3.896
   51   1HA   GLY  14          2HA       GLY  14 -12.646   0.711  -3.566
   52   2HA   GLY  14          1HA       GLY  14 -12.960  -0.988  -3.249
   53    H    LEU  15           H        LEU  15 -10.277  -0.584  -1.555
   54    HA   LEU  15           HA       LEU  15 -11.742   0.233   0.860
   55   1HB   LEU  15          2HB       LEU  15 -10.027  -1.098   2.089
   56   2HB   LEU  15          1HB       LEU  15 -11.064  -2.039   1.035
   57    HG   LEU  15           HG       LEU  15  -9.231  -2.040  -0.666
   58   1HD1  LEU  15          1HD1      LEU  15  -6.923  -1.592   0.433
   59   2HD1  LEU  15          2HD1      LEU  15  -7.844  -0.550   1.518
   60   3HD1  LEU  15          3HD1      LEU  15  -7.856  -0.244  -0.219
   61   1HD2  LEU  15          1HD2      LEU  15  -9.541  -3.976   0.702
   62   2HD2  LEU  15          2HD2      LEU  15  -8.681  -3.226   2.046
   63   3HD2  LEU  15          3HD2      LEU  15  -7.809  -3.664   0.577
   64    H    SER  16           H        SER  16 -10.342   1.174   2.601
   65    HA   SER  16           HA       SER  16  -8.715   3.295   1.436
   66   1HB   SER  16          2HB       SER  16  -9.704   2.911   4.276
   67   2HB   SER  16          1HB       SER  16  -8.868   4.339   3.666
   68    HG   SER  16           HG       SER  16 -10.605   4.806   2.386
   69    H    VAL  17           H        VAL  17  -6.659   3.897   2.422
   70    HA   VAL  17           HA       VAL  17  -5.256   1.639   3.682
   71    HB   VAL  17           HB       VAL  17  -4.613   1.590   1.364
   72   1HG1  VAL  17          1HG1      VAL  17  -4.348   4.537   1.723
   73   2HG1  VAL  17          2HG1      VAL  17  -5.085   3.620   0.407
   74   3HG1  VAL  17          3HG1      VAL  17  -3.328   3.722   0.536
   75   1HG2  VAL  17          1HG2      VAL  17  -2.865   1.416   3.259
   76   2HG2  VAL  17          2HG2      VAL  17  -2.310   2.986   2.679
   77   3HG2  VAL  17          3HG2      VAL  17  -2.298   1.594   1.597
   78    H    ARG  18           H        ARG  18  -3.812   2.144   5.261
   79    HA   ARG  18           HA       ARG  18  -3.215   4.981   5.745
   80   1HB   ARG  18          2HB       ARG  18  -4.130   2.990   7.830
   81   2HB   ARG  18          1HB       ARG  18  -3.550   4.615   8.172
   82   1HG   ARG  18          2HG       ARG  18  -5.414   5.556   6.917
   83   2HG   ARG  18          1HG       ARG  18  -5.993   3.931   6.550
   84   1HD   ARG  18          2HD       ARG  18  -6.303   3.504   8.940
   85   2HD   ARG  18          1HD       ARG  18  -5.713   5.125   9.308
   86    HE   ARG  18           HE       ARG  18  -7.808   5.894   8.880
   87   1HH1  ARG  18          1HH1      ARG  18  -7.421   2.856   7.203
   88   2HH1  ARG  18          2HH1      ARG  18  -9.030   2.863   6.564
   89   1HH2  ARG  18          1HH2      ARG  18  -9.925   5.900   8.044
   90   2HH2  ARG  18          2HH2      ARG  18 -10.452   4.588   7.042
   91    H    ILE  19           H        ILE  19  -1.087   5.270   5.827
   92    HA   ILE  19           HA       ILE  19   0.650   2.984   6.301
   93    HB   ILE  19           HB       ILE  19   1.275   5.787   5.372
   94   1HG1  ILE  19          2HG1      ILE  19   1.837   4.636   3.241
   95   2HG1  ILE  19          1HG1      ILE  19   1.277   3.119   3.940
   96   1HG2  ILE  19          1HG2      ILE  19   3.486   4.327   4.771
   97   2HG2  ILE  19          2HG2      ILE  19   3.022   3.629   6.323
   98   3HG2  ILE  19          3HG2      ILE  19   3.324   5.362   6.191
   99   1HD1  ILE  19          1HD1      ILE  19  -0.532   5.507   3.758
  100   2HD1  ILE  19          2HD1      ILE  19  -0.961   3.806   3.929
  101   3HD1  ILE  19          3HD1      ILE  19  -0.321   4.405   2.396
  102    H    ALA  20           H        ALA  20   1.984   2.729   8.011
  103    HA   ALA  20           HA       ALA  20   1.646   4.597  10.235
  104   1HB   ALA  20          1HB       ALA  20   2.428   1.720  10.055
  105   2HB   ALA  20          2HB       ALA  20   1.158   2.475  11.017
  106   3HB   ALA  20          3HB       ALA  20   2.847   2.665  11.483
  107    H    ARG  21           H        ARG  21   4.069   3.156   8.194
  108    HA   ARG  21           HA       ARG  21   5.934   5.229   8.935
  109   1HB   ARG  21          2HB       ARG  21   6.482   3.415  10.486
  110   2HB   ARG  21          1HB       ARG  21   6.667   2.312   9.132
  111   1HG   ARG  21          2HG       ARG  21   8.828   3.023   9.916
  112   2HG   ARG  21          1HG       ARG  21   8.533   3.666   8.298
  113   1HD   ARG  21          2HD       ARG  21   7.893   5.820   9.275
  114   2HD   ARG  21          1HD       ARG  21   8.191   5.178  10.888
  115    HE   ARG  21           HE       ARG  21  10.123   6.222   9.108
  116   1HH1  ARG  21          1HH1      ARG  21   9.661   3.710  11.489
  117   2HH1  ARG  21          2HH1      ARG  21  11.350   3.571  11.849
  118   1HH2  ARG  21          1HH2      ARG  21  12.341   6.042   9.586
  119   2HH2  ARG  21          2HH2      ARG  21  12.869   4.897  10.772
  120    H    SER  22           H        SER  22   7.437   5.689   7.361
  121    HA   SER  22           HA       SER  22   7.374   4.091   4.908
  122   1HB   SER  22          2HB       SER  22   6.906   7.080   5.001
  123   2HB   SER  22          1HB       SER  22   7.117   6.128   3.531
  124    HG   SER  22           HG       SER  22   5.052   5.809   3.647
  125    H    VAL  23           H        VAL  23   9.082   4.742   3.354
  126    HA   VAL  23           HA       VAL  23  11.586   5.026   4.725
  127    HB   VAL  23           HB       VAL  23  11.372   3.539   2.784
  128   1HG1  VAL  23          1HG1      VAL  23  11.368   5.813   0.878
  129   2HG1  VAL  23          2HG1      VAL  23   9.834   5.386   1.636
  130   3HG1  VAL  23          3HG1      VAL  23  10.721   4.183   0.698
  131   1HG2  VAL  23          1HG2      VAL  23  13.411   4.210   1.621
  132   2HG2  VAL  23          2HG2      VAL  23  13.567   4.467   3.359
  133   3HG2  VAL  23          3HG2      VAL  23  13.268   5.836   2.288
  134    H    HIS  24           H        HIS  24   9.465   7.097   2.894
  135    HA   HIS  24           HA       HIS  24  11.428   9.281   3.081
  136   1HB   HIS  24          2HB       HIS  24   9.049   9.030   1.229
  137   2HB   HIS  24          1HB       HIS  24  10.189  10.371   1.267
  138    HD1  HIS  24           1HD      HIS  24  12.847   9.309   1.004
  139    HD2  HIS  24           2HD      HIS  24   9.645   7.378  -0.809
  140    HE1  HIS  24           1HE      HIS  24  13.856   7.908  -0.824
  141    HE2  HIS  24           2HE      HIS  24  11.889   6.831  -1.972
  142    H    ARG  25           H        ARG  25  10.923  11.123   4.147
  143    HA   ARG  25           HA       ARG  25   8.867  11.054   6.075
  144   1HB   ARG  25          2HB       ARG  25  10.958  12.227   6.471
  145   2HB   ARG  25          1HB       ARG  25  10.605  13.345   5.160
  146   1HG   ARG  25          2HG       ARG  25   8.655  14.168   6.408
  147   2HG   ARG  25          1HG       ARG  25   9.066  13.077   7.735
  148   1HD   ARG  25          2HD       ARG  25  11.217  14.206   8.001
  149   2HD   ARG  25          1HD       ARG  25  10.824  15.284   6.662
  150    HE   ARG  25           HE       ARG  25   8.795  15.469   8.584
  151   1HH1  ARG  25          1HH1      ARG  25  12.166  16.279   8.191
  152   2HH1  ARG  25          2HH1      ARG  25  12.100  17.622   9.281
  153   1HH2  ARG  25          1HH2      ARG  25   8.706  17.235  10.019
  154   2HH2  ARG  25          2HH2      ARG  25  10.136  18.164  10.321
  155    H    ASP  26           H        ASP  26   8.939  12.305   2.851
  156    HA   ASP  26           HA       ASP  26   6.743  14.097   3.211
  157   1HB   ASP  26          2HB       ASP  26   6.801  14.372   0.780
  158   2HB   ASP  26          1HB       ASP  26   8.412  14.518   1.475
  159    H    ILE  27           H        ILE  27   6.789  10.817   3.243
  160    HA   ILE  27           HA       ILE  27   4.051  10.686   2.252
  161    HB   ILE  27           HB       ILE  27   4.452   8.418   1.400
  162   1HG1  ILE  27          2HG1      ILE  27   7.336   9.039   2.077
  163   2HG1  ILE  27          1HG1      ILE  27   6.332   7.798   2.816
  164   1HG2  ILE  27          1HG2      ILE  27   6.012   9.150  -0.513
  165   2HG2  ILE  27          2HG2      ILE  27   6.030  10.716   0.299
  166   3HG2  ILE  27          3HG2      ILE  27   4.506  10.036  -0.273
  167   1HD1  ILE  27          1HD1      ILE  27   7.924   6.888   1.186
  168   2HD1  ILE  27          2HD1      ILE  27   7.153   7.847  -0.077
  169   3HD1  ILE  27          3HD1      ILE  27   6.247   6.574   0.741
  170    H    GLN  28           H        GLN  28   6.313   9.875   4.692
  171    HA   GLN  28           HA       GLN  28   5.058   7.685   5.900
  172   1HB   GLN  28          2HB       GLN  28   7.325   8.404   6.476
  173   2HB   GLN  28          1HB       GLN  28   6.692   9.889   7.172
  174   1HG   GLN  28          2HG       GLN  28   5.505   8.582   8.866
  175   2HG   GLN  28          1HG       GLN  28   6.159   7.099   8.173
  176   1HE2  GLN  28          1HE2      GLN  28   6.520   9.210  10.613
  177   2HE2  GLN  28          2HE2      GLN  28   8.201   9.003  10.954
  178    H    GLY  29           H        GLY  29   3.535   7.490   7.514
  179   1HA   GLY  29          2HA       GLY  29   1.687   8.028   8.760
  180   2HA   GLY  29          1HA       GLY  29   2.408   9.616   8.968
  181    H    ILE  30           H        ILE  30   1.860   8.632   5.726
  182    HA   ILE  30           HA       ILE  30  -0.319  10.551   5.543
  183    HB   ILE  30           HB       ILE  30   1.367   9.372   3.337
  184   1HG1  ILE  30          2HG1      ILE  30   2.673  10.827   4.805
  185   2HG1  ILE  30          1HG1      ILE  30   2.413  11.602   3.243
  186   1HG2  ILE  30          1HG2      ILE  30  -0.900  10.041   2.629
  187   2HG2  ILE  30          2HG2      ILE  30   0.362  11.032   1.896
  188   3HG2  ILE  30          3HG2      ILE  30  -0.588  11.666   3.239
  189   1HD1  ILE  30          1HD1      ILE  30   0.627  12.960   4.213
  190   2HD1  ILE  30          2HD1      ILE  30   2.152  13.189   5.070
  191   3HD1  ILE  30          3HD1      ILE  30   0.885  12.184   5.776
  192    H    SER  31           H        SER  31  -2.277   9.650   5.721
  193    HA   SER  31           HA       SER  31  -2.739   6.957   4.693
  194   1HB   SER  31          2HB       SER  31  -4.930   7.142   5.835
  195   2HB   SER  31          1HB       SER  31  -3.586   7.456   6.933
  196    HG   SER  31           HG       SER  31  -5.493   8.964   6.896
  197    H    GLY  32           H        GLY  32  -4.854   6.586   3.505
  198   1HA   GLY  32          2HA       GLY  32  -6.267   8.561   2.174
  199   2HA   GLY  32          1HA       GLY  32  -4.867   8.216   1.169
  200    H    ARG  33           H        ARG  33  -6.473   7.569  -0.409
  201    HA   ARG  33           HA       ARG  33  -7.718   4.992   0.139
  202   1HB   ARG  33          2HB       ARG  33  -8.334   7.173  -1.773
  203   2HB   ARG  33          1HB       ARG  33  -8.805   5.537  -2.185
  204   1HG   ARG  33          2HG       ARG  33 -10.534   6.965  -1.009
  205   2HG   ARG  33          1HG       ARG  33 -10.249   5.349  -0.368
  206   1HD   ARG  33          2HD       ARG  33 -10.402   6.826   1.488
  207   2HD   ARG  33          1HD       ARG  33  -8.706   6.388   1.317
  208    HE   ARG  33           HE       ARG  33  -9.267   8.794  -0.061
  209   1HH1  ARG  33          1HH1      ARG  33  -8.818   7.510   3.148
  210   2HH1  ARG  33          2HH1      ARG  33  -8.280   9.015   3.811
  211   1HH2  ARG  33          1HH2      ARG  33  -8.557  10.778   0.805
  212   2HH2  ARG  33          2HH2      ARG  33  -8.131  10.872   2.483
  213    H    VAL  34           H        VAL  34  -7.825   3.526  -1.871
  214    HA   VAL  34           HA       VAL  34  -5.033   3.015  -2.597
  215    HB   VAL  34           HB       VAL  34  -6.202   1.303  -1.294
  216   1HG1  VAL  34          1HG1      VAL  34  -8.439   1.707  -2.359
  217   2HG1  VAL  34          2HG1      VAL  34  -7.991   0.011  -2.172
  218   3HG1  VAL  34          3HG1      VAL  34  -7.863   0.789  -3.750
  219   1HG2  VAL  34          1HG2      VAL  34  -5.532   0.315  -4.063
  220   2HG2  VAL  34          2HG2      VAL  34  -5.428  -0.585  -2.549
  221   3HG2  VAL  34          3HG2      VAL  34  -4.329   0.763  -2.851
  222    H    VAL  35           H        VAL  35  -4.398   2.109  -4.617
  223    HA   VAL  35           HA       VAL  35  -6.283   2.473  -6.842
  224    HB   VAL  35           HB       VAL  35  -3.519   2.821  -7.655
  225   1HG1  VAL  35          1HG1      VAL  35  -4.823   3.234  -9.407
  226   2HG1  VAL  35          2HG1      VAL  35  -4.806   4.875  -8.763
  227   3HG1  VAL  35          3HG1      VAL  35  -6.160   3.806  -8.418
  228   1HG2  VAL  35          1HG2      VAL  35  -4.420   5.407  -6.734
  229   2HG2  VAL  35          2HG2      VAL  35  -2.855   4.626  -6.579
  230   3HG2  VAL  35          3HG2      VAL  35  -4.126   4.268  -5.427
  231    H    ASP  36           H        ASP  36  -3.139   1.204  -5.834
  232    HA   ASP  36           HA       ASP  36  -3.771  -1.429  -6.778
  233   1HB   ASP  36          2HB       ASP  36  -3.046  -0.170  -8.851
  234   2HB   ASP  36          1HB       ASP  36  -1.457  -0.019  -8.111
  235    H    GLU  37           H        GLU  37  -1.864  -2.949  -6.448
  236    HA   GLU  37           HA       GLU  37  -0.075  -1.994  -4.312
  237   1HB   GLU  37          2HB       GLU  37  -1.870  -3.331  -3.292
  238   2HB   GLU  37          1HB       GLU  37  -1.499  -4.665  -4.376
  239   1HG   GLU  37          2HG       GLU  37   0.758  -4.796  -3.382
  240   2HG   GLU  37          1HG       GLU  37   0.299  -3.531  -2.245
  241    H    THR  38           H        THR  38   2.033  -2.403  -4.709
  242    HA   THR  38           HA       THR  38   2.665  -4.478  -6.708
  243    HB   THR  38           HB       THR  38   4.033  -1.815  -6.327
  244    HG1  THR  38           1HG      THR  38   1.955  -1.868  -7.444
  245   1HG2  THR  38          1HG2      THR  38   5.609  -3.561  -7.041
  246   2HG2  THR  38          2HG2      THR  38   5.343  -2.330  -8.276
  247   3HG2  THR  38          3HG2      THR  38   4.565  -3.906  -8.420
  248    H    ARG  39           H        ARG  39   4.689  -5.519  -6.533
  249    HA   ARG  39           HA       ARG  39   5.376  -6.658  -4.192
  250   1HB   ARG  39          2HB       ARG  39   7.575  -7.142  -5.143
  251   2HB   ARG  39          1HB       ARG  39   6.271  -7.412  -6.285
  252   1HG   ARG  39          2HG       ARG  39   7.525  -4.752  -6.389
  253   2HG   ARG  39          1HG       ARG  39   8.536  -6.107  -6.890
  254   1HD   ARG  39          2HD       ARG  39   6.824  -6.809  -8.473
  255   2HD   ARG  39          1HD       ARG  39   5.792  -5.473  -7.967
  256    HE   ARG  39           HE       ARG  39   8.258  -4.435  -8.794
  257   1HH1  ARG  39          1HH1      ARG  39   5.456  -6.023 -10.137
  258   2HH1  ARG  39          2HH1      ARG  39   5.621  -5.274 -11.690
  259   1HH2  ARG  39          1HH2      ARG  39   8.474  -3.448 -10.836
  260   2HH2  ARG  39          2HH2      ARG  39   7.332  -3.812 -12.086
  261    H    ASN  40           H        ASN  40   6.563  -3.511  -5.294
  262    HA   ASN  40           HA       ASN  40   7.529  -3.027  -2.586
  263   1HB   ASN  40          2HB       ASN  40   9.699  -2.206  -3.316
  264   2HB   ASN  40          1HB       ASN  40   9.487  -3.887  -3.778
  265   1HD2  ASN  40          1HD2      ASN  40   7.599  -2.210  -5.904
  266   2HD2  ASN  40          2HD2      ASN  40   8.744  -1.973  -7.165
  267    H    THR  41           H        THR  41   5.345  -2.013  -4.335
  268    HA   THR  41           HA       THR  41   5.756   0.773  -3.718
  269    HB   THR  41           HB       THR  41   4.981   1.402  -6.108
  270    HG1  THR  41           1HG      THR  41   4.809  -0.241  -7.375
  271   1HG2  THR  41          1HG2      THR  41   7.796   0.413  -5.768
  272   2HG2  THR  41          2HG2      THR  41   7.186   1.958  -5.172
  273   3HG2  THR  41          3HG2      THR  41   7.220   1.632  -6.906
  274    H    LEU  42           H        LEU  42   3.885   1.962  -3.571
  275    HA   LEU  42           HA       LEU  42   1.406   0.385  -3.788
  276   1HB   LEU  42          2HB       LEU  42   2.273   2.383  -1.725
  277   2HB   LEU  42          1HB       LEU  42   0.578   2.015  -1.978
  278    HG   LEU  42           HG       LEU  42   2.698   0.023  -1.185
  279   1HD1  LEU  42          1HD1      LEU  42   1.052   1.854   0.349
  280   2HD1  LEU  42          2HD1      LEU  42   2.390   0.832   0.876
  281   3HD1  LEU  42          3HD1      LEU  42   0.754   0.175   0.794
  282   1HD2  LEU  42          1HD2      LEU  42   0.985  -1.053  -2.494
  283   2HD2  LEU  42          2HD2      LEU  42  -0.282  -0.260  -1.559
  284   3HD2  LEU  42          3HD2      LEU  42   0.748  -1.469  -0.795
  285    H    ARG  43           H        ARG  43  -0.518   1.524  -4.197
  286    HA   ARG  43           HA       ARG  43  -0.188   4.121  -5.519
  287   1HB   ARG  43          2HB       ARG  43  -0.921   1.620  -6.721
  288   2HB   ARG  43          1HB       ARG  43  -2.291   2.701  -6.780
  289   1HG   ARG  43          2HG       ARG  43   0.443   3.184  -7.920
  290   2HG   ARG  43          1HG       ARG  43  -1.056   2.905  -8.804
  291   1HD   ARG  43          2HD       ARG  43  -1.951   5.004  -8.054
  292   2HD   ARG  43          1HD       ARG  43  -0.559   5.276  -7.009
  293    HE   ARG  43           HE       ARG  43   0.355   4.945  -9.629
  294   1HH1  ARG  43          1HH1      ARG  43  -1.522   7.210  -7.754
  295   2HH1  ARG  43          2HH1      ARG  43  -1.074   8.575  -8.718
  296   1HH2  ARG  43          1HH2      ARG  43   0.947   6.739 -10.903
  297   2HH2  ARG  43          2HH2      ARG  43   0.327   8.307 -10.507
  298    H    ILE  44           H        ILE  44  -1.424   5.562  -4.518
  299    HA   ILE  44           HA       ILE  44  -3.739   4.643  -2.969
  300    HB   ILE  44           HB       ILE  44  -2.083   7.163  -2.805
  301   1HG1  ILE  44          2HG1      ILE  44  -2.457   4.873  -0.874
  302   2HG1  ILE  44          1HG1      ILE  44  -1.033   5.164  -1.870
  303   1HG2  ILE  44          1HG2      ILE  44  -4.021   6.685  -0.658
  304   2HG2  ILE  44          2HG2      ILE  44  -4.710   7.179  -2.202
  305   3HG2  ILE  44          3HG2      ILE  44  -3.503   8.190  -1.414
  306   1HD1  ILE  44          1HD1      ILE  44  -1.665   6.183   0.716
  307   2HD1  ILE  44          2HD1      ILE  44  -1.493   7.524  -0.415
  308   3HD1  ILE  44          3HD1      ILE  44  -0.181   6.361  -0.221
  309    H    GLU  45           H        GLU  45  -5.540   4.685  -4.193
  310    HA   GLU  45           HA       GLU  45  -6.112   7.162  -5.648
  311   1HB   GLU  45          2HB       GLU  45  -5.990   5.408  -7.264
  312   2HB   GLU  45          1HB       GLU  45  -6.963   4.330  -6.286
  313   1HG   GLU  45          2HG       GLU  45  -8.827   6.068  -6.572
  314   2HG   GLU  45          1HG       GLU  45  -7.818   6.741  -7.848
  315    H    MET  46           H        MET  46  -7.913   8.170  -5.300
  316    HA   MET  46           HA       MET  46  -9.652   7.286  -3.106
  317   1HB   MET  46          2HB       MET  46  -9.003  10.017  -4.220
  318   2HB   MET  46          1HB       MET  46 -10.280   9.742  -3.051
  319   1HG   MET  46          2HG       MET  46  -8.241  10.574  -2.012
  320   2HG   MET  46          1HG       MET  46  -8.678   8.980  -1.421
  321   1HE   MET  46          1HE       MET  46  -5.854   9.961  -4.656
  322   2HE   MET  46          2HE       MET  46  -5.103  10.650  -3.218
  323   3HE   MET  46          3HE       MET  46  -6.751  11.101  -3.656
  324    H    ASP  47           H        ASP  47 -11.801   7.028  -3.415
  325    HA   ASP  47           HA       ASP  47 -12.886   6.475  -5.863
  326   1HB   ASP  47          2HB       ASP  47 -15.114   6.753  -4.794
  327   2HB   ASP  47          1HB       ASP  47 -13.992   5.798  -3.829
  328    H    ASP  48           H        ASP  48 -12.404   9.590  -4.454
  329    HA   ASP  48           HA       ASP  48 -14.271  11.060  -5.970
  330   1HB   ASP  48          2HB       ASP  48 -11.637  11.936  -4.768
  331   2HB   ASP  48          1HB       ASP  48 -12.856  13.026  -5.418
  332    H    GLY  49           H        GLY  49 -11.495   9.404  -6.935
  333   1HA   GLY  49          2HA       GLY  49 -10.974   9.158  -9.248
  334   2HA   GLY  49          1HA       GLY  49 -11.538  10.800  -9.517
  335    H    ARG  50           H        ARG  50  -9.517  10.121  -6.799
  336    HA   ARG  50           HA       ARG  50  -7.332  11.601  -8.105
  337   1HB   ARG  50          2HB       ARG  50  -7.867  11.146  -5.167
  338   2HB   ARG  50          1HB       ARG  50  -6.538  12.087  -5.825
  339   1HG   ARG  50          2HG       ARG  50  -8.111  13.681  -6.772
  340   2HG   ARG  50          1HG       ARG  50  -9.463  12.721  -6.166
  341   1HD   ARG  50          2HD       ARG  50  -8.657  13.079  -3.867
  342   2HD   ARG  50          1HD       ARG  50  -7.348  14.079  -4.497
  343    HE   ARG  50           HE       ARG  50  -9.756  15.124  -5.438
  344   1HH1  ARG  50          1HH1      ARG  50  -8.089  14.689  -2.403
  345   2HH1  ARG  50          2HH1      ARG  50  -8.820  16.072  -1.659
  346   1HH2  ARG  50          1HH2      ARG  50 -10.721  16.942  -4.460
  347   2HH2  ARG  50          2HH2      ARG  50 -10.315  17.350  -2.826
  348    H    GLU  51           H        GLU  51  -5.108  10.925  -7.625
  349    HA   GLU  51           HA       GLU  51  -4.750   8.215  -6.651
  350   1HB   GLU  51          2HB       GLU  51  -4.023   8.982  -9.482
  351   2HB   GLU  51          1HB       GLU  51  -3.604   7.462  -8.702
  352   1HG   GLU  51          2HG       GLU  51  -5.978   6.921  -8.492
  353   2HG   GLU  51          1HG       GLU  51  -6.391   8.443  -9.282
  354    H    ILE  52           H        ILE  52  -2.736   7.853  -5.832
  355    HA   ILE  52           HA       ILE  52  -0.487   9.522  -6.538
  356    HB   ILE  52           HB       ILE  52  -1.603  10.954  -4.906
  357   1HG1  ILE  52          2HG1      ILE  52   0.902   9.650  -3.813
  358   2HG1  ILE  52          1HG1      ILE  52   0.850  10.954  -5.001
  359   1HG2  ILE  52          1HG2      ILE  52  -2.229  10.324  -2.779
  360   2HG2  ILE  52          2HG2      ILE  52  -1.132   8.943  -2.752
  361   3HG2  ILE  52          3HG2      ILE  52  -2.608   8.879  -3.716
  362   1HD1  ILE  52          1HD1      ILE  52  -0.115  11.129  -2.144
  363   2HD1  ILE  52          2HD1      ILE  52  -0.165  12.432  -3.331
  364   3HD1  ILE  52          3HD1      ILE  52   1.389  11.805  -2.776
  365    H    THR  53           H        THR  53   1.192   8.185  -6.638
  366    HA   THR  53           HA       THR  53   1.121   5.600  -5.384
  367    HB   THR  53           HB       THR  53   2.035   5.827  -7.621
  368    HG1  THR  53           1HG      THR  53   4.071   5.202  -5.749
  369   1HG2  THR  53          1HG2      THR  53   4.229   6.885  -7.985
  370   2HG2  THR  53          2HG2      THR  53   4.140   7.568  -6.362
  371   3HG2  THR  53          3HG2      THR  53   2.958   8.040  -7.585
  372    H    VAL  54           H        VAL  54   2.733   4.730  -3.987
  373    HA   VAL  54           HA       VAL  54   4.493   6.568  -2.585
  374    HB   VAL  54           HB       VAL  54   2.385   5.013  -1.077
  375   1HG1  VAL  54          1HG1      VAL  54   4.452   6.968  -0.070
  376   2HG1  VAL  54          2HG1      VAL  54   4.547   5.215   0.095
  377   3HG1  VAL  54          3HG1      VAL  54   3.259   6.110   0.904
  378   1HG2  VAL  54          1HG2      VAL  54   2.645   7.959  -1.662
  379   2HG2  VAL  54          2HG2      VAL  54   1.570   7.294  -0.432
  380   3HG2  VAL  54          3HG2      VAL  54   1.330   6.882  -2.131
  381    HA   PRO  55           HA       PRO  55   6.938   2.810  -2.957
  382   1HB   PRO  55          2HB       PRO  55   8.693   4.242  -1.043
  383   2HB   PRO  55          1HB       PRO  55   9.076   3.549  -2.622
  384   1HG   PRO  55          2HG       PRO  55   8.880   6.186  -2.298
  385   2HG   PRO  55          1HG       PRO  55   8.287   5.399  -3.772
  386   1HD   PRO  55          2HD       PRO  55   6.749   6.421  -1.418
  387   2HD   PRO  55          1HD       PRO  55   6.354   6.504  -3.148
  388    H    LYS  56           H        LYS  56   6.244   1.064  -1.888
  389    HA   LYS  56           HA       LYS  56   5.981   1.165   1.028
  390   1HB   LYS  56          2HB       LYS  56   4.646  -0.848   0.854
  391   2HB   LYS  56          1HB       LYS  56   4.018   0.396  -0.214
  392   1HG   LYS  56          2HG       LYS  56   4.820  -0.690  -2.133
  393   2HG   LYS  56          1HG       LYS  56   5.876  -1.743  -1.193
  394   1HD   LYS  56          2HD       LYS  56   2.860  -1.799  -1.098
  395   2HD   LYS  56          1HD       LYS  56   3.857  -2.896  -2.052
  396   1HE   LYS  56          2HE       LYS  56   4.938  -3.675   0.012
  397   2HE   LYS  56          1HE       LYS  56   3.900  -2.606   0.950
  398   1HZ   LYS  56          1HZ       LYS  56   2.887  -4.695   1.036
  399   2HZ   LYS  56          2HZ       LYS  56   3.127  -4.995  -0.610
  400   3HZ   LYS  56          3HZ       LYS  56   1.988  -3.844  -0.118
  401    H    GLY  57           H        GLY  57   8.309   0.289  -1.148
  402   1HA   GLY  57          2HA       GLY  57   9.152  -2.246  -0.540
  403   2HA   GLY  57          1HA       GLY  57  10.256  -0.921  -0.874
  404    H    ILE  58           H        ILE  58   9.153   0.481   1.582
  405    HA   ILE  58           HA       ILE  58  10.039  -1.191   3.752
  406    HB   ILE  58           HB       ILE  58  11.417   1.454   3.287
  407   1HG1  ILE  58          2HG1      ILE  58  13.479  -0.090   3.006
  408   2HG1  ILE  58          1HG1      ILE  58  12.303  -1.354   2.657
  409   1HG2  ILE  58          1HG2      ILE  58  12.226  -0.694   5.219
  410   2HG2  ILE  58          2HG2      ILE  58  11.039   0.537   5.642
  411   3HG2  ILE  58          3HG2      ILE  58  12.680   1.010   5.203
  412   1HD1  ILE  58          1HD1      ILE  58  11.607   0.867   1.077
  413   2HD1  ILE  58          2HD1      ILE  58  12.266  -0.683   0.555
  414   3HD1  ILE  58          3HD1      ILE  58  13.352   0.653   0.936
  415    H    ALA  59           H        ALA  59   7.550  -0.581   3.640
  416    HA   ALA  59           HA       ALA  59   7.218   1.542   5.603
  417   1HB   ALA  59          1HB       ALA  59   5.373   2.587   4.338
  418   2HB   ALA  59          2HB       ALA  59   5.761   1.538   2.976
  419   3HB   ALA  59          3HB       ALA  59   6.937   2.726   3.537
  420    H    VAL  60           H        VAL  60   6.169   0.635   7.251
  421    HA   VAL  60           HA       VAL  60   4.369  -1.582   6.904
  422    HB   VAL  60           HB       VAL  60   5.737  -1.392   8.936
  423   1HG1  VAL  60          1HG1      VAL  60   5.886   0.456  10.170
  424   2HG1  VAL  60          2HG1      VAL  60   4.132   0.608  10.286
  425   3HG1  VAL  60          3HG1      VAL  60   4.984   1.274   8.893
  426   1HG2  VAL  60          1HG2      VAL  60   3.815  -1.639  10.609
  427   2HG2  VAL  60          2HG2      VAL  60   3.851  -2.742   9.233
  428   3HG2  VAL  60          3HG2      VAL  60   2.751  -1.364   9.230
  429    H    PHE  61           H        PHE  61   2.134  -1.537   6.812
  430    HA   PHE  61           HA       PHE  61   0.740   0.891   7.548
  431   1HB   PHE  61          2HB       PHE  61  -0.314   1.177   5.327
  432   2HB   PHE  61          1HB       PHE  61   1.421   1.469   5.304
  433    HD1  PHE  61           1HD      PHE  61  -1.032  -1.275   4.713
  434    HD2  PHE  61           2HD      PHE  61   2.682   0.506   3.648
  435    HE1  PHE  61           1HE      PHE  61  -0.784  -2.893   2.879
  436    HE2  PHE  61           2HE      PHE  61   2.934  -1.110   1.811
  437    HZ   PHE  61           HZ       PHE  61   1.199  -2.811   1.423
  438    H    HIS  62           H        HIS  62  -1.603   0.682   7.381
  439    HA   HIS  62           HA       HIS  62  -2.470  -2.125   7.501
  440   1HB   HIS  62          2HB       HIS  62  -2.309  -1.161   9.748
  441   2HB   HIS  62          1HB       HIS  62  -3.363   0.162   9.264
  442    HD1  HIS  62           1HD      HIS  62  -3.772  -3.592   8.822
  443    HD2  HIS  62           2HD      HIS  62  -5.708  -0.330  10.513
  444    HE1  HIS  62           1HE      HIS  62  -5.916  -4.496   9.762
  445    HE2  HIS  62           2HE      HIS  62  -6.980  -2.540  10.933
  446    H    PHE  63           H        PHE  63  -4.074  -2.640   6.203
  447    HA   PHE  63           HA       PHE  63  -5.523  -0.534   4.795
  448   1HB   PHE  63          2HB       PHE  63  -5.057  -3.455   4.295
  449   2HB   PHE  63          1HB       PHE  63  -6.410  -2.643   3.519
  450    HD1  PHE  63           1HD      PHE  63  -5.677  -2.861   1.290
  451    HD2  PHE  63           2HD      PHE  63  -3.140  -1.065   4.198
  452    HE1  PHE  63           1HE      PHE  63  -4.191  -2.070  -0.502
  453    HE2  PHE  63           2HE      PHE  63  -1.652  -0.271   2.408
  454    HZ   PHE  63           HZ       PHE  63  -2.173  -0.773   0.056
  455    H    ARG  64           H        ARG  64  -7.768  -0.426   4.722
  456    HA   ARG  64           HA       ARG  64  -9.239  -2.145   6.591
  457   1HB   ARG  64          2HB       ARG  64  -9.156   0.864   6.558
  458   2HB   ARG  64          1HB       ARG  64 -10.565   0.012   7.174
  459   1HG   ARG  64          2HG       ARG  64  -7.775  -0.432   8.205
  460   2HG   ARG  64          1HG       ARG  64  -8.907   0.731   8.900
  461   1HD   ARG  64          2HD       ARG  64 -10.519  -1.143   9.227
  462   2HD   ARG  64          1HD       ARG  64  -9.258  -2.257   8.698
  463    HE   ARG  64           HE       ARG  64  -8.199  -0.738  10.769
  464   1HH1  ARG  64          1HH1      ARG  64 -10.769  -3.054  10.306
  465   2HH1  ARG  64          2HH1      ARG  64 -10.685  -3.657  11.927
  466   1HH2  ARG  64          1HH2      ARG  64  -8.088  -1.532  12.901
  467   2HH2  ARG  64          2HH2      ARG  64  -9.164  -2.794  13.401
  468    H    THR  65           H        THR  65 -11.002  -2.982   5.666
  469    HA   THR  65           HA       THR  65 -11.962  -1.796   3.166
  470    HB   THR  65           HB       THR  65 -12.511  -4.515   4.368
  471    HG1  THR  65           1HG      THR  65 -10.335  -4.016   3.519
  472   1HG2  THR  65          1HG2      THR  65 -13.938  -3.185   2.363
  473   2HG2  THR  65          2HG2      THR  65 -14.024  -4.891   2.805
  474   3HG2  THR  65          3HG2      THR  65 -12.913  -4.361   1.542
  475    HA   PRO  66           HA       PRO  66 -15.435   0.035   5.277
  476   1HB   PRO  66          2HB       PRO  66 -17.116   0.002   3.046
  477   2HB   PRO  66          1HB       PRO  66 -16.010   1.303   3.487
  478   1HG   PRO  66          2HG       PRO  66 -15.648  -0.908   1.520
  479   2HG   PRO  66          1HG       PRO  66 -15.108   0.778   1.428
  480   1HD   PRO  66          2HD       PRO  66 -13.396  -1.193   1.999
  481   2HD   PRO  66          1HD       PRO  66 -13.266   0.392   2.793
  482    H    GLN  67           H        GLN  67 -15.569  -2.953   3.480
  483    HA   GLN  67           HA       GLN  67 -18.197  -3.723   4.182
  484   1HB   GLN  67          2HB       GLN  67 -15.808  -5.444   3.498
  485   2HB   GLN  67          1HB       GLN  67 -17.476  -5.998   3.553
  486   1HG   GLN  67          2HG       GLN  67 -18.046  -4.459   1.743
  487   2HG   GLN  67          1HG       GLN  67 -16.376  -3.906   1.689
  488   1HE2  GLN  67          1HE2      GLN  67 -16.216  -7.122   2.385
  489   2HE2  GLN  67          2HE2      GLN  67 -16.062  -7.750   0.786
  490    H    GLY  68           H        GLY  68 -15.399  -3.411   6.061
  491   1HA   GLY  68          2HA       GLY  68 -15.542  -3.609   8.442
  492   2HA   GLY  68          1HA       GLY  68 -16.683  -4.930   8.225
  493    H    GLU  69           H        GLU  69 -13.632  -4.536   6.506
  494    HA   GLU  69           HA       GLU  69 -12.580  -6.862   7.982
  495   1HB   GLU  69          2HB       GLU  69 -12.301  -6.329   5.019
  496   2HB   GLU  69          1HB       GLU  69 -11.550  -7.657   5.892
  497   1HG   GLU  69          2HG       GLU  69 -13.753  -8.546   6.446
  498   2HG   GLU  69          1HG       GLU  69 -14.510  -7.211   5.580
  499    H    LEU  70           H        LEU  70 -10.306  -6.983   8.197
  500    HA   LEU  70           HA       LEU  70  -8.907  -4.446   7.704
  501   1HB   LEU  70          2HB       LEU  70  -7.846  -4.551   9.797
  502   2HB   LEU  70          1HB       LEU  70  -9.530  -4.910  10.102
  503    HG   LEU  70           HG       LEU  70  -8.200  -6.337  11.477
  504   1HD1  LEU  70          1HD1      LEU  70  -9.138  -8.407  10.991
  505   2HD1  LEU  70          2HD1      LEU  70  -9.059  -8.144   9.249
  506   3HD1  LEU  70          3HD1      LEU  70 -10.234  -7.258  10.224
  507   1HD2  LEU  70          1HD2      LEU  70  -6.237  -7.221  10.903
  508   2HD2  LEU  70          2HD2      LEU  70  -6.341  -6.257   9.430
  509   3HD2  LEU  70          3HD2      LEU  70  -6.898  -7.929   9.431
  510    H    VAL  71           H        VAL  71  -6.762  -4.542   7.058
  511    HA   VAL  71           HA       VAL  71  -5.553  -7.185   6.703
  512    HB   VAL  71           HB       VAL  71  -5.906  -5.226   4.436
  513   1HG1  VAL  71          1HG1      VAL  71  -4.878  -7.028   3.064
  514   2HG1  VAL  71          2HG1      VAL  71  -4.506  -7.896   4.554
  515   3HG1  VAL  71          3HG1      VAL  71  -3.773  -6.322   4.242
  516   1HG2  VAL  71          1HG2      VAL  71  -7.057  -7.439   3.525
  517   2HG2  VAL  71          2HG2      VAL  71  -7.946  -6.233   4.457
  518   3HG2  VAL  71          3HG2      VAL  71  -7.343  -7.689   5.248
  519    H    GLU  72           H        GLU  72  -3.747  -6.898   7.889
  520    HA   GLU  72           HA       GLU  72  -2.253  -4.399   7.753
  521   1HB   GLU  72          2HB       GLU  72  -1.785  -6.919   9.361
  522   2HB   GLU  72          1HB       GLU  72  -0.821  -5.455   9.488
  523   1HG   GLU  72          2HG       GLU  72  -2.723  -4.223  10.304
  524   2HG   GLU  72          1HG       GLU  72  -3.770  -5.621  10.068
  525    H    ILE  73           H        ILE  73  -0.137  -4.195   6.951
  526    HA   ILE  73           HA       ILE  73   1.145  -6.540   5.799
  527    HB   ILE  73           HB       ILE  73   0.451  -4.155   4.085
  528   1HG1  ILE  73          2HG1      ILE  73  -0.535  -7.012   3.993
  529   2HG1  ILE  73          1HG1      ILE  73  -1.483  -5.605   4.465
  530   1HG2  ILE  73          1HG2      ILE  73   2.465  -4.824   3.215
  531   2HG2  ILE  73          2HG2      ILE  73   1.358  -5.849   2.303
  532   3HG2  ILE  73          3HG2      ILE  73   2.232  -6.507   3.688
  533   1HD1  ILE  73          1HD1      ILE  73  -0.371  -6.209   1.734
  534   2HD1  ILE  73          2HD1      ILE  73  -1.167  -4.699   2.174
  535   3HD1  ILE  73          3HD1      ILE  73  -2.065  -6.216   2.226
  536    H    ASP  74           H        ASP  74   3.317  -6.407   5.907
  537    HA   ASP  74           HA       ASP  74   4.439  -3.969   7.044
  538   1HB   ASP  74          2HB       ASP  74   5.646  -6.719   6.697
  539   2HB   ASP  74          1HB       ASP  74   6.420  -5.367   7.519
  540    H    GLY  75           H        GLY  75   4.843  -2.522   5.450
  541   1HA   GLY  75          2HA       GLY  75   5.704  -3.060   2.856
  542   2HA   GLY  75          1HA       GLY  75   5.945  -1.543   3.694
  543    H    ARG  76           H        ARG  76   7.466  -3.413   5.749
  544    HA   ARG  76           HA       ARG  76  10.017  -3.013   4.455
  545   1HB   ARG  76          2HB       ARG  76   9.695  -2.176   6.753
  546   2HB   ARG  76          1HB       ARG  76   9.374  -3.816   7.295
  547   1HG   ARG  76          2HG       ARG  76  11.965  -3.149   5.962
  548   2HG   ARG  76          1HG       ARG  76  11.713  -2.775   7.666
  549   1HD   ARG  76          2HD       ARG  76  11.521  -5.495   6.371
  550   2HD   ARG  76          1HD       ARG  76  12.797  -4.926   7.440
  551    HE   ARG  76           HE       ARG  76  10.359  -4.686   8.784
  552   1HH1  ARG  76          1HH1      ARG  76  12.472  -7.179   7.559
  553   2HH1  ARG  76          2HH1      ARG  76  11.991  -8.344   8.747
  554   1HH2  ARG  76          1HH2      ARG  76   9.727  -6.217  10.349
  555   2HH2  ARG  76          2HH2      ARG  76  10.434  -7.798  10.331
  556    H    ALA  77           H        ALA  77   7.961  -5.534   5.645
  557    HA   ALA  77           HA       ALA  77   9.900  -7.591   5.007
  558   1HB   ALA  77          1HB       ALA  77   8.482  -9.122   6.137
  559   2HB   ALA  77          2HB       ALA  77   7.131  -7.990   6.107
  560   3HB   ALA  77          3HB       ALA  77   8.538  -7.657   7.116
  561    H    LEU  78           H        LEU  78   7.743  -5.845   3.283
  562    HA   LEU  78           HA       LEU  78   6.973  -8.100   1.566
  563   1HB   LEU  78          2HB       LEU  78   5.695  -5.459   2.125
  564   2HB   LEU  78          1HB       LEU  78   5.422  -6.226   0.573
  565    HG   LEU  78           HG       LEU  78   3.598  -6.760   2.048
  566   1HD1  LEU  78          1HD1      LEU  78   4.991  -9.345   2.179
  567   2HD1  LEU  78          2HD1      LEU  78   4.961  -8.576   0.593
  568   3HD1  LEU  78          3HD1      LEU  78   3.450  -8.915   1.436
  569   1HD2  LEU  78          1HD2      LEU  78   4.201  -8.280   4.069
  570   2HD2  LEU  78          2HD2      LEU  78   4.328  -6.527   4.223
  571   3HD2  LEU  78          3HD2      LEU  78   5.776  -7.496   3.955
  572    H    VAL  79           H        VAL  79   9.569  -7.068   1.503
  573    HA   VAL  79           HA       VAL  79  10.207  -5.121  -0.316
  574    HB   VAL  79           HB       VAL  79  11.881  -6.372   0.976
  575   1HG1  VAL  79          1HG1      VAL  79  11.808  -8.594  -1.015
  576   2HG1  VAL  79          2HG1      VAL  79  10.698  -8.615   0.356
  577   3HG1  VAL  79          3HG1      VAL  79  12.440  -8.577   0.631
  578   1HG2  VAL  79          1HG2      VAL  79  12.478  -5.089  -1.097
  579   2HG2  VAL  79          2HG2      VAL  79  12.478  -6.622  -1.966
  580   3HG2  VAL  79          3HG2      VAL  79  13.621  -6.356  -0.649
  581    H    ALA  80           H        ALA  80  10.976  -5.323  -2.579
  582    HA   ALA  80           HA       ALA  80   9.020  -6.028  -4.347
  583   1HB   ALA  80          1HB       ALA  80  11.993  -5.857  -4.763
  584   2HB   ALA  80          2HB       ALA  80  10.773  -4.627  -5.087
  585   3HB   ALA  80          3HB       ALA  80  10.847  -6.078  -6.085
  586    H    ARG  81           H        ARG  81   9.011  -7.693  -6.065
  587    HA   ARG  81           HA       ARG  81   8.860 -10.239  -4.992
  588   1HB   ARG  81          2HB       ARG  81   8.880  -9.208  -7.801
  589   2HB   ARG  81          1HB       ARG  81   8.890 -10.940  -7.499
  590   1HG   ARG  81          2HG       ARG  81   6.823  -9.044  -6.423
  591   2HG   ARG  81          1HG       ARG  81   6.633 -10.006  -7.887
  592   1HD   ARG  81          2HD       ARG  81   6.893 -12.053  -6.579
  593   2HD   ARG  81          1HD       ARG  81   7.113 -11.099  -5.114
  594    HE   ARG  81           HE       ARG  81   4.652 -11.825  -6.296
  595   1HH1  ARG  81          1HH1      ARG  81   6.216  -9.193  -4.618
  596   2HH1  ARG  81          2HH1      ARG  81   4.731  -8.529  -4.023
  597   1HH2  ARG  81          1HH2      ARG  81   2.702 -10.953  -5.508
  598   2HH2  ARG  81          2HH2      ARG  81   2.739  -9.527  -4.525
  599    HA   PRO  82           HA       PRO  82  13.253 -11.201  -5.284
  600   1HB   PRO  82          2HB       PRO  82  13.265 -13.320  -3.657
  601   2HB   PRO  82          1HB       PRO  82  13.063 -11.680  -3.025
  602   1HG   PRO  82          2HG       PRO  82  11.004 -13.792  -3.512
  603   2HG   PRO  82          1HG       PRO  82  11.150 -12.661  -2.156
  604   1HD   PRO  82          2HD       PRO  82   9.459 -12.321  -4.319
  605   2HD   PRO  82          1HD       PRO  82  10.033 -11.011  -3.269
  606    H    GLU  83           H        GLU  83  10.569 -13.112  -6.251
  607    HA   GLU  83           HA       GLU  83  12.348 -15.025  -7.599
  608   1HB   GLU  83          2HB       GLU  83   9.421 -15.298  -6.910
  609   2HB   GLU  83          1HB       GLU  83  10.383 -16.509  -7.748
  610   1HG   GLU  83          2HG       GLU  83  11.813 -16.738  -5.783
  611   2HG   GLU  83          1HG       GLU  83  10.850 -15.523  -4.944
  612    H    GLU  84           H        GLU  84   9.952 -12.590  -8.099
  613    HA   GLU  84           HA       GLU  84   9.613 -13.312 -10.903
  614   1HB   GLU  84          2HB       GLU  84   8.370 -11.050  -9.331
  615   2HB   GLU  84          1HB       GLU  84   7.946 -11.518 -10.971
  616   1HG   GLU  84          2HG       GLU  84   7.192 -13.698 -10.148
  617   2HG   GLU  84          1HG       GLU  84   7.593 -13.205  -8.503
  618    H    ARG  85           H        ARG  85  12.051 -11.930  -9.431
  619    HA   ARG  85           HA       ARG  85  13.733 -10.543 -10.074
  620   1HB   ARG  85          2HB       ARG  85  13.487 -11.592 -12.278
  621   2HB   ARG  85          1HB       ARG  85  12.224 -10.443 -12.694
  622   1HG   ARG  85          2HG       ARG  85  13.834  -8.612 -12.545
  623   2HG   ARG  85          1HG       ARG  85  15.103  -9.766 -12.127
  624   1HD   ARG  85          2HD       ARG  85  13.526  -9.711 -14.698
  625   2HD   ARG  85          1HD       ARG  85  15.190  -9.167 -14.493
  626    HE   ARG  85           HE       ARG  85  15.024 -11.823 -13.636
  627   1HH1  ARG  85          1HH1      ARG  85  14.764  -9.975 -16.585
  628   2HH1  ARG  85          2HH1      ARG  85  15.308 -11.274 -17.593
  629   1HH2  ARG  85          1HH2      ARG  85  15.741 -13.531 -14.960
  630   2HH2  ARG  85          2HH2      ARG  85  15.863 -13.292 -16.671
  631    H    ILE  86           H        ILE  86  14.226  -8.270 -10.502
  632    HA   ILE  86           HA       ILE  86  11.989  -6.568  -9.671
  633    HB   ILE  86           HB       ILE  86  14.927  -5.878  -9.712
  634   1HG1  ILE  86          2HG1      ILE  86  14.573  -7.749  -8.200
  635   2HG1  ILE  86          1HG1      ILE  86  14.850  -6.284  -7.266
  636   1HG2  ILE  86          1HG2      ILE  86  12.457  -4.504  -8.780
  637   2HG2  ILE  86          2HG2      ILE  86  13.875  -3.848  -9.598
  638   3HG2  ILE  86          3HG2      ILE  86  13.955  -4.256  -7.883
  639   1HD1  ILE  86          1HD1      ILE  86  13.027  -6.809  -6.127
  640   2HD1  ILE  86          2HD1      ILE  86  12.583  -8.062  -7.284
  641   3HD1  ILE  86          3HD1      ILE  86  12.102  -6.390  -7.569
  Start of MODEL   19
    1    H    ARG   9           H        ARG   9  -5.166 -12.702 -11.225
    2    HA   ARG   9           HA       ARG   9  -4.211 -13.938  -8.758
    3   1HB   ARG   9          2HB       ARG   9  -2.587 -12.801 -10.220
    4   2HB   ARG   9          1HB       ARG   9  -3.477 -11.296 -10.036
    5   1HG   ARG   9          2HG       ARG   9  -2.974 -11.264  -7.660
    6   2HG   ARG   9          1HG       ARG   9  -2.123 -12.803  -7.808
    7   1HD   ARG   9          2HD       ARG   9  -0.537 -11.747  -9.367
    8   2HD   ARG   9          1HD       ARG   9  -1.376 -10.212  -9.163
    9    HE   ARG   9           HE       ARG   9  -0.183  -9.908  -7.252
   10   1HH1  ARG   9          1HH1      ARG   9  -0.297 -13.335  -7.913
   11   2HH1  ARG   9          2HH1      ARG   9   0.673 -13.757  -6.541
   12   1HH2  ARG   9          1HH2      ARG   9   1.100 -10.463  -5.455
   13   2HH2  ARG   9          2HH2      ARG   9   1.467 -12.128  -5.148
   14    H    HIS  10           H        HIS  10  -4.207 -12.610  -6.756
   15    HA   HIS  10           HA       HIS  10  -6.747 -11.936  -5.928
   16   1HB   HIS  10          2HB       HIS  10  -5.679 -10.841  -3.995
   17   2HB   HIS  10          1HB       HIS  10  -4.931 -12.391  -4.363
   18    HD1  HIS  10           1HD      HIS  10  -4.279  -8.772  -5.381
   19    HD2  HIS  10           2HD      HIS  10  -2.250 -12.205  -4.213
   20    HE1  HIS  10           1HE      HIS  10  -1.848  -8.134  -5.340
   21    HE2  HIS  10           2HE      HIS  10  -0.650 -10.200  -4.536
   22    H    GLU  11           H        GLU  11  -7.569  -9.808  -5.185
   23    HA   GLU  11           HA       GLU  11  -6.863  -7.699  -7.120
   24   1HB   GLU  11          2HB       GLU  11  -9.148  -8.729  -7.352
   25   2HB   GLU  11          1HB       GLU  11  -9.533  -8.092  -5.759
   26   1HG   GLU  11          2HG       GLU  11  -9.146  -5.818  -6.589
   27   2HG   GLU  11          1HG       GLU  11  -8.796  -6.472  -8.186
   28    H    LEU  12           H        LEU  12  -8.574  -7.915  -3.992
   29    HA   LEU  12           HA       LEU  12  -8.489  -6.619  -2.118
   30   1HB   LEU  12          2HB       LEU  12  -6.200  -7.679  -2.151
   31   2HB   LEU  12          1HB       LEU  12  -5.599  -6.202  -2.876
   32    HG   LEU  12           HG       LEU  12  -6.396  -4.969  -0.836
   33   1HD1  LEU  12          1HD1      LEU  12  -7.199  -6.042   1.031
   34   2HD1  LEU  12          2HD1      LEU  12  -6.514  -7.597   0.563
   35   3HD1  LEU  12          3HD1      LEU  12  -7.949  -6.985  -0.255
   36   1HD2  LEU  12          1HD2      LEU  12  -4.393  -7.161  -0.323
   37   2HD2  LEU  12          2HD2      LEU  12  -4.509  -5.616   0.519
   38   3HD2  LEU  12          3HD2      LEU  12  -4.050  -5.660  -1.183
   39    H    ILE  13           H        ILE  13  -8.955  -5.338  -4.808
   40    HA   ILE  13           HA       ILE  13  -7.947  -2.635  -4.406
   41    HB   ILE  13           HB       ILE  13  -9.674  -3.738  -6.628
   42   1HG1  ILE  13          2HG1      ILE  13  -7.457  -4.780  -6.575
   43   2HG1  ILE  13          1HG1      ILE  13  -7.606  -3.702  -7.961
   44   1HG2  ILE  13          1HG2      ILE  13 -10.043  -1.423  -6.589
   45   2HG2  ILE  13          2HG2      ILE  13  -8.786  -1.651  -7.806
   46   3HG2  ILE  13          3HG2      ILE  13  -8.359  -1.074  -6.194
   47   1HD1  ILE  13          1HD1      ILE  13  -6.457  -1.957  -6.507
   48   2HD1  ILE  13          2HD1      ILE  13  -5.477  -3.298  -7.102
   49   3HD1  ILE  13          3HD1      ILE  13  -6.050  -3.297  -5.435
   50    H    GLY  14           H        GLY  14  -9.426  -0.786  -4.534
   51   1HA   GLY  14          2HA       GLY  14 -11.396   0.342  -4.076
   52   2HA   GLY  14          1HA       GLY  14 -12.223  -1.203  -3.975
   53    H    LEU  15           H        LEU  15  -9.403  -0.980  -2.071
   54    HA   LEU  15           HA       LEU  15 -11.060  -0.646   0.340
   55   1HB   LEU  15          2HB       LEU  15  -8.346  -1.938   0.110
   56   2HB   LEU  15          1HB       LEU  15  -9.405  -1.950   1.508
   57    HG   LEU  15           HG       LEU  15 -10.054  -3.275  -1.122
   58   1HD1  LEU  15          1HD1      LEU  15  -8.071  -4.111   0.382
   59   2HD1  LEU  15          2HD1      LEU  15  -9.214  -5.248  -0.335
   60   3HD1  LEU  15          3HD1      LEU  15  -9.384  -4.776   1.356
   61   1HD2  LEU  15          1HD2      LEU  15 -11.559  -4.484   0.767
   62   2HD2  LEU  15          2HD2      LEU  15 -12.114  -3.132  -0.221
   63   3HD2  LEU  15          3HD2      LEU  15 -11.498  -2.841   1.405
   64    H    SER  16           H        SER  16 -10.200   0.540   2.118
   65    HA   SER  16           HA       SER  16  -8.664   2.846   1.327
   66   1HB   SER  16          2HB       SER  16  -9.629   1.988   4.076
   67   2HB   SER  16          1HB       SER  16  -8.961   3.569   3.670
   68    HG   SER  16           HG       SER  16 -10.729   3.843   2.228
   69    H    VAL  17           H        VAL  17  -6.601   3.448   2.311
   70    HA   VAL  17           HA       VAL  17  -5.152   1.282   3.617
   71    HB   VAL  17           HB       VAL  17  -4.736   0.813   1.297
   72   1HG1  VAL  17          1HG1      VAL  17  -3.472   2.581  -0.056
   73   2HG1  VAL  17          2HG1      VAL  17  -4.080   3.734   1.131
   74   3HG1  VAL  17          3HG1      VAL  17  -5.210   2.793   0.157
   75   1HG2  VAL  17          1HG2      VAL  17  -2.347   2.159   2.554
   76   2HG2  VAL  17          2HG2      VAL  17  -2.295   0.988   1.237
   77   3HG2  VAL  17          3HG2      VAL  17  -2.870   0.497   2.831
   78    H    ARG  18           H        ARG  18  -3.670   1.936   5.036
   79    HA   ARG  18           HA       ARG  18  -2.710   4.702   4.934
   80   1HB   ARG  18          2HB       ARG  18  -3.053   4.951   7.364
   81   2HB   ARG  18          1HB       ARG  18  -4.570   4.744   6.500
   82   1HG   ARG  18          2HG       ARG  18  -4.740   2.468   7.218
   83   2HG   ARG  18          1HG       ARG  18  -3.123   2.522   7.925
   84   1HD   ARG  18          2HD       ARG  18  -4.916   2.728   9.608
   85   2HD   ARG  18          1HD       ARG  18  -3.849   4.132   9.568
   86    HE   ARG  18           HE       ARG  18  -6.027   4.639   7.892
   87   1HH1  ARG  18          1HH1      ARG  18  -5.358   4.186  11.287
   88   2HH1  ARG  18          2HH1      ARG  18  -6.666   5.194  11.807
   89   1HH2  ARG  18          1HH2      ARG  18  -7.746   5.968   8.574
   90   2HH2  ARG  18          2HH2      ARG  18  -8.023   6.206  10.268
   91    H    ILE  19           H        ILE  19  -0.638   4.999   5.655
   92    HA   ILE  19           HA       ILE  19   0.853   2.538   6.243
   93    HB   ILE  19           HB       ILE  19   1.954   5.210   5.371
   94   1HG1  ILE  19          2HG1      ILE  19   1.244   2.751   3.759
   95   2HG1  ILE  19          1HG1      ILE  19   0.533   4.356   3.613
   96   1HG2  ILE  19          1HG2      ILE  19   3.340   3.329   6.604
   97   2HG2  ILE  19          2HG2      ILE  19   4.020   4.246   5.262
   98   3HG2  ILE  19          3HG2      ILE  19   3.375   2.629   4.988
   99   1HD1  ILE  19          1HD1      ILE  19   3.352   3.552   2.908
  100   2HD1  ILE  19          2HD1      ILE  19   2.755   5.211   2.892
  101   3HD1  ILE  19          3HD1      ILE  19   2.063   4.015   1.794
  102    H    ALA  20           H        ALA  20   2.100   2.317   8.051
  103    HA   ALA  20           HA       ALA  20   1.707   4.325  10.140
  104   1HB   ALA  20          1HB       ALA  20   1.416   1.644  10.253
  105   2HB   ALA  20          2HB       ALA  20   1.768   2.657  11.653
  106   3HB   ALA  20          3HB       ALA  20   3.076   1.814  10.825
  107    H    ARG  21           H        ARG  21   4.178   2.788   8.255
  108    HA   ARG  21           HA       ARG  21   6.068   4.820   8.988
  109   1HB   ARG  21          2HB       ARG  21   6.676   1.911   9.536
  110   2HB   ARG  21          1HB       ARG  21   7.843   3.222   9.626
  111   1HG   ARG  21          2HG       ARG  21   6.528   4.252  11.423
  112   2HG   ARG  21          1HG       ARG  21   5.398   2.899  11.351
  113   1HD   ARG  21          2HD       ARG  21   6.998   2.588  13.164
  114   2HD   ARG  21          1HD       ARG  21   7.210   1.354  11.921
  115    HE   ARG  21           HE       ARG  21   9.336   2.108  11.651
  116   1HH1  ARG  21          1HH1      ARG  21   7.449   4.699  13.033
  117   2HH1  ARG  21          2HH1      ARG  21   8.787   5.794  13.121
  118   1HH2  ARG  21          1HH2      ARG  21  11.099   3.544  11.774
  119   2HH2  ARG  21          2HH2      ARG  21  10.859   5.138  12.410
  120    H    SER  22           H        SER  22   7.327   5.337   7.295
  121    HA   SER  22           HA       SER  22   7.693   3.374   5.150
  122   1HB   SER  22          2HB       SER  22   7.173   5.151   3.466
  123   2HB   SER  22          1HB       SER  22   5.782   4.665   4.437
  124    HG   SER  22           HG       SER  22   7.348   7.009   4.662
  125    H    VAL  23           H        VAL  23   9.331   4.079   3.544
  126    HA   VAL  23           HA       VAL  23  11.765   4.658   4.714
  127    HB   VAL  23           HB       VAL  23  11.574   3.614   2.514
  128   1HG1  VAL  23          1HG1      VAL  23  10.874   6.342   1.441
  129   2HG1  VAL  23          2HG1      VAL  23   9.701   5.054   1.710
  130   3HG1  VAL  23          3HG1      VAL  23  10.998   4.835   0.534
  131   1HG2  VAL  23          1HG2      VAL  23  13.689   4.673   3.146
  132   2HG2  VAL  23          2HG2      VAL  23  13.148   6.189   2.428
  133   3HG2  VAL  23          3HG2      VAL  23  13.416   4.776   1.406
  134    H    HIS  24           H        HIS  24   9.596   6.882   2.975
  135    HA   HIS  24           HA       HIS  24  11.291   9.126   3.785
  136   1HB   HIS  24          2HB       HIS  24   8.936   9.036   1.888
  137   2HB   HIS  24          1HB       HIS  24   9.914  10.459   2.226
  138    HD1  HIS  24           1HD      HIS  24  12.672   9.795   1.792
  139    HD2  HIS  24           2HD      HIS  24   9.710   7.902  -0.423
  140    HE1  HIS  24           1HE      HIS  24  13.827   8.916  -0.261
  141    HE2  HIS  24           2HE      HIS  24  12.031   7.700  -1.546
  142    H    ARG  25           H        ARG  25  10.689  10.624   5.236
  143    HA   ARG  25           HA       ARG  25   8.585  10.046   7.040
  144   1HB   ARG  25          2HB       ARG  25  10.622  11.167   7.765
  145   2HB   ARG  25          1HB       ARG  25  10.267  12.534   6.716
  146   1HG   ARG  25          2HG       ARG  25   8.272  13.032   8.037
  147   2HG   ARG  25          1HG       ARG  25   8.630  11.664   9.089
  148   1HD   ARG  25          2HD       ARG  25  10.760  12.712   9.713
  149   2HD   ARG  25          1HD       ARG  25  10.384  14.084   8.672
  150    HE   ARG  25           HE       ARG  25   9.131  14.923  10.371
  151   1HH1  ARG  25          1HH1      ARG  25   9.375  11.470  10.828
  152   2HH1  ARG  25          2HH1      ARG  25   8.462  11.475  12.298
  153   1HH2  ARG  25          1HH2      ARG  25   7.938  14.931  12.308
  154   2HH2  ARG  25          2HH2      ARG  25   7.648  13.439  13.139
  155    H    ASP  26           H        ASP  26   8.686  11.821   4.112
  156    HA   ASP  26           HA       ASP  26   6.451  13.512   4.711
  157   1HB   ASP  26          2HB       ASP  26   6.617  14.202   2.358
  158   2HB   ASP  26          1HB       ASP  26   8.177  14.281   3.171
  159    H    ILE  27           H        ILE  27   6.568  10.282   4.191
  160    HA   ILE  27           HA       ILE  27   3.880  10.286   3.066
  161    HB   ILE  27           HB       ILE  27   4.378   8.267   1.756
  162   1HG1  ILE  27          2HG1      ILE  27   7.208   8.797   2.681
  163   2HG1  ILE  27          1HG1      ILE  27   6.232   7.375   3.017
  164   1HG2  ILE  27          1HG2      ILE  27   5.872   9.414   0.054
  165   2HG2  ILE  27          2HG2      ILE  27   5.974  10.753   1.198
  166   3HG2  ILE  27          3HG2      ILE  27   4.411  10.279   0.533
  167   1HD1  ILE  27          1HD1      ILE  27   6.416   6.590   0.820
  168   2HD1  ILE  27          2HD1      ILE  27   8.031   7.156   1.243
  169   3HD1  ILE  27          3HD1      ILE  27   6.989   8.147   0.221
  170    H    GLN  28           H        GLN  28   5.708   9.477   5.670
  171    HA   GLN  28           HA       GLN  28   4.489   6.918   6.206
  172   1HB   GLN  28          2HB       GLN  28   5.803   6.904   8.245
  173   2HB   GLN  28          1HB       GLN  28   6.822   7.330   6.878
  174   1HG   GLN  28          2HG       GLN  28   6.712   9.673   7.500
  175   2HG   GLN  28          1HG       GLN  28   5.640   9.280   8.841
  176   1HE2  GLN  28          1HE2      GLN  28   7.762   6.772   8.653
  177   2HE2  GLN  28          2HE2      GLN  28   8.957   7.326   9.768
  178    H    GLY  29           H        GLY  29   3.146   6.482   8.025
  179   1HA   GLY  29          2HA       GLY  29   1.390   6.889   9.445
  180   2HA   GLY  29          1HA       GLY  29   2.150   8.435   9.779
  181    H    ILE  30           H        ILE  30   1.359   7.837   6.492
  182    HA   ILE  30           HA       ILE  30  -0.821   9.755   6.705
  183    HB   ILE  30           HB       ILE  30   0.743   8.936   4.261
  184   1HG1  ILE  30          2HG1      ILE  30   2.122  10.179   5.851
  185   2HG1  ILE  30          1HG1      ILE  30   1.769  11.169   4.439
  186   1HG2  ILE  30          1HG2      ILE  30  -0.342  11.164   3.448
  187   2HG2  ILE  30          2HG2      ILE  30  -1.535  10.814   4.699
  188   3HG2  ILE  30          3HG2      ILE  30  -1.263   9.662   3.391
  189   1HD1  ILE  30          1HD1      ILE  30   0.032  12.343   5.697
  190   2HD1  ILE  30          2HD1      ILE  30   1.603  12.469   6.489
  191   3HD1  ILE  30          3HD1      ILE  30   0.387  11.352   7.111
  192    H    SER  31           H        SER  31  -2.837   9.035   6.563
  193    HA   SER  31           HA       SER  31  -3.347   6.386   5.449
  194   1HB   SER  31          2HB       SER  31  -5.178   8.281   6.944
  195   2HB   SER  31          1HB       SER  31  -5.597   6.643   6.440
  196    HG   SER  31           HG       SER  31  -4.909   6.651   8.592
  197    H    GLY  32           H        GLY  32  -4.918   6.017   3.796
  198   1HA   GLY  32          2HA       GLY  32  -6.263   8.179   2.517
  199   2HA   GLY  32          1HA       GLY  32  -4.815   7.735   1.633
  200    H    ARG  33           H        ARG  33  -6.308   7.299  -0.081
  201    HA   ARG  33           HA       ARG  33  -7.776   4.792   0.205
  202   1HB   ARG  33          2HB       ARG  33  -8.220   7.176  -1.462
  203   2HB   ARG  33          1HB       ARG  33  -8.642   5.618  -2.146
  204   1HG   ARG  33          2HG       ARG  33  -9.571   6.427   0.554
  205   2HG   ARG  33          1HG       ARG  33 -10.460   6.835  -0.908
  206   1HD   ARG  33          2HD       ARG  33  -9.704   4.056  -0.035
  207   2HD   ARG  33          1HD       ARG  33 -11.299   4.785   0.156
  208    HE   ARG  33           HE       ARG  33 -10.499   4.896  -2.551
  209   1HH1  ARG  33          1HH1      ARG  33 -11.618   2.645  -0.129
  210   2HH1  ARG  33          2HH1      ARG  33 -12.325   1.565  -1.282
  211   1HH2  ARG  33          1HH2      ARG  33 -11.428   3.476  -4.067
  212   2HH2  ARG  33          2HH2      ARG  33 -12.217   2.036  -3.518
  213    H    VAL  34           H        VAL  34  -7.992   3.610  -1.944
  214    HA   VAL  34           HA       VAL  34  -5.221   2.945  -2.718
  215    HB   VAL  34           HB       VAL  34  -6.594   1.172  -1.669
  216   1HG1  VAL  34          1HG1      VAL  34  -8.777   1.600  -2.453
  217   2HG1  VAL  34          2HG1      VAL  34  -8.295   0.067  -3.178
  218   3HG1  VAL  34          3HG1      VAL  34  -8.266   1.542  -4.140
  219   1HG2  VAL  34          1HG2      VAL  34  -5.931   0.458  -4.517
  220   2HG2  VAL  34          2HG2      VAL  34  -5.846  -0.568  -3.085
  221   3HG2  VAL  34          3HG2      VAL  34  -4.697   0.755  -3.291
  222    H    VAL  35           H        VAL  35  -4.627   2.351  -4.873
  223    HA   VAL  35           HA       VAL  35  -6.537   3.009  -6.986
  224    HB   VAL  35           HB       VAL  35  -3.865   3.663  -7.860
  225   1HG1  VAL  35          1HG1      VAL  35  -6.600   4.672  -8.193
  226   2HG1  VAL  35          2HG1      VAL  35  -5.365   4.292  -9.390
  227   3HG1  VAL  35          3HG1      VAL  35  -5.286   5.808  -8.495
  228   1HG2  VAL  35          1HG2      VAL  35  -4.382   4.683  -5.354
  229   2HG2  VAL  35          2HG2      VAL  35  -4.731   6.011  -6.450
  230   3HG2  VAL  35          3HG2      VAL  35  -3.160   5.236  -6.490
  231    H    ASP  36           H        ASP  36  -3.293   1.816  -6.253
  232    HA   ASP  36           HA       ASP  36  -3.803  -0.678  -7.570
  233   1HB   ASP  36          2HB       ASP  36  -3.279   0.757  -9.501
  234   2HB   ASP  36          1HB       ASP  36  -1.746   1.194  -8.755
  235    H    GLU  37           H        GLU  37  -1.817  -2.106  -7.540
  236    HA   GLU  37           HA       GLU  37  -0.024  -1.408  -5.309
  237   1HB   GLU  37          2HB       GLU  37  -1.252  -4.117  -5.872
  238   2HB   GLU  37          1HB       GLU  37  -0.060  -3.782  -4.624
  239   1HG   GLU  37          2HG       GLU  37  -1.640  -2.280  -3.519
  240   2HG   GLU  37          1HG       GLU  37  -2.834  -2.621  -4.771
  241    H    THR  38           H        THR  38   2.088  -1.482  -5.878
  242    HA   THR  38           HA       THR  38   2.787  -3.044  -8.276
  243    HB   THR  38           HB       THR  38   4.038  -0.500  -7.243
  244    HG1  THR  38           1HG      THR  38   1.955  -0.390  -8.356
  245   1HG2  THR  38          1HG2      THR  38   4.775  -2.268  -9.539
  246   2HG2  THR  38          2HG2      THR  38   5.813  -1.565  -8.298
  247   3HG2  THR  38          3HG2      THR  38   5.123  -0.539  -9.557
  248    H    ARG  39           H        ARG  39   4.906  -3.943  -8.386
  249    HA   ARG  39           HA       ARG  39   5.652  -5.646  -6.440
  250   1HB   ARG  39          2HB       ARG  39   7.884  -5.719  -7.461
  251   2HB   ARG  39          1HB       ARG  39   6.614  -5.673  -8.677
  252   1HG   ARG  39          2HG       ARG  39   7.004  -3.253  -8.953
  253   2HG   ARG  39          1HG       ARG  39   8.329  -3.360  -7.794
  254   1HD   ARG  39          2HD       ARG  39   9.475  -4.953  -9.271
  255   2HD   ARG  39          1HD       ARG  39   8.160  -4.807 -10.436
  256    HE   ARG  39           HE       ARG  39   9.156  -2.247  -9.888
  257   1HH1  ARG  39          1HH1      ARG  39  10.152  -5.202 -11.454
  258   2HH1  ARG  39          2HH1      ARG  39  11.219  -4.405 -12.558
  259   1HH2  ARG  39          1HH2      ARG  39  10.554  -1.197 -11.342
  260   2HH2  ARG  39          2HH2      ARG  39  11.448  -2.130 -12.497
  261    H    ASN  40           H        ASN  40   6.961  -2.352  -6.777
  262    HA   ASN  40           HA       ASN  40   7.701  -2.479  -3.943
  263   1HB   ASN  40          2HB       ASN  40   9.828  -1.342  -4.394
  264   2HB   ASN  40          1HB       ASN  40   9.747  -2.911  -5.177
  265   1HD2  ASN  40          1HD2      ASN  40   7.805  -0.818  -6.928
  266   2HD2  ASN  40          2HD2      ASN  40   8.958  -0.337  -8.112
  267    H    THR  41           H        THR  41   5.465  -1.209  -5.381
  268    HA   THR  41           HA       THR  41   5.728   1.378  -4.139
  269    HB   THR  41           HB       THR  41   4.932   2.530  -6.297
  270    HG1  THR  41           1HG      THR  41   5.744   1.509  -8.186
  271   1HG2  THR  41          1HG2      THR  41   7.141   3.020  -7.035
  272   2HG2  THR  41          2HG2      THR  41   7.772   1.555  -6.280
  273   3HG2  THR  41          3HG2      THR  41   7.157   2.872  -5.278
  274    H    LEU  42           H        LEU  42   3.757   2.512  -3.942
  275    HA   LEU  42           HA       LEU  42   1.396   0.812  -4.401
  276   1HB   LEU  42          2HB       LEU  42   2.074   2.578  -2.066
  277   2HB   LEU  42          1HB       LEU  42   0.437   2.039  -2.385
  278    HG   LEU  42           HG       LEU  42   2.810   0.270  -1.790
  279   1HD1  LEU  42          1HD1      LEU  42   0.724   1.516  -0.152
  280   2HD1  LEU  42          2HD1      LEU  42   2.280   0.833   0.321
  281   3HD1  LEU  42          3HD1      LEU  42   0.885  -0.223   0.088
  282   1HD2  LEU  42          1HD2      LEU  42  -0.065  -0.395  -2.423
  283   2HD2  LEU  42          2HD2      LEU  42   1.083  -1.536  -1.724
  284   3HD2  LEU  42          3HD2      LEU  42   1.368  -0.873  -3.334
  285    H    ARG  43           H        ARG  43  -0.639   1.971  -4.498
  286    HA   ARG  43           HA       ARG  43  -0.417   4.712  -5.498
  287   1HB   ARG  43          2HB       ARG  43  -1.141   2.346  -7.015
  288   2HB   ARG  43          1HB       ARG  43  -2.425   3.537  -7.030
  289   1HG   ARG  43          2HG       ARG  43  -0.885   5.225  -7.859
  290   2HG   ARG  43          1HG       ARG  43   0.433   4.053  -7.806
  291   1HD   ARG  43          2HD       ARG  43  -0.721   2.672  -9.457
  292   2HD   ARG  43          1HD       ARG  43  -2.064   3.813  -9.488
  293    HE   ARG  43           HE       ARG  43  -0.861   5.063 -10.958
  294   1HH1  ARG  43          1HH1      ARG  43   1.376   3.080  -9.152
  295   2HH1  ARG  43          2HH1      ARG  43   2.766   3.649 -10.012
  296   1HH2  ARG  43          1HH2      ARG  43   0.967   5.806 -12.091
  297   2HH2  ARG  43          2HH2      ARG  43   2.536   5.193 -11.681
  298    H    ILE  44           H        ILE  44  -1.683   5.955  -4.329
  299    HA   ILE  44           HA       ILE  44  -3.980   4.785  -2.932
  300    HB   ILE  44           HB       ILE  44  -2.347   7.267  -2.375
  301   1HG1  ILE  44          2HG1      ILE  44  -2.673   4.685  -0.839
  302   2HG1  ILE  44          1HG1      ILE  44  -1.263   5.158  -1.779
  303   1HG2  ILE  44          1HG2      ILE  44  -4.993   7.073  -1.741
  304   2HG2  ILE  44          2HG2      ILE  44  -3.806   8.061  -0.891
  305   3HG2  ILE  44          3HG2      ILE  44  -4.214   6.458  -0.284
  306   1HD1  ILE  44          1HD1      ILE  44  -0.928   7.062  -0.251
  307   2HD1  ILE  44          2HD1      ILE  44  -0.841   5.499   0.561
  308   3HD1  ILE  44          3HD1      ILE  44  -2.290   6.491   0.713
  309    H    GLU  45           H        GLU  45  -5.837   5.055  -4.045
  310    HA   GLU  45           HA       GLU  45  -6.462   7.777  -4.923
  311   1HB   GLU  45          2HB       GLU  45  -6.143   6.553  -6.949
  312   2HB   GLU  45          1HB       GLU  45  -7.118   5.210  -6.369
  313   1HG   GLU  45          2HG       GLU  45  -9.091   6.677  -6.392
  314   2HG   GLU  45          1HG       GLU  45  -8.091   7.983  -7.028
  315    H    MET  46           H        MET  46  -8.383   8.546  -4.434
  316    HA   MET  46           HA       MET  46 -10.207   6.849  -2.863
  317   1HB   MET  46          2HB       MET  46 -10.879   8.947  -1.698
  318   2HB   MET  46          1HB       MET  46  -9.205   8.507  -1.425
  319   1HG   MET  46          2HG       MET  46  -8.878  10.126  -3.519
  320   2HG   MET  46          1HG       MET  46 -10.353  10.817  -2.846
  321   1HE   MET  46          1HE       MET  46  -6.521  10.127  -2.302
  322   2HE   MET  46          2HE       MET  46  -7.297   9.055  -1.130
  323   3HE   MET  46          3HE       MET  46  -6.357  10.439  -0.572
  324    H    ASP  47           H        ASP  47 -12.360   6.943  -3.264
  325    HA   ASP  47           HA       ASP  47 -13.354   7.202  -5.750
  326   1HB   ASP  47          2HB       ASP  47 -14.572   6.220  -3.844
  327   2HB   ASP  47          1HB       ASP  47 -14.892   7.839  -3.231
  328    H    ASP  48           H        ASP  48 -12.783   9.836  -3.564
  329    HA   ASP  48           HA       ASP  48 -14.396  11.794  -4.749
  330   1HB   ASP  48          2HB       ASP  48 -11.700  12.141  -3.418
  331   2HB   ASP  48          1HB       ASP  48 -12.855  13.430  -3.739
  332    H    GLY  49           H        GLY  49 -11.708  10.146  -5.989
  333   1HA   GLY  49          2HA       GLY  49 -11.069  10.284  -8.259
  334   2HA   GLY  49          1HA       GLY  49 -11.624  11.951  -8.289
  335    H    ARG  50           H        ARG  50  -9.789  11.006  -5.568
  336    HA   ARG  50           HA       ARG  50  -7.493  12.531  -6.622
  337   1HB   ARG  50          2HB       ARG  50  -8.285  11.983  -3.768
  338   2HB   ARG  50          1HB       ARG  50  -6.860  12.877  -4.257
  339   1HG   ARG  50          2HG       ARG  50  -9.682  13.695  -4.909
  340   2HG   ARG  50          1HG       ARG  50  -8.761  14.294  -3.530
  341   1HD   ARG  50          2HD       ARG  50  -8.538  15.928  -5.218
  342   2HD   ARG  50          1HD       ARG  50  -7.012  15.049  -5.191
  343    HE   ARG  50           HE       ARG  50  -8.729  13.888  -7.092
  344   1HH1  ARG  50          1HH1      ARG  50  -6.838  16.774  -6.576
  345   2HH1  ARG  50          2HH1      ARG  50  -6.608  17.077  -8.266
  346   1HH2  ARG  50          1HH2      ARG  50  -8.427  14.283  -9.316
  347   2HH2  ARG  50          2HH2      ARG  50  -7.512  15.664  -9.820
  348    H    GLU  51           H        GLU  51  -5.733  11.448  -7.167
  349    HA   GLU  51           HA       GLU  51  -5.228   8.875  -5.836
  350   1HB   GLU  51          2HB       GLU  51  -4.324   7.999  -7.873
  351   2HB   GLU  51          1HB       GLU  51  -5.897   8.690  -8.233
  352   1HG   GLU  51          2HG       GLU  51  -3.278  10.081  -8.734
  353   2HG   GLU  51          1HG       GLU  51  -4.171   9.159  -9.942
  354    H    ILE  52           H        ILE  52  -3.082   8.348  -5.328
  355    HA   ILE  52           HA       ILE  52  -0.916  10.148  -5.939
  356    HB   ILE  52           HB       ILE  52  -1.978  11.341  -4.081
  357   1HG1  ILE  52          2HG1      ILE  52   0.642  10.021  -3.325
  358   2HG1  ILE  52          1HG1      ILE  52   0.461  11.453  -4.337
  359   1HG2  ILE  52          1HG2      ILE  52  -1.329   9.003  -2.312
  360   2HG2  ILE  52          2HG2      ILE  52  -2.912   9.209  -3.063
  361   3HG2  ILE  52          3HG2      ILE  52  -2.303  10.427  -1.942
  362   1HD1  ILE  52          1HD1      ILE  52  -0.300  11.247  -1.424
  363   2HD1  ILE  52          2HD1      ILE  52  -0.478  12.681  -2.436
  364   3HD1  ILE  52          3HD1      ILE  52   1.132  12.054  -2.068
  365    H    THR  53           H        THR  53   0.825   8.910  -6.227
  366    HA   THR  53           HA       THR  53   0.871   6.176  -5.369
  367    HB   THR  53           HB       THR  53   1.804   6.794  -7.524
  368    HG1  THR  53           1HG      THR  53   2.769   5.021  -6.556
  369   1HG2  THR  53          1HG2      THR  53   4.280   7.872  -7.062
  370   2HG2  THR  53          2HG2      THR  53   3.236   8.794  -5.980
  371   3HG2  THR  53          3HG2      THR  53   2.879   8.729  -7.706
  372    H    VAL  54           H        VAL  54   2.510   5.166  -4.080
  373    HA   VAL  54           HA       VAL  54   4.152   6.854  -2.381
  374    HB   VAL  54           HB       VAL  54   2.110   5.000  -1.150
  375   1HG1  VAL  54          1HG1      VAL  54   2.884   6.265   0.945
  376   2HG1  VAL  54          2HG1      VAL  54   4.283   6.735  -0.019
  377   3HG1  VAL  54          3HG1      VAL  54   3.958   5.029   0.286
  378   1HG2  VAL  54          1HG2      VAL  54   1.074   7.073  -0.282
  379   2HG2  VAL  54          2HG2      VAL  54   0.999   6.956  -2.040
  380   3HG2  VAL  54          3HG2      VAL  54   2.185   8.015  -1.277
  381    HA   PRO  55           HA       PRO  55   6.770   3.282  -3.201
  382   1HB   PRO  55          2HB       PRO  55   8.482   4.561  -1.153
  383   2HB   PRO  55          1HB       PRO  55   8.867   4.098  -2.813
  384   1HG   PRO  55          2HG       PRO  55   8.547   6.658  -2.148
  385   2HG   PRO  55          1HG       PRO  55   7.963   6.036  -3.704
  386   1HD   PRO  55          2HD       PRO  55   6.426   6.645  -1.206
  387   2HD   PRO  55          1HD       PRO  55   5.997   6.963  -2.900
  388    H    LYS  56           H        LYS  56   6.239   1.372  -2.336
  389    HA   LYS  56           HA       LYS  56   5.981   1.120   0.573
  390   1HB   LYS  56          2HB       LYS  56   4.887  -1.039   0.087
  391   2HB   LYS  56          1HB       LYS  56   4.062   0.329  -0.638
  392   1HG   LYS  56          2HG       LYS  56   4.882  -0.206  -2.797
  393   2HG   LYS  56          1HG       LYS  56   6.012  -1.392  -2.144
  394   1HD   LYS  56          2HD       LYS  56   3.073  -1.717  -1.704
  395   2HD   LYS  56          1HD       LYS  56   3.791  -2.190  -3.243
  396   1HE   LYS  56          2HE       LYS  56   3.681  -4.109  -1.791
  397   2HE   LYS  56          1HE       LYS  56   5.365  -3.647  -2.016
  398   1HZ   LYS  56          1HZ       LYS  56   5.520  -2.858   0.133
  399   2HZ   LYS  56          2HZ       LYS  56   4.531  -4.215   0.328
  400   3HZ   LYS  56          3HZ       LYS  56   3.849  -2.668   0.315
  401    H    GLY  57           H        GLY  57   8.341   0.659  -1.712
  402   1HA   GLY  57          2HA       GLY  57   9.388  -1.856  -1.345
  403   2HA   GLY  57          1HA       GLY  57  10.375  -0.423  -1.589
  404    H    ILE  58           H        ILE  58   9.273   0.721   0.959
  405    HA   ILE  58           HA       ILE  58  10.287  -1.027   3.004
  406    HB   ILE  58           HB       ILE  58  11.548   1.692   2.635
  407   1HG1  ILE  58          2HG1      ILE  58  13.662   0.242   2.256
  408   2HG1  ILE  58          1HG1      ILE  58  12.531  -1.056   1.887
  409   1HG2  ILE  58          1HG2      ILE  58  11.369   0.965   4.955
  410   2HG2  ILE  58          2HG2      ILE  58  13.050   0.997   4.428
  411   3HG2  ILE  58          3HG2      ILE  58  12.194  -0.541   4.555
  412   1HD1  ILE  58          1HD1      ILE  58  11.682   1.141   0.384
  413   2HD1  ILE  58          2HD1      ILE  58  12.481  -0.321  -0.194
  414   3HD1  ILE  58          3HD1      ILE  58  13.437   1.097   0.234
  415    H    ALA  59           H        ALA  59   7.781  -0.546   2.997
  416    HA   ALA  59           HA       ALA  59   7.382   1.429   5.090
  417   1HB   ALA  59          1HB       ALA  59   7.072   2.653   2.974
  418   2HB   ALA  59          2HB       ALA  59   5.615   2.614   3.966
  419   3HB   ALA  59          3HB       ALA  59   5.754   1.553   2.563
  420    H    VAL  60           H        VAL  60   6.200   0.563   6.659
  421    HA   VAL  60           HA       VAL  60   4.557  -1.771   6.174
  422    HB   VAL  60           HB       VAL  60   5.850  -1.617   8.260
  423   1HG1  VAL  60          1HG1      VAL  60   4.052   0.341   9.509
  424   2HG1  VAL  60          2HG1      VAL  60   5.155   1.004   8.303
  425   3HG1  VAL  60          3HG1      VAL  60   5.793   0.118   9.688
  426   1HG2  VAL  60          1HG2      VAL  60   3.964  -2.104   9.845
  427   2HG2  VAL  60          2HG2      VAL  60   3.925  -3.020   8.339
  428   3HG2  VAL  60          3HG2      VAL  60   2.851  -1.638   8.559
  429    H    PHE  61           H        PHE  61   2.313  -1.848   6.180
  430    HA   PHE  61           HA       PHE  61   0.801   0.511   6.885
  431   1HB   PHE  61          2HB       PHE  61  -0.288   0.652   4.626
  432   2HB   PHE  61          1HB       PHE  61   1.390   1.179   4.684
  433    HD1  PHE  61           1HD      PHE  61  -0.484  -2.010   4.119
  434    HD2  PHE  61           2HD      PHE  61   2.694   0.557   2.929
  435    HE1  PHE  61           1HE      PHE  61   0.076  -3.557   2.291
  436    HE2  PHE  61           2HE      PHE  61   3.258  -0.983   1.100
  437    HZ   PHE  61           HZ       PHE  61   1.949  -3.044   0.777
  438    H    HIS  62           H        HIS  62  -1.577   0.185   6.473
  439    HA   HIS  62           HA       HIS  62  -2.346  -2.645   6.552
  440   1HB   HIS  62          2HB       HIS  62  -3.443  -0.612   8.494
  441   2HB   HIS  62          1HB       HIS  62  -3.679  -2.355   8.514
  442    HD1  HIS  62           1HD      HIS  62  -1.076  -3.601   8.647
  443    HD2  HIS  62           2HD      HIS  62  -1.720   0.095  10.429
  444    HE1  HIS  62           1HE      HIS  62   0.739  -3.360  10.367
  445    HE2  HIS  62           2HE      HIS  62   0.279  -1.155  11.493
  446    H    PHE  63           H        PHE  63  -4.072  -3.062   5.297
  447    HA   PHE  63           HA       PHE  63  -5.506  -0.804   4.119
  448   1HB   PHE  63          2HB       PHE  63  -5.276  -3.716   3.388
  449   2HB   PHE  63          1HB       PHE  63  -6.508  -2.688   2.670
  450    HD1  PHE  63           1HD      PHE  63  -5.945  -2.328   0.486
  451    HD2  PHE  63           2HD      PHE  63  -2.912  -2.052   3.460
  452    HE1  PHE  63           1HE      PHE  63  -4.343  -1.585  -1.226
  453    HE2  PHE  63           2HE      PHE  63  -1.307  -1.304   1.749
  454    HZ   PHE  63           HZ       PHE  63  -2.020  -1.072  -0.593
  455    H    ARG  64           H        ARG  64  -7.608  -0.356   4.498
  456    HA   ARG  64           HA       ARG  64  -9.052  -2.144   6.341
  457   1HB   ARG  64          2HB       ARG  64  -9.358   0.826   5.873
  458   2HB   ARG  64          1HB       ARG  64 -10.431  -0.128   6.887
  459   1HG   ARG  64          2HG       ARG  64  -8.882   0.992   8.296
  460   2HG   ARG  64          1HG       ARG  64  -8.466  -0.720   8.293
  461   1HD   ARG  64          2HD       ARG  64  -6.510   0.823   8.123
  462   2HD   ARG  64          1HD       ARG  64  -6.628  -0.352   6.819
  463    HE   ARG  64           HE       ARG  64  -6.739   1.402   5.377
  464   1HH1  ARG  64          1HH1      ARG  64  -7.873   2.509   8.487
  465   2HH1  ARG  64          2HH1      ARG  64  -8.167   4.126   7.943
  466   1HH2  ARG  64          1HH2      ARG  64  -7.115   3.529   4.665
  467   2HH2  ARG  64          2HH2      ARG  64  -7.734   4.707   5.776
  468    H    THR  65           H        THR  65 -11.189  -2.708   5.915
  469    HA   THR  65           HA       THR  65 -12.089  -2.146   3.166
  470    HB   THR  65           HB       THR  65 -12.768  -4.539   4.880
  471    HG1  THR  65           1HG      THR  65 -10.844  -4.158   2.851
  472   1HG2  THR  65          1HG2      THR  65 -13.283  -5.438   2.486
  473   2HG2  THR  65          2HG2      THR  65 -13.531  -3.729   2.127
  474   3HG2  THR  65          3HG2      THR  65 -14.489  -4.514   3.382
  475    HA   PRO  66           HA       PRO  66 -15.451   0.235   4.844
  476   1HB   PRO  66          2HB       PRO  66 -16.879  -0.994   2.523
  477   2HB   PRO  66          1HB       PRO  66 -16.818   0.697   3.039
  478   1HG   PRO  66          2HG       PRO  66 -15.364  -0.128   0.974
  479   2HG   PRO  66          1HG       PRO  66 -14.701   1.031   2.142
  480   1HD   PRO  66          2HD       PRO  66 -14.116  -1.871   1.809
  481   2HD   PRO  66          1HD       PRO  66 -13.044  -0.554   2.322
  482    H    GLN  67           H        GLN  67 -15.842  -3.156   3.927
  483    HA   GLN  67           HA       GLN  67 -18.330  -3.535   5.233
  484   1HB   GLN  67          2HB       GLN  67 -17.660  -5.053   3.503
  485   2HB   GLN  67          1HB       GLN  67 -16.176  -5.456   4.355
  486   1HG   GLN  67          2HG       GLN  67 -17.501  -6.500   6.136
  487   2HG   GLN  67          1HG       GLN  67 -18.973  -6.136   5.232
  488   1HE2  GLN  67          1HE2      GLN  67 -16.334  -8.231   5.621
  489   2HE2  GLN  67          2HE2      GLN  67 -16.713  -9.335   4.347
  490    H    GLY  68           H        GLY  68 -15.203  -3.069   6.435
  491   1HA   GLY  68          2HA       GLY  68 -14.876  -2.758   8.785
  492   2HA   GLY  68          1HA       GLY  68 -16.085  -3.998   9.080
  493    H    GLU  69           H        GLU  69 -13.204  -3.997   6.983
  494    HA   GLU  69           HA       GLU  69 -12.207  -6.282   8.569
  495   1HB   GLU  69          2HB       GLU  69 -11.837  -5.863   5.598
  496   2HB   GLU  69          1HB       GLU  69 -11.246  -7.223   6.537
  497   1HG   GLU  69          2HG       GLU  69 -13.544  -7.884   7.032
  498   2HG   GLU  69          1HG       GLU  69 -14.137  -6.526   6.077
  499    H    LEU  70           H        LEU  70  -9.939  -6.478   8.802
  500    HA   LEU  70           HA       LEU  70  -8.423  -4.043   8.147
  501   1HB   LEU  70          2HB       LEU  70  -9.083  -4.117  10.540
  502   2HB   LEU  70          1HB       LEU  70  -8.219  -5.631  10.707
  503    HG   LEU  70           HG       LEU  70  -6.971  -3.680  11.587
  504   1HD1  LEU  70          1HD1      LEU  70  -5.446  -4.660   9.214
  505   2HD1  LEU  70          2HD1      LEU  70  -5.939  -5.798  10.469
  506   3HD1  LEU  70          3HD1      LEU  70  -4.909  -4.426  10.879
  507   1HD2  LEU  70          1HD2      LEU  70  -7.792  -2.033   9.949
  508   2HD2  LEU  70          2HD2      LEU  70  -6.835  -2.826   8.697
  509   3HD2  LEU  70          3HD2      LEU  70  -6.031  -2.048  10.060
  510    H    VAL  71           H        VAL  71  -6.720  -4.452   6.929
  511    HA   VAL  71           HA       VAL  71  -5.489  -7.128   7.047
  512    HB   VAL  71           HB       VAL  71  -5.514  -5.222   4.698
  513   1HG1  VAL  71          1HG1      VAL  71  -4.593  -8.089   4.839
  514   2HG1  VAL  71          2HG1      VAL  71  -3.523  -6.686   4.859
  515   3HG1  VAL  71          3HG1      VAL  71  -4.517  -7.016   3.441
  516   1HG2  VAL  71          1HG2      VAL  71  -7.642  -5.967   4.536
  517   2HG2  VAL  71          2HG2      VAL  71  -7.333  -7.395   5.523
  518   3HG2  VAL  71          3HG2      VAL  71  -6.858  -7.376   3.825
  519    H    GLU  72           H        GLU  72  -3.211  -7.256   7.005
  520    HA   GLU  72           HA       GLU  72  -1.798  -4.702   7.350
  521   1HB   GLU  72          2HB       GLU  72  -1.401  -7.161   9.061
  522   2HB   GLU  72          1HB       GLU  72  -0.486  -5.665   9.183
  523   1HG   GLU  72          2HG       GLU  72  -2.514  -4.469   9.818
  524   2HG   GLU  72          1HG       GLU  72  -3.439  -5.964   9.685
  525    H    ILE  73           H        ILE  73   0.246  -4.577   6.548
  526    HA   ILE  73           HA       ILE  73   1.573  -6.959   5.542
  527    HB   ILE  73           HB       ILE  73   0.876  -4.664   3.708
  528   1HG1  ILE  73          2HG1      ILE  73  -0.041  -7.548   3.704
  529   2HG1  ILE  73          1HG1      ILE  73  -1.031  -6.150   4.115
  530   1HG2  ILE  73          1HG2      ILE  73   1.952  -6.047   1.964
  531   2HG2  ILE  73          2HG2      ILE  73   2.472  -7.173   3.217
  532   3HG2  ILE  73          3HG2      ILE  73   3.077  -5.517   3.215
  533   1HD1  ILE  73          1HD1      ILE  73  -0.807  -5.314   1.834
  534   2HD1  ILE  73          2HD1      ILE  73  -1.493  -6.940   1.859
  535   3HD1  ILE  73          3HD1      ILE  73   0.199  -6.703   1.421
  536    H    ASP  74           H        ASP  74   3.815  -6.619   5.131
  537    HA   ASP  74           HA       ASP  74   4.827  -4.158   6.384
  538   1HB   ASP  74          2HB       ASP  74   6.895  -5.505   6.825
  539   2HB   ASP  74          1HB       ASP  74   5.453  -6.103   7.641
  540    H    GLY  75           H        GLY  75   5.156  -2.766   4.748
  541   1HA   GLY  75          2HA       GLY  75   6.126  -3.436   2.182
  542   2HA   GLY  75          1HA       GLY  75   6.078  -1.825   2.870
  543    H    ARG  76           H        ARG  76   7.760  -3.248   5.153
  544    HA   ARG  76           HA       ARG  76  10.274  -2.512   3.943
  545   1HB   ARG  76          2HB       ARG  76   9.570  -3.114   6.806
  546   2HB   ARG  76          1HB       ARG  76  11.163  -2.614   6.255
  547   1HG   ARG  76          2HG       ARG  76  10.159  -0.505   5.425
  548   2HG   ARG  76          1HG       ARG  76   8.622  -1.004   6.134
  549   1HD   ARG  76          2HD       ARG  76   9.593  -1.022   8.340
  550   2HD   ARG  76          1HD       ARG  76  11.194  -0.687   7.680
  551    HE   ARG  76           HE       ARG  76   9.435   1.357   6.899
  552   1HH1  ARG  76          1HH1      ARG  76  10.996   0.122   9.766
  553   2HH1  ARG  76          2HH1      ARG  76  11.045   1.664  10.554
  554   1HH2  ARG  76          1HH2      ARG  76   9.504   3.386   7.933
  555   2HH2  ARG  76          2HH2      ARG  76  10.199   3.516   9.515
  556    H    ALA  77           H        ALA  77   8.834  -5.257   5.576
  557    HA   ALA  77           HA       ALA  77  11.168  -6.863   4.931
  558   1HB   ALA  77          1HB       ALA  77  10.806  -7.344   7.104
  559   2HB   ALA  77          2HB       ALA  77   9.718  -8.544   6.407
  560   3HB   ALA  77          3HB       ALA  77   9.077  -7.011   7.001
  561    H    LEU  78           H        LEU  78   8.155  -6.219   3.613
  562    HA   LEU  78           HA       LEU  78   8.123  -8.856   2.295
  563   1HB   LEU  78          2HB       LEU  78   6.164  -8.377   3.791
  564   2HB   LEU  78          1HB       LEU  78   5.740  -7.058   2.716
  565    HG   LEU  78           HG       LEU  78   5.419  -8.645   0.872
  566   1HD1  LEU  78          1HD1      LEU  78   6.013 -10.758   2.939
  567   2HD1  LEU  78          2HD1      LEU  78   7.028 -10.341   1.558
  568   3HD1  LEU  78          3HD1      LEU  78   5.434 -11.048   1.298
  569   1HD2  LEU  78          1HD2      LEU  78   3.892  -8.846   3.407
  570   2HD2  LEU  78          2HD2      LEU  78   3.539 -10.020   2.142
  571   3HD2  LEU  78          3HD2      LEU  78   3.379  -8.296   1.811
  572    H    VAL  79           H        VAL  79   9.717  -6.758   1.348
  573    HA   VAL  79           HA       VAL  79   8.527  -5.145  -0.606
  574    HB   VAL  79           HB       VAL  79  10.823  -4.786   0.151
  575   1HG1  VAL  79          1HG1      VAL  79  12.585  -6.233  -0.188
  576   2HG1  VAL  79          2HG1      VAL  79  11.789  -7.056  -1.531
  577   3HG1  VAL  79          3HG1      VAL  79  11.260  -7.355   0.125
  578   1HG2  VAL  79          1HG2      VAL  79   9.903  -4.277  -2.285
  579   2HG2  VAL  79          2HG2      VAL  79  11.205  -5.377  -2.732
  580   3HG2  VAL  79          3HG2      VAL  79  11.565  -3.913  -1.818
  581    H    ALA  80           H        ALA  80   7.119  -6.070  -1.999
  582    HA   ALA  80           HA       ALA  80   7.293  -8.620  -3.114
  583   1HB   ALA  80          1HB       ALA  80   5.194  -7.829  -3.403
  584   2HB   ALA  80          2HB       ALA  80   5.836  -7.360  -4.976
  585   3HB   ALA  80          3HB       ALA  80   5.737  -6.173  -3.675
  586    H    ARG  81           H        ARG  81   8.559  -9.469  -4.626
  587    HA   ARG  81           HA       ARG  81  10.226  -7.672  -6.209
  588   1HB   ARG  81          2HB       ARG  81  11.448  -9.815  -6.797
  589   2HB   ARG  81          1HB       ARG  81  11.526  -9.303  -5.118
  590   1HG   ARG  81          2HG       ARG  81  11.217 -11.685  -5.249
  591   2HG   ARG  81          1HG       ARG  81   9.786 -10.936  -4.551
  592   1HD   ARG  81          2HD       ARG  81   8.577 -11.182  -6.594
  593   2HD   ARG  81          1HD       ARG  81  10.028 -11.679  -7.463
  594    HE   ARG  81           HE       ARG  81   9.611 -13.803  -6.766
  595   1HH1  ARG  81          1HH1      ARG  81   8.007 -11.621  -4.563
  596   2HH1  ARG  81          2HH1      ARG  81   7.315 -12.891  -3.613
  597   1HH2  ARG  81          1HH2      ARG  81   8.696 -15.473  -5.520
  598   2HH2  ARG  81          2HH2      ARG  81   7.703 -15.078  -4.157
  599    HA   PRO  82           HA       PRO  82   8.076  -8.638  -9.948
  600   1HB   PRO  82          2HB       PRO  82   9.809  -7.700 -11.736
  601   2HB   PRO  82          1HB       PRO  82   9.088  -6.623 -10.537
  602   1HG   PRO  82          2HG       PRO  82  11.817  -7.824 -10.609
  603   2HG   PRO  82          1HG       PRO  82  11.313  -6.213 -10.073
  604   1HD   PRO  82          2HD       PRO  82  11.806  -8.427  -8.421
  605   2HD   PRO  82          1HD       PRO  82  10.971  -6.934  -7.950
  606    H    GLU  83           H        GLU  83   9.344  -9.247 -12.418
  607    HA   GLU  83           HA       GLU  83   9.378 -12.022 -12.404
  608   1HB   GLU  83          2HB       GLU  83  10.696 -10.153 -14.380
  609   2HB   GLU  83          1HB       GLU  83  10.358 -11.855 -14.663
  610   1HG   GLU  83          2HG       GLU  83   7.966 -11.417 -14.445
  611   2HG   GLU  83          1HG       GLU  83   8.305  -9.711 -14.162
  612    H    GLU  84           H        GLU  84  11.825  -9.851 -11.426
  613    HA   GLU  84           HA       GLU  84  14.062 -11.584 -11.908
  614   1HB   GLU  84          2HB       GLU  84  14.261  -9.115 -11.835
  615   2HB   GLU  84          1HB       GLU  84  13.852  -9.151 -10.126
  616   1HG   GLU  84          2HG       GLU  84  15.870 -10.379  -9.630
  617   2HG   GLU  84          1HG       GLU  84  16.260 -10.485 -11.345
  618    H    ARG  85           H        ARG  85  11.602 -12.187 -10.001
  619    HA   ARG  85           HA       ARG  85  11.197 -13.248  -8.044
  620   1HB   ARG  85          2HB       ARG  85  12.706 -15.112  -7.513
  621   2HB   ARG  85          1HB       ARG  85  12.314 -15.050  -9.224
  622   1HG   ARG  85          2HG       ARG  85  14.473 -14.104  -9.726
  623   2HG   ARG  85          1HG       ARG  85  14.869 -14.016  -8.009
  624   1HD   ARG  85          2HD       ARG  85  15.932 -15.947  -9.026
  625   2HD   ARG  85          1HD       ARG  85  14.712 -16.461  -7.862
  626    HE   ARG  85           HE       ARG  85  13.655 -17.531  -9.566
  627   1HH1  ARG  85          1HH1      ARG  85  15.628 -15.004 -10.948
  628   2HH1  ARG  85          2HH1      ARG  85  15.206 -15.396 -12.580
  629   1HH2  ARG  85          1HH2      ARG  85  13.104 -18.050 -11.712
  630   2HH2  ARG  85          2HH2      ARG  85  13.776 -17.127 -13.015
  631    H    ILE  86           H        ILE  86  12.444 -14.006  -5.863
  632    HA   ILE  86           HA       ILE  86  13.116 -11.528  -4.605
  633    HB   ILE  86           HB       ILE  86  13.352 -14.284  -3.402
  634   1HG1  ILE  86          2HG1      ILE  86  10.947 -12.444  -3.468
  635   2HG1  ILE  86          1HG1      ILE  86  11.105 -13.940  -4.384
  636   1HG2  ILE  86          1HG2      ILE  86  14.356 -12.229  -2.266
  637   2HG2  ILE  86          2HG2      ILE  86  13.249 -13.218  -1.313
  638   3HG2  ILE  86          3HG2      ILE  86  12.690 -11.701  -2.021
  639   1HD1  ILE  86          1HD1      ILE  86  11.502 -14.970  -2.004
  640   2HD1  ILE  86          2HD1      ILE  86   9.874 -14.661  -2.611
  641   3HD1  ILE  86          3HD1      ILE  86  10.626 -13.529  -1.485
  Start of MODEL   20
    1    H    ARG   9           H        ARG   9 -10.202 -11.325  -7.642
    2    HA   ARG   9           HA       ARG   9  -8.950 -13.833  -7.822
    3   1HB   ARG   9          2HB       ARG   9  -7.867 -12.617  -9.776
    4   2HB   ARG   9          1HB       ARG   9  -7.112 -11.564  -8.591
    5   1HG   ARG   9          2HG       ARG   9  -6.751 -14.551  -8.715
    6   2HG   ARG   9          1HG       ARG   9  -5.632 -13.365  -9.384
    7   1HD   ARG   9          2HD       ARG   9  -5.400 -12.408  -7.085
    8   2HD   ARG   9          1HD       ARG   9  -6.365 -13.757  -6.488
    9    HE   ARG   9           HE       ARG   9  -4.238 -14.795  -7.971
   10   1HH1  ARG   9          1HH1      ARG   9  -4.793 -13.065  -4.990
   11   2HH1  ARG   9          2HH1      ARG   9  -3.395 -13.718  -4.205
   12   1HH2  ARG   9          1HH2      ARG   9  -2.398 -15.654  -6.939
   13   2HH2  ARG   9          2HH2      ARG   9  -2.034 -15.188  -5.311
   14    H    HIS  10           H        HIS  10  -7.946 -10.519  -6.955
   15    HA   HIS  10           HA       HIS  10  -7.489 -11.484  -4.213
   16   1HB   HIS  10          2HB       HIS  10  -6.009  -9.364  -4.090
   17   2HB   HIS  10          1HB       HIS  10  -5.403 -10.770  -4.955
   18    HD1  HIS  10           1HD      HIS  10  -7.459  -7.707  -5.960
   19    HD2  HIS  10           2HD      HIS  10  -4.247 -10.002  -7.253
   20    HE1  HIS  10           1HE      HIS  10  -6.690  -6.639  -8.098
   21    HE2  HIS  10           2HE      HIS  10  -4.687  -7.988  -8.813
   22    H    GLU  11           H        GLU  11  -9.057  -9.067  -6.174
   23    HA   GLU  11           HA       GLU  11 -10.412  -7.290  -5.668
   24   1HB   GLU  11          2HB       GLU  11 -12.304  -7.896  -4.234
   25   2HB   GLU  11          1HB       GLU  11 -11.908  -9.188  -5.359
   26   1HG   GLU  11          2HG       GLU  11 -10.777 -10.409  -3.598
   27   2HG   GLU  11          1HG       GLU  11 -11.091  -9.097  -2.463
   28    H    LEU  12           H        LEU  12  -7.882  -7.276  -4.205
   29    HA   LEU  12           HA       LEU  12  -8.430  -6.388  -1.532
   30   1HB   LEU  12          2HB       LEU  12  -6.313  -7.498  -2.211
   31   2HB   LEU  12          1HB       LEU  12  -5.918  -6.096  -3.184
   32    HG   LEU  12           HG       LEU  12  -6.314  -5.962  -0.196
   33   1HD1  LEU  12          1HD1      LEU  12  -3.740  -6.235  -1.743
   34   2HD1  LEU  12          2HD1      LEU  12  -4.467  -7.479  -0.727
   35   3HD1  LEU  12          3HD1      LEU  12  -3.889  -5.978  -0.005
   36   1HD2  LEU  12          1HD2      LEU  12  -5.753  -4.030  -2.309
   37   2HD2  LEU  12          2HD2      LEU  12  -4.593  -3.969  -0.981
   38   3HD2  LEU  12          3HD2      LEU  12  -6.315  -3.772  -0.658
   39    H    ILE  13           H        ILE  13  -8.098  -4.909  -4.668
   40    HA   ILE  13           HA       ILE  13  -7.536  -2.279  -3.968
   41    HB   ILE  13           HB       ILE  13  -9.331  -3.192  -6.218
   42   1HG1  ILE  13          2HG1      ILE  13  -6.338  -2.729  -6.155
   43   2HG1  ILE  13          1HG1      ILE  13  -7.132  -4.297  -6.269
   44   1HG2  ILE  13          1HG2      ILE  13  -8.275  -1.031  -7.230
   45   2HG2  ILE  13          2HG2      ILE  13  -8.020  -0.595  -5.541
   46   3HG2  ILE  13          3HG2      ILE  13  -9.651  -0.908  -6.134
   47   1HD1  ILE  13          1HD1      ILE  13  -7.197  -4.121  -8.469
   48   2HD1  ILE  13          2HD1      ILE  13  -6.348  -2.579  -8.355
   49   3HD1  ILE  13          3HD1      ILE  13  -8.112  -2.619  -8.349
   50    H    GLY  14           H        GLY  14  -8.918  -0.416  -3.769
   51   1HA   GLY  14          2HA       GLY  14 -10.956   0.668  -3.338
   52   2HA   GLY  14          1HA       GLY  14 -11.731  -0.898  -3.174
   53    H    LEU  15           H        LEU  15  -9.386  -1.638  -1.313
   54    HA   LEU  15           HA       LEU  15 -10.748  -0.967   1.104
   55   1HB   LEU  15          2HB       LEU  15  -8.054  -2.261   0.689
   56   2HB   LEU  15          1HB       LEU  15  -8.921  -2.194   2.210
   57    HG   LEU  15           HG       LEU  15  -9.887  -3.626  -0.266
   58   1HD1  LEU  15          1HD1      LEU  15  -7.830  -4.515   1.030
   59   2HD1  LEU  15          2HD1      LEU  15  -9.149  -5.619   0.640
   60   3HD1  LEU  15          3HD1      LEU  15  -9.011  -4.949   2.266
   61   1HD2  LEU  15          1HD2      LEU  15 -11.790  -4.159   0.833
   62   2HD2  LEU  15          2HD2      LEU  15 -11.455  -2.647   1.678
   63   3HD2  LEU  15          3HD2      LEU  15 -11.002  -4.185   2.409
   64    H    SER  16           H        SER  16  -9.596  -0.050   3.012
   65    HA   SER  16           HA       SER  16  -8.290   2.439   2.232
   66   1HB   SER  16          2HB       SER  16  -8.640   3.039   4.643
   67   2HB   SER  16          1HB       SER  16 -10.129   2.645   3.783
   68    HG   SER  16           HG       SER  16 -10.433   1.105   5.159
   69    H    VAL  17           H        VAL  17  -6.322   3.184   3.328
   70    HA   VAL  17           HA       VAL  17  -4.743   1.103   4.633
   71    HB   VAL  17           HB       VAL  17  -3.694   2.553   2.205
   72   1HG1  VAL  17          1HG1      VAL  17  -1.898   0.760   2.428
   73   2HG1  VAL  17          2HG1      VAL  17  -2.527   0.496   4.054
   74   3HG1  VAL  17          3HG1      VAL  17  -1.876   2.073   3.605
   75   1HG2  VAL  17          1HG2      VAL  17  -3.699   0.158   1.262
   76   2HG2  VAL  17          2HG2      VAL  17  -5.224   1.044   1.305
   77   3HG2  VAL  17          3HG2      VAL  17  -4.879  -0.181   2.527
   78    H    ARG  18           H        ARG  18  -3.444   1.869   6.183
   79    HA   ARG  18           HA       ARG  18  -3.043   4.784   6.332
   80   1HB   ARG  18          2HB       ARG  18  -3.366   2.716   8.495
   81   2HB   ARG  18          1HB       ARG  18  -2.617   4.271   8.823
   82   1HG   ARG  18          2HG       ARG  18  -4.894   4.422   9.457
   83   2HG   ARG  18          1HG       ARG  18  -4.696   5.363   7.978
   84   1HD   ARG  18          2HD       ARG  18  -5.604   3.515   6.673
   85   2HD   ARG  18          1HD       ARG  18  -5.772   2.550   8.138
   86    HE   ARG  18           HE       ARG  18  -7.150   4.991   8.437
   87   1HH1  ARG  18          1HH1      ARG  18  -7.362   1.941   6.761
   88   2HH1  ARG  18          2HH1      ARG  18  -9.089   1.987   6.639
   89   1HH2  ARG  18          1HH2      ARG  18  -9.422   5.053   8.279
   90   2HH2  ARG  18          2HH2      ARG  18 -10.258   3.752   7.500
   91    H    ILE  19           H        ILE  19  -1.020   5.543   6.298
   92    HA   ILE  19           HA       ILE  19   1.171   3.634   6.107
   93    HB   ILE  19           HB       ILE  19   1.215   6.634   5.736
   94   1HG1  ILE  19          2HG1      ILE  19  -0.245   5.546   4.092
   95   2HG1  ILE  19          1HG1      ILE  19   1.227   6.146   3.327
   96   1HG2  ILE  19          1HG2      ILE  19   3.412   6.504   5.379
   97   2HG2  ILE  19          2HG2      ILE  19   3.248   5.065   4.375
   98   3HG2  ILE  19          3HG2      ILE  19   3.331   4.911   6.130
   99   1HD1  ILE  19          1HD1      ILE  19   0.508   3.299   3.988
  100   2HD1  ILE  19          2HD1      ILE  19   2.143   3.796   3.552
  101   3HD1  ILE  19          3HD1      ILE  19   0.822   4.007   2.402
  102    H    ALA  20           H        ALA  20   2.282   3.080   7.862
  103    HA   ALA  20           HA       ALA  20   2.222   4.766  10.225
  104   1HB   ALA  20          1HB       ALA  20   2.874   1.939   9.665
  105   2HB   ALA  20          2HB       ALA  20   1.945   2.647  10.986
  106   3HB   ALA  20          3HB       ALA  20   3.708   2.698  11.021
  107    H    ARG  21           H        ARG  21   4.484   3.588   7.854
  108    HA   ARG  21           HA       ARG  21   6.325   5.701   8.459
  109   1HB   ARG  21          2HB       ARG  21   7.170   2.823   8.811
  110   2HB   ARG  21          1HB       ARG  21   8.278   4.184   8.746
  111   1HG   ARG  21          2HG       ARG  21   6.125   3.804  10.818
  112   2HG   ARG  21          1HG       ARG  21   7.832   3.417  11.036
  113   1HD   ARG  21          2HD       ARG  21   8.424   5.753  10.676
  114   2HD   ARG  21          1HD       ARG  21   6.730   6.155  10.400
  115    HE   ARG  21           HE       ARG  21   6.948   4.936  12.907
  116   1HH1  ARG  21          1HH1      ARG  21   7.921   7.878  11.303
  117   2HH1  ARG  21          2HH1      ARG  21   7.916   8.821  12.756
  118   1HH2  ARG  21          1HH2      ARG  21   6.941   6.173  14.820
  119   2HH2  ARG  21          2HH2      ARG  21   7.360   7.852  14.753
  120    H    SER  22           H        SER  22   7.536   6.271   6.699
  121    HA   SER  22           HA       SER  22   7.587   4.446   4.407
  122   1HB   SER  22          2HB       SER  22   6.925   6.259   2.876
  123   2HB   SER  22          1HB       SER  22   5.656   5.918   4.054
  124    HG   SER  22           HG       SER  22   7.576   7.991   4.316
  125    H    VAL  23           H        VAL  23   9.100   5.195   2.695
  126    HA   VAL  23           HA       VAL  23  11.638   5.707   3.749
  127    HB   VAL  23           HB       VAL  23  11.322   4.567   1.614
  128   1HG1  VAL  23          1HG1      VAL  23  10.510   7.259   0.519
  129   2HG1  VAL  23          2HG1      VAL  23   9.417   5.909   0.813
  130   3HG1  VAL  23          3HG1      VAL  23  10.690   5.764  -0.400
  131   1HG2  VAL  23          1HG2      VAL  23  12.892   7.126   1.287
  132   2HG2  VAL  23          2HG2      VAL  23  13.111   5.640   0.361
  133   3HG2  VAL  23          3HG2      VAL  23  13.471   5.666   2.087
  134    H    HIS  24           H        HIS  24   9.330   7.864   2.140
  135    HA   HIS  24           HA       HIS  24  11.082  10.141   2.737
  136   1HB   HIS  24          2HB       HIS  24   8.657   9.965   0.936
  137   2HB   HIS  24          1HB       HIS  24   9.637  11.407   1.179
  138    HD1  HIS  24           1HD      HIS  24  12.384  10.736   0.673
  139    HD2  HIS  24           2HD      HIS  24   9.350   8.753  -1.361
  140    HE1  HIS  24           1HE      HIS  24  13.467   9.786  -1.388
  141    HE2  HIS  24           2HE      HIS  24  11.633   8.509  -2.554
  142    H    ARG  25           H        ARG  25  10.539  11.668   4.185
  143    HA   ARG  25           HA       ARG  25   8.437  11.153   6.023
  144   1HB   ARG  25          2HB       ARG  25   9.130  13.271   7.080
  145   2HB   ARG  25          1HB       ARG  25  10.491  12.203   6.765
  146   1HG   ARG  25          2HG       ARG  25  11.054  13.504   4.775
  147   2HG   ARG  25          1HG       ARG  25   9.691  14.575   5.091
  148   1HD   ARG  25          2HD       ARG  25  10.694  15.223   7.227
  149   2HD   ARG  25          1HD       ARG  25  12.049  14.138   6.924
  150    HE   ARG  25           HE       ARG  25  12.978  15.784   5.662
  151   1HH1  ARG  25          1HH1      ARG  25   9.534  16.346   5.785
  152   2HH1  ARG  25          2HH1      ARG  25   9.613  17.795   4.840
  153   1HH2  ARG  25          1HH2      ARG  25  13.081  17.691   4.426
  154   2HH2  ARG  25          2HH2      ARG  25  11.625  18.559   4.070
  155    H    ASP  26           H        ASP  26   8.666  13.025   3.142
  156    HA   ASP  26           HA       ASP  26   6.591  14.864   3.630
  157   1HB   ASP  26          2HB       ASP  26   7.576  13.747   0.999
  158   2HB   ASP  26          1HB       ASP  26   6.547  15.164   1.179
  159    H    ILE  27           H        ILE  27   6.571  11.532   2.835
  160    HA   ILE  27           HA       ILE  27   3.702  11.626   2.305
  161    HB   ILE  27           HB       ILE  27   3.940   9.423   1.246
  162   1HG1  ILE  27          2HG1      ILE  27   6.891   9.850   1.772
  163   2HG1  ILE  27          1HG1      ILE  27   5.873   8.605   2.485
  164   1HG2  ILE  27          1HG2      ILE  27   3.974  11.174  -0.291
  165   2HG2  ILE  27          2HG2      ILE  27   5.405  10.231  -0.704
  166   3HG2  ILE  27          3HG2      ILE  27   5.569  11.723   0.223
  167   1HD1  ILE  27          1HD1      ILE  27   6.564   8.848  -0.434
  168   2HD1  ILE  27          2HD1      ILE  27   5.562   7.592   0.293
  169   3HD1  ILE  27          3HD1      ILE  27   7.272   7.708   0.711
  170    H    GLN  28           H        GLN  28   6.121  10.514   4.451
  171    HA   GLN  28           HA       GLN  28   4.926   8.280   5.604
  172   1HB   GLN  28          2HB       GLN  28   7.236   8.957   6.052
  173   2HB   GLN  28          1HB       GLN  28   6.664  10.382   6.910
  174   1HG   GLN  28          2HG       GLN  28   5.586   8.919   8.568
  175   2HG   GLN  28          1HG       GLN  28   6.241   7.516   7.726
  176   1HE2  GLN  28          1HE2      GLN  28   7.996   6.721   8.616
  177   2HE2  GLN  28          2HE2      GLN  28   9.193   7.607   9.490
  178    H    GLY  29           H        GLY  29   3.762   8.017   7.564
  179   1HA   GLY  29          2HA       GLY  29   2.086   8.468   9.059
  180   2HA   GLY  29          1HA       GLY  29   2.672  10.121   9.075
  181    H    ILE  30           H        ILE  30   1.754   8.994   5.978
  182    HA   ILE  30           HA       ILE  30  -0.683  10.581   6.168
  183    HB   ILE  30           HB       ILE  30   0.856   9.775   3.703
  184   1HG1  ILE  30          2HG1      ILE  30   0.648  12.414   5.172
  185   2HG1  ILE  30          1HG1      ILE  30   2.085  11.402   5.028
  186   1HG2  ILE  30          1HG2      ILE  30  -0.900  10.392   2.496
  187   2HG2  ILE  30          2HG2      ILE  30  -0.935  11.964   3.295
  188   3HG2  ILE  30          3HG2      ILE  30  -1.827  10.606   3.981
  189   1HD1  ILE  30          1HD1      ILE  30   0.781  13.145   2.984
  190   2HD1  ILE  30          2HD1      ILE  30   1.736  11.754   2.470
  191   3HD1  ILE  30          3HD1      ILE  30   2.481  13.024   3.442
  192    H    SER  31           H        SER  31  -2.621   9.671   5.979
  193    HA   SER  31           HA       SER  31  -2.760   6.817   5.345
  194   1HB   SER  31          2HB       SER  31  -3.819   7.529   7.438
  195   2HB   SER  31          1HB       SER  31  -4.829   8.672   6.552
  196    HG   SER  31           HG       SER  31  -6.122   7.098   6.040
  197    H    GLY  32           H        GLY  32  -4.575   6.051   3.974
  198   1HA   GLY  32          2HA       GLY  32  -5.974   7.853   2.283
  199   2HA   GLY  32          1HA       GLY  32  -4.550   7.235   1.460
  200    H    ARG  33           H        ARG  33  -6.123   6.366  -0.047
  201    HA   ARG  33           HA       ARG  33  -7.204   3.822   0.919
  202   1HB   ARG  33          2HB       ARG  33  -8.879   5.660   0.336
  203   2HB   ARG  33          1HB       ARG  33  -8.476   5.327  -1.331
  204   1HG   ARG  33          2HG       ARG  33  -9.640   3.400  -1.356
  205   2HG   ARG  33          1HG       ARG  33  -9.092   2.948   0.254
  206   1HD   ARG  33          2HD       ARG  33 -11.154   5.089  -0.186
  207   2HD   ARG  33          1HD       ARG  33 -11.587   3.386  -0.069
  208    HE   ARG  33           HE       ARG  33 -11.049   3.415   2.192
  209   1HH1  ARG  33          1HH1      ARG  33 -10.428   6.537   0.754
  210   2HH1  ARG  33          2HH1      ARG  33 -10.139   7.312   2.270
  211   1HH2  ARG  33          1HH2      ARG  33 -10.688   4.447   4.182
  212   2HH2  ARG  33          2HH2      ARG  33 -10.289   6.131   4.213
  213    H    VAL  34           H        VAL  34  -7.603   2.276  -1.046
  214    HA   VAL  34           HA       VAL  34  -5.011   2.146  -2.399
  215    HB   VAL  34           HB       VAL  34  -5.567   0.307  -0.899
  216   1HG1  VAL  34          1HG1      VAL  34  -7.520  -0.746  -0.876
  217   2HG1  VAL  34          2HG1      VAL  34  -7.473  -1.025  -2.613
  218   3HG1  VAL  34          3HG1      VAL  34  -8.103   0.495  -1.984
  219   1HG2  VAL  34          1HG2      VAL  34  -4.968  -1.510  -2.386
  220   2HG2  VAL  34          2HG2      VAL  34  -4.081  -0.052  -2.832
  221   3HG2  VAL  34          3HG2      VAL  34  -5.474  -0.562  -3.787
  222    H    VAL  35           H        VAL  35  -4.758   1.365  -4.542
  223    HA   VAL  35           HA       VAL  35  -7.168   1.264  -6.170
  224    HB   VAL  35           HB       VAL  35  -6.079   3.594  -6.329
  225   1HG1  VAL  35          1HG1      VAL  35  -3.802   2.892  -6.582
  226   2HG1  VAL  35          2HG1      VAL  35  -4.337   3.822  -7.977
  227   3HG1  VAL  35          3HG1      VAL  35  -4.201   2.069  -8.085
  228   1HG2  VAL  35          1HG2      VAL  35  -7.797   2.456  -7.862
  229   2HG2  VAL  35          2HG2      VAL  35  -6.442   2.224  -8.965
  230   3HG2  VAL  35          3HG2      VAL  35  -6.923   3.852  -8.490
  231    H    ASP  36           H        ASP  36  -3.626   0.919  -6.154
  232    HA   ASP  36           HA       ASP  36  -3.816  -1.738  -7.208
  233   1HB   ASP  36          2HB       ASP  36  -3.987  -0.422  -9.278
  234   2HB   ASP  36          1HB       ASP  36  -2.496   0.420  -8.869
  235    H    GLU  37           H        GLU  37  -1.590  -2.722  -7.444
  236    HA   GLU  37           HA       GLU  37   0.334  -1.420  -5.632
  237   1HB   GLU  37          2HB       GLU  37  -0.310  -4.371  -5.796
  238   2HB   GLU  37          1HB       GLU  37   0.952  -3.661  -4.798
  239   1HG   GLU  37          2HG       GLU  37  -0.737  -2.428  -3.537
  240   2HG   GLU  37          1HG       GLU  37  -2.001  -3.140  -4.537
  241    H    THR  38           H        THR  38   2.421  -1.332  -6.326
  242    HA   THR  38           HA       THR  38   3.063  -2.796  -8.802
  243    HB   THR  38           HB       THR  38   4.081  -0.074  -7.971
  244    HG1  THR  38           1HG      THR  38   1.926   0.045  -8.608
  245   1HG2  THR  38          1HG2      THR  38   4.277  -1.145 -10.737
  246   2HG2  THR  38          2HG2      THR  38   5.479  -1.620  -9.538
  247   3HG2  THR  38          3HG2      THR  38   5.250   0.083  -9.930
  248    H    ARG  39           H        ARG  39   5.159  -3.598  -9.032
  249    HA   ARG  39           HA       ARG  39   6.336  -4.730  -6.802
  250   1HB   ARG  39          2HB       ARG  39   8.238  -5.256  -8.254
  251   2HB   ARG  39          1HB       ARG  39   6.706  -5.559  -9.059
  252   1HG   ARG  39          2HG       ARG  39   6.918  -3.454 -10.274
  253   2HG   ARG  39          1HG       ARG  39   8.450  -3.140  -9.460
  254   1HD   ARG  39          2HD       ARG  39   9.410  -5.142 -10.467
  255   2HD   ARG  39          1HD       ARG  39   7.873  -5.498 -11.254
  256    HE   ARG  39           HE       ARG  39   9.872  -3.728 -12.183
  257   1HH1  ARG  39          1HH1      ARG  39   6.405  -4.099 -12.002
  258   2HH1  ARG  39          2HH1      ARG  39   6.100  -3.076 -13.363
  259   1HH2  ARG  39          1HH2      ARG  39   9.470  -2.386 -13.978
  260   2HH2  ARG  39          2HH2      ARG  39   7.838  -2.106 -14.488
  261    H    ASN  40           H        ASN  40   6.714  -1.519  -8.014
  262    HA   ASN  40           HA       ASN  40   8.735  -1.052  -5.942
  263   1HB   ASN  40          2HB       ASN  40   9.961   0.479  -7.416
  264   2HB   ASN  40          1HB       ASN  40   9.950  -1.165  -8.033
  265   1HD2  ASN  40          1HD2      ASN  40   6.912   0.135  -8.582
  266   2HD2  ASN  40          2HD2      ASN  40   7.160   0.688 -10.190
  267    H    THR  41           H        THR  41   5.701  -0.392  -6.646
  268    HA   THR  41           HA       THR  41   5.776   2.103  -5.222
  269    HB   THR  41           HB       THR  41   4.353   3.270  -6.983
  270    HG1  THR  41           1HG      THR  41   3.905   2.069  -8.628
  271   1HG2  THR  41          1HG2      THR  41   7.170   2.743  -7.866
  272   2HG2  THR  41          2HG2      THR  41   6.748   3.804  -6.521
  273   3HG2  THR  41          3HG2      THR  41   6.187   4.180  -8.151
  274    H    LEU  42           H        LEU  42   3.640   2.922  -4.702
  275    HA   LEU  42           HA       LEU  42   1.588   0.804  -4.711
  276   1HB   LEU  42          2HB       LEU  42   2.714   1.099  -2.519
  277   2HB   LEU  42          1HB       LEU  42   2.172   2.755  -2.483
  278    HG   LEU  42           HG       LEU  42   0.823   1.294  -1.049
  279   1HD1  LEU  42          1HD1      LEU  42  -0.090   3.322  -2.373
  280   2HD1  LEU  42          2HD1      LEU  42  -1.235   2.226  -1.597
  281   3HD1  LEU  42          3HD1      LEU  42  -0.940   2.111  -3.332
  282   1HD2  LEU  42          1HD2      LEU  42   0.899  -0.418  -3.344
  283   2HD2  LEU  42          2HD2      LEU  42  -0.780  -0.055  -2.945
  284   3HD2  LEU  42          3HD2      LEU  42   0.283  -0.756  -1.726
  285    H    ARG  43           H        ARG  43  -0.263   1.414  -5.633
  286    HA   ARG  43           HA       ARG  43  -0.673   4.273  -6.089
  287   1HB   ARG  43          2HB       ARG  43  -0.676   2.335  -7.887
  288   2HB   ARG  43          1HB       ARG  43  -2.344   2.163  -7.381
  289   1HG   ARG  43          2HG       ARG  43  -2.696   4.567  -7.905
  290   2HG   ARG  43          1HG       ARG  43  -1.040   4.631  -8.504
  291   1HD   ARG  43          2HD       ARG  43  -3.284   2.932  -9.593
  292   2HD   ARG  43          1HD       ARG  43  -2.559   4.340 -10.365
  293    HE   ARG  43           HE       ARG  43  -1.607   1.682 -10.470
  294   1HH1  ARG  43          1HH1      ARG  43  -0.492   4.985 -10.288
  295   2HH1  ARG  43          2HH1      ARG  43   1.052   4.631 -10.987
  296   1HH2  ARG  43          1HH2      ARG  43   0.419   1.219 -11.393
  297   2HH2  ARG  43          2HH2      ARG  43   1.569   2.495 -11.617
  298    H    ILE  44           H        ILE  44  -2.207   5.347  -5.063
  299    HA   ILE  44           HA       ILE  44  -4.012   3.893  -3.256
  300    HB   ILE  44           HB       ILE  44  -2.799   6.645  -3.183
  301   1HG1  ILE  44          2HG1      ILE  44  -2.685   4.311  -1.271
  302   2HG1  ILE  44          1HG1      ILE  44  -1.411   4.804  -2.381
  303   1HG2  ILE  44          1HG2      ILE  44  -4.329   7.503  -1.847
  304   2HG2  ILE  44          2HG2      ILE  44  -4.315   6.083  -0.808
  305   3HG2  ILE  44          3HG2      ILE  44  -5.358   6.125  -2.227
  306   1HD1  ILE  44          1HD1      ILE  44  -2.116   5.841   0.246
  307   2HD1  ILE  44          2HD1      ILE  44  -1.871   7.097  -0.969
  308   3HD1  ILE  44          3HD1      ILE  44  -0.595   5.926  -0.641
  309    H    GLU  45           H        GLU  45  -6.149   3.818  -3.741
  310    HA   GLU  45           HA       GLU  45  -7.317   6.234  -4.904
  311   1HB   GLU  45          2HB       GLU  45  -7.291   4.739  -6.776
  312   2HB   GLU  45          1HB       GLU  45  -7.928   3.413  -5.808
  313   1HG   GLU  45          2HG       GLU  45 -10.029   4.666  -5.540
  314   2HG   GLU  45          1HG       GLU  45  -9.378   5.939  -6.571
  315    H    MET  46           H        MET  46  -9.248   6.793  -4.133
  316    HA   MET  46           HA       MET  46 -10.364   5.174  -1.955
  317   1HB   MET  46          2HB       MET  46 -11.043   7.301  -0.881
  318   2HB   MET  46          1HB       MET  46  -9.301   7.116  -1.013
  319   1HG   MET  46          2HG       MET  46  -9.735   8.465  -3.259
  320   2HG   MET  46          1HG       MET  46 -11.118   9.035  -2.326
  321   1HE   MET  46          1HE       MET  46  -7.250   9.004  -2.746
  322   2HE   MET  46          2HE       MET  46  -7.447   8.013  -1.295
  323   3HE   MET  46          3HE       MET  46  -6.690   9.602  -1.179
  324    H    ASP  47           H        ASP  47 -12.463   4.767  -1.929
  325    HA   ASP  47           HA       ASP  47 -14.032   4.671  -4.116
  326   1HB   ASP  47          2HB       ASP  47 -14.998   5.088  -1.286
  327   2HB   ASP  47          1HB       ASP  47 -15.978   4.478  -2.614
  328    H    ASP  48           H        ASP  48 -13.476   7.501  -2.204
  329    HA   ASP  48           HA       ASP  48 -15.711   9.026  -2.919
  330   1HB   ASP  48          2HB       ASP  48 -12.878   9.964  -2.403
  331   2HB   ASP  48          1HB       ASP  48 -14.305  10.996  -2.419
  332    H    GLY  49           H        GLY  49 -13.151   7.855  -4.824
  333   1HA   GLY  49          2HA       GLY  49 -13.252   7.932  -7.195
  334   2HA   GLY  49          1HA       GLY  49 -14.067   9.483  -7.083
  335    H    ARG  50           H        ARG  50 -11.407   9.042  -4.994
  336    HA   ARG  50           HA       ARG  50  -9.799  10.813  -6.716
  337   1HB   ARG  50          2HB       ARG  50  -9.658  10.385  -3.743
  338   2HB   ARG  50          1HB       ARG  50  -8.588  11.434  -4.650
  339   1HG   ARG  50          2HG       ARG  50 -11.575  11.777  -4.486
  340   2HG   ARG  50          1HG       ARG  50 -10.413  12.618  -3.459
  341   1HD   ARG  50          2HD       ARG  50 -10.942  14.120  -5.198
  342   2HD   ARG  50          1HD       ARG  50  -9.351  13.474  -5.590
  343    HE   ARG  50           HE       ARG  50 -11.331  11.928  -6.854
  344   1HH1  ARG  50          1HH1      ARG  50  -9.853  15.082  -7.028
  345   2HH1  ARG  50          2HH1      ARG  50 -10.155  15.267  -8.724
  346   1HH2  ARG  50          1HH2      ARG  50 -11.729  12.168  -9.083
  347   2HH2  ARG  50          2HH2      ARG  50 -11.218  13.614  -9.891
  348    H    GLU  51           H        GLU  51  -7.437  10.550  -6.628
  349    HA   GLU  51           HA       GLU  51  -6.484   7.912  -5.889
  350   1HB   GLU  51          2HB       GLU  51  -6.379   8.893  -8.748
  351   2HB   GLU  51          1HB       GLU  51  -5.587   7.446  -8.142
  352   1HG   GLU  51          2HG       GLU  51  -7.762   6.488  -7.585
  353   2HG   GLU  51          1HG       GLU  51  -8.555   7.938  -8.198
  354    H    ILE  52           H        ILE  52  -4.260   7.793  -5.664
  355    HA   ILE  52           HA       ILE  52  -2.518   9.946  -6.459
  356    HB   ILE  52           HB       ILE  52  -3.507  10.891  -4.419
  357   1HG1  ILE  52          2HG1      ILE  52  -1.396  11.329  -3.197
  358   2HG1  ILE  52          1HG1      ILE  52  -0.629  10.015  -4.087
  359   1HG2  ILE  52          1HG2      ILE  52  -3.693   8.405  -3.476
  360   2HG2  ILE  52          2HG2      ILE  52  -3.682   9.825  -2.431
  361   3HG2  ILE  52          3HG2      ILE  52  -2.203   8.897  -2.672
  362   1HD1  ILE  52          1HD1      ILE  52  -1.027  11.239  -6.192
  363   2HD1  ILE  52          2HD1      ILE  52  -0.024  12.152  -5.062
  364   3HD1  ILE  52          3HD1      ILE  52  -1.727  12.568  -5.264
  365    H    THR  53           H        THR  53  -0.262   9.414  -6.150
  366    HA   THR  53           HA       THR  53   0.146   6.530  -5.783
  367    HB   THR  53           HB       THR  53   0.796   7.494  -7.950
  368    HG1  THR  53           1HG      THR  53   2.604   6.342  -8.048
  369   1HG2  THR  53          1HG2      THR  53   1.488   9.733  -7.043
  370   2HG2  THR  53          2HG2      THR  53   2.570   9.009  -8.234
  371   3HG2  THR  53          3HG2      THR  53   2.985   8.959  -6.520
  372    H    VAL  54           H        VAL  54   1.844   5.705  -4.536
  373    HA   VAL  54           HA       VAL  54   3.480   7.505  -2.958
  374    HB   VAL  54           HB       VAL  54   1.607   5.575  -1.581
  375   1HG1  VAL  54          1HG1      VAL  54   3.634   7.523  -0.479
  376   2HG1  VAL  54          2HG1      VAL  54   3.723   5.764  -0.415
  377   3HG1  VAL  54          3HG1      VAL  54   2.473   6.616   0.490
  378   1HG2  VAL  54          1HG2      VAL  54   0.339   7.459  -2.345
  379   2HG2  VAL  54          2HG2      VAL  54   1.569   8.584  -1.771
  380   3HG2  VAL  54          3HG2      VAL  54   0.616   7.657  -0.613
  381    HA   PRO  55           HA       PRO  55   6.224   4.053  -3.811
  382   1HB   PRO  55          2HB       PRO  55   7.993   5.363  -1.845
  383   2HB   PRO  55          1HB       PRO  55   8.286   4.986  -3.545
  384   1HG   PRO  55          2HG       PRO  55   7.894   7.502  -2.727
  385   2HG   PRO  55          1HG       PRO  55   7.276   6.929  -4.287
  386   1HD   PRO  55          2HD       PRO  55   5.814   7.337  -1.706
  387   2HD   PRO  55          1HD       PRO  55   5.307   7.727  -3.361
  388    H    LYS  56           H        LYS  56   5.835   2.117  -2.918
  389    HA   LYS  56           HA       LYS  56   5.679   1.883   0.001
  390   1HB   LYS  56          2HB       LYS  56   4.714  -0.359  -0.434
  391   2HB   LYS  56          1HB       LYS  56   3.762   0.960  -1.090
  392   1HG   LYS  56          2HG       LYS  56   4.649   0.519  -3.311
  393   2HG   LYS  56          1HG       LYS  56   5.672  -0.760  -2.662
  394   1HD   LYS  56          2HD       LYS  56   2.663  -0.781  -2.484
  395   2HD   LYS  56          1HD       LYS  56   3.567  -1.537  -3.794
  396   1HE   LYS  56          2HE       LYS  56   3.081  -3.252  -2.241
  397   2HE   LYS  56          1HE       LYS  56   4.787  -2.860  -2.028
  398   1HZ   LYS  56          1HZ       LYS  56   3.054  -1.323  -0.331
  399   2HZ   LYS  56          2HZ       LYS  56   4.435  -2.220   0.061
  400   3HZ   LYS  56          3HZ       LYS  56   2.934  -2.987  -0.054
  401    H    GLY  57           H        GLY  57   8.009   1.538  -2.319
  402   1HA   GLY  57          2HA       GLY  57   9.187  -0.918  -1.987
  403   2HA   GLY  57          1HA       GLY  57  10.101   0.565  -2.218
  404    H    ILE  58           H        ILE  58   8.986   1.635   0.348
  405    HA   ILE  58           HA       ILE  58  10.054  -0.100   2.376
  406    HB   ILE  58           HB       ILE  58  11.266   2.643   2.027
  407   1HG1  ILE  58          2HG1      ILE  58  13.408   1.238   1.648
  408   2HG1  ILE  58          1HG1      ILE  58  12.305  -0.080   1.268
  409   1HG2  ILE  58          1HG2      ILE  58  12.560   2.216   3.912
  410   2HG2  ILE  58          2HG2      ILE  58  12.267   0.479   3.840
  411   3HG2  ILE  58          3HG2      ILE  58  10.978   1.569   4.345
  412   1HD1  ILE  58          1HD1      ILE  58  13.184   2.084  -0.377
  413   2HD1  ILE  58          2HD1      ILE  58  11.427   2.118  -0.227
  414   3HD1  ILE  58          3HD1      ILE  58  12.234   0.662  -0.810
  415    H    ALA  59           H        ALA  59   7.546   0.332   2.394
  416    HA   ALA  59           HA       ALA  59   7.135   2.412   4.405
  417   1HB   ALA  59          1HB       ALA  59   5.413   3.494   3.325
  418   2HB   ALA  59          2HB       ALA  59   5.080   2.124   2.265
  419   3HB   ALA  59          3HB       ALA  59   6.511   3.120   1.995
  420    H    VAL  60           H        VAL  60   6.431   1.372   6.170
  421    HA   VAL  60           HA       VAL  60   4.851  -1.035   5.993
  422    HB   VAL  60           HB       VAL  60   6.463  -0.747   7.831
  423   1HG1  VAL  60          1HG1      VAL  60   4.696   1.126   9.284
  424   2HG1  VAL  60          2HG1      VAL  60   5.669   1.806   7.978
  425   3HG1  VAL  60          3HG1      VAL  60   6.452   0.964   9.315
  426   1HG2  VAL  60          1HG2      VAL  60   4.854  -1.302   9.716
  427   2HG2  VAL  60          2HG2      VAL  60   4.744  -2.304   8.269
  428   3HG2  VAL  60          3HG2      VAL  60   3.555  -1.032   8.553
  429    H    PHE  61           H        PHE  61   2.686  -1.157   5.924
  430    HA   PHE  61           HA       PHE  61   1.073   0.910   7.146
  431   1HB   PHE  61          2HB       PHE  61  -0.196   1.413   5.090
  432   2HB   PHE  61          1HB       PHE  61   1.490   1.905   4.971
  433    HD1  PHE  61           1HD      PHE  61   2.570   1.456   3.010
  434    HD2  PHE  61           2HD      PHE  61  -0.634  -1.079   4.202
  435    HE1  PHE  61           1HE      PHE  61   2.789   0.195   0.909
  436    HE2  PHE  61           2HE      PHE  61  -0.414  -2.347   2.107
  437    HZ   PHE  61           HZ       PHE  61   1.295  -1.710   0.457
  438    H    HIS  62           H        HIS  62  -1.098   0.355   7.415
  439    HA   HIS  62           HA       HIS  62  -1.698  -2.497   6.954
  440   1HB   HIS  62          2HB       HIS  62  -2.604  -0.709   9.224
  441   2HB   HIS  62          1HB       HIS  62  -3.076  -2.390   9.003
  442    HD1  HIS  62           1HD      HIS  62  -1.833  -1.945  11.596
  443    HD2  HIS  62           2HD      HIS  62   0.487  -2.577   8.206
  444    HE1  HIS  62           1HE      HIS  62   0.400  -2.728  12.444
  445    HE2  HIS  62           2HE      HIS  62   1.814  -3.023  10.381
  446    H    PHE  63           H        PHE  63  -3.641  -2.999   5.988
  447    HA   PHE  63           HA       PHE  63  -5.292  -0.692   5.214
  448   1HB   PHE  63          2HB       PHE  63  -5.957  -1.883   3.246
  449   2HB   PHE  63          1HB       PHE  63  -4.207  -1.977   3.364
  450    HD1  PHE  63           1HD      PHE  63  -7.256  -3.921   4.294
  451    HD2  PHE  63           2HD      PHE  63  -3.192  -4.007   3.036
  452    HE1  PHE  63           1HE      PHE  63  -7.384  -6.365   4.062
  453    HE2  PHE  63           2HE      PHE  63  -3.313  -6.453   2.801
  454    HZ   PHE  63           HZ       PHE  63  -5.412  -7.636   3.312
  455    H    ARG  64           H        ARG  64  -7.450  -0.657   5.549
  456    HA   ARG  64           HA       ARG  64  -8.531  -2.821   7.224
  457   1HB   ARG  64          2HB       ARG  64  -9.420   0.060   6.996
  458   2HB   ARG  64          1HB       ARG  64 -10.141  -1.148   8.048
  459   1HG   ARG  64          2HG       ARG  64  -7.307  -0.148   8.214
  460   2HG   ARG  64          1HG       ARG  64  -8.639   0.337   9.264
  461   1HD   ARG  64          2HD       ARG  64  -7.530  -2.455   8.981
  462   2HD   ARG  64          1HD       ARG  64  -7.230  -1.357  10.326
  463    HE   ARG  64           HE       ARG  64  -9.482  -3.031   9.990
  464   1HH1  ARG  64          1HH1      ARG  64  -8.568   0.130  11.155
  465   2HH1  ARG  64          2HH1      ARG  64  -9.929   0.270  12.214
  466   1HH2  ARG  64          1HH2      ARG  64 -11.269  -2.851  11.390
  467   2HH2  ARG  64          2HH2      ARG  64 -11.461  -1.422  12.351
  468    H    THR  65           H        THR  65 -10.469  -3.772   6.740
  469    HA   THR  65           HA       THR  65 -11.548  -3.183   4.069
  470    HB   THR  65           HB       THR  65 -11.748  -5.709   5.722
  471    HG1  THR  65           1HG      THR  65  -9.776  -5.820   4.937
  472   1HG2  THR  65          1HG2      THR  65 -12.368  -6.616   3.361
  473   2HG2  THR  65          2HG2      THR  65 -12.909  -4.960   3.090
  474   3HG2  THR  65          3HG2      THR  65 -13.604  -5.910   4.403
  475    HA   PRO  66           HA       PRO  66 -15.178  -1.316   5.846
  476   1HB   PRO  66          2HB       PRO  66 -16.454  -2.802   3.582
  477   2HB   PRO  66          1HB       PRO  66 -16.683  -1.126   4.097
  478   1HG   PRO  66          2HG       PRO  66 -15.160  -1.699   1.990
  479   2HG   PRO  66          1HG       PRO  66 -14.701  -0.417   3.125
  480   1HD   PRO  66          2HD       PRO  66 -13.548  -3.130   2.769
  481   2HD   PRO  66          1HD       PRO  66 -12.770  -1.634   3.322
  482    H    GLN  67           H        GLN  67 -15.094  -4.726   4.944
  483    HA   GLN  67           HA       GLN  67 -17.430  -5.552   6.255
  484   1HB   GLN  67          2HB       GLN  67 -14.887  -7.104   5.752
  485   2HB   GLN  67          1HB       GLN  67 -16.432  -7.809   6.205
  486   1HG   GLN  67          2HG       GLN  67 -17.423  -6.969   4.136
  487   2HG   GLN  67          1HG       GLN  67 -15.870  -6.273   3.680
  488   1HE2  GLN  67          1HE2      GLN  67 -14.821  -7.437   2.254
  489   2HE2  GLN  67          2HE2      GLN  67 -14.846  -9.158   2.114
  490    H    GLY  68           H        GLY  68 -14.454  -4.475   7.521
  491   1HA   GLY  68          2HA       GLY  68 -14.281  -3.930   9.847
  492   2HA   GLY  68          1HA       GLY  68 -15.315  -5.305  10.207
  493    H    GLU  69           H        GLU  69 -12.410  -5.080   8.174
  494    HA   GLU  69           HA       GLU  69 -11.106  -6.997   9.998
  495   1HB   GLU  69          2HB       GLU  69 -10.966  -6.995   6.980
  496   2HB   GLU  69          1HB       GLU  69 -10.072  -8.074   8.041
  497   1HG   GLU  69          2HG       GLU  69 -12.170  -9.022   8.850
  498   2HG   GLU  69          1HG       GLU  69 -13.069  -7.937   7.789
  499    H    LEU  70           H        LEU  70  -8.824  -6.904  10.121
  500    HA   LEU  70           HA       LEU  70  -7.627  -4.429   9.064
  501   1HB   LEU  70          2HB       LEU  70  -8.173  -4.237  11.477
  502   2HB   LEU  70          1HB       LEU  70  -7.150  -5.620  11.798
  503    HG   LEU  70           HG       LEU  70  -6.147  -3.028  10.614
  504   1HD1  LEU  70          1HD1      LEU  70  -6.996  -2.651  12.868
  505   2HD1  LEU  70          2HD1      LEU  70  -5.233  -2.575  12.843
  506   3HD1  LEU  70          3HD1      LEU  70  -6.044  -4.011  13.466
  507   1HD2  LEU  70          1HD2      LEU  70  -4.900  -5.616  11.385
  508   2HD2  LEU  70          2HD2      LEU  70  -3.993  -4.134  11.689
  509   3HD2  LEU  70          3HD2      LEU  70  -4.515  -4.528  10.051
  510    H    VAL  71           H        VAL  71  -5.828  -4.745   7.926
  511    HA   VAL  71           HA       VAL  71  -4.297  -7.224   8.372
  512    HB   VAL  71           HB       VAL  71  -4.801  -5.918   5.697
  513   1HG1  VAL  71          1HG1      VAL  71  -3.135  -8.235   6.580
  514   2HG1  VAL  71          2HG1      VAL  71  -2.740  -6.933   5.458
  515   3HG1  VAL  71          3HG1      VAL  71  -3.839  -8.222   4.963
  516   1HG2  VAL  71          1HG2      VAL  71  -6.824  -6.926   6.121
  517   2HG2  VAL  71          2HG2      VAL  71  -6.105  -8.201   7.103
  518   3HG2  VAL  71          3HG2      VAL  71  -5.945  -8.245   5.347
  519    H    GLU  72           H        GLU  72  -2.041  -7.107   7.908
  520    HA   GLU  72           HA       GLU  72  -0.979  -4.358   7.916
  521   1HB   GLU  72          2HB       GLU  72   0.234  -6.786   9.244
  522   2HB   GLU  72          1HB       GLU  72   0.844  -5.137   9.320
  523   1HG   GLU  72          2HG       GLU  72  -1.200  -4.453  10.495
  524   2HG   GLU  72          1HG       GLU  72  -1.766  -6.121  10.451
  525    H    ILE  73           H        ILE  73   0.731  -3.877   6.612
  526    HA   ILE  73           HA       ILE  73   1.958  -6.031   5.048
  527    HB   ILE  73           HB       ILE  73   0.826  -3.506   3.829
  528   1HG1  ILE  73          2HG1      ILE  73   0.018  -6.407   3.524
  529   2HG1  ILE  73          1HG1      ILE  73  -0.912  -5.148   4.333
  530   1HG2  ILE  73          1HG2      ILE  73   1.594  -4.376   1.701
  531   2HG2  ILE  73          2HG2      ILE  73   2.256  -5.804   2.497
  532   3HG2  ILE  73          3HG2      ILE  73   2.953  -4.214   2.813
  533   1HD1  ILE  73          1HD1      ILE  73  -1.380  -4.054   2.297
  534   2HD1  ILE  73          2HD1      ILE  73  -1.645  -5.773   1.998
  535   3HD1  ILE  73          3HD1      ILE  73  -0.170  -4.995   1.426
  536    H    ASP  74           H        ASP  74   4.109  -5.850   5.107
  537    HA   ASP  74           HA       ASP  74   5.274  -3.382   6.107
  538   1HB   ASP  74          2HB       ASP  74   6.541  -6.067   5.523
  539   2HB   ASP  74          1HB       ASP  74   7.360  -4.700   6.273
  540    H    GLY  75           H        GLY  75   5.378  -1.899   4.520
  541   1HA   GLY  75          2HA       GLY  75   5.934  -2.349   1.818
  542   2HA   GLY  75          1HA       GLY  75   6.122  -0.819   2.646
  543    H    ARG  76           H        ARG  76   8.068  -2.564   4.459
  544    HA   ARG  76           HA       ARG  76  10.368  -1.849   2.870
  545   1HB   ARG  76          2HB       ARG  76  11.654  -2.114   4.936
  546   2HB   ARG  76          1HB       ARG  76  10.302  -1.013   5.145
  547   1HG   ARG  76          2HG       ARG  76   9.014  -2.821   6.199
  548   2HG   ARG  76          1HG       ARG  76  10.406  -3.889   6.029
  549   1HD   ARG  76          2HD       ARG  76  11.734  -2.398   7.435
  550   2HD   ARG  76          1HD       ARG  76  10.352  -1.315   7.599
  551    HE   ARG  76           HE       ARG  76  10.849  -3.654   9.106
  552   1HH1  ARG  76          1HH1      ARG  76   8.253  -1.829   7.650
  553   2HH1  ARG  76          2HH1      ARG  76   7.047  -2.451   8.724
  554   1HH2  ARG  76          1HH2      ARG  76   9.262  -4.469  10.522
  555   2HH2  ARG  76          2HH2      ARG  76   7.619  -3.946  10.356
  556    H    ALA  77           H        ALA  77   9.201  -4.648   4.662
  557    HA   ALA  77           HA       ALA  77  11.193  -6.296   3.339
  558   1HB   ALA  77          1HB       ALA  77  11.391  -6.748   5.566
  559   2HB   ALA  77          2HB       ALA  77  10.274  -8.020   5.072
  560   3HB   ALA  77          3HB       ALA  77   9.662  -6.568   5.864
  561    H    LEU  78           H        LEU  78   7.796  -5.738   3.315
  562    HA   LEU  78           HA       LEU  78   7.095  -8.319   2.283
  563   1HB   LEU  78          2HB       LEU  78   5.551  -6.848   3.597
  564   2HB   LEU  78          1HB       LEU  78   5.451  -5.799   2.198
  565    HG   LEU  78           HG       LEU  78   3.515  -7.346   2.462
  566   1HD1  LEU  78          1HD1      LEU  78   3.196  -7.300   0.254
  567   2HD1  LEU  78          2HD1      LEU  78   4.624  -8.284  -0.066
  568   3HD1  LEU  78          3HD1      LEU  78   4.787  -6.545   0.173
  569   1HD2  LEU  78          1HD2      LEU  78   3.702  -9.584   2.538
  570   2HD2  LEU  78          2HD2      LEU  78   5.345  -9.236   3.078
  571   3HD2  LEU  78          3HD2      LEU  78   5.036  -9.619   1.385
  572    H    VAL  79           H        VAL  79   7.996  -5.270   0.886
  573    HA   VAL  79           HA       VAL  79   6.965  -5.532  -1.678
  574    HB   VAL  79           HB       VAL  79   9.636  -4.334  -0.922
  575   1HG1  VAL  79          1HG1      VAL  79   9.414  -3.023  -2.968
  576   2HG1  VAL  79          2HG1      VAL  79   7.911  -3.862  -3.353
  577   3HG1  VAL  79          3HG1      VAL  79   9.435  -4.750  -3.326
  578   1HG2  VAL  79          1HG2      VAL  79   6.990  -2.936  -1.267
  579   2HG2  VAL  79          2HG2      VAL  79   8.503  -2.250  -0.678
  580   3HG2  VAL  79          3HG2      VAL  79   7.637  -3.438   0.296
  581    H    ALA  80           H        ALA  80   7.049  -7.477  -2.657
  582    HA   ALA  80           HA       ALA  80   9.688  -8.726  -3.037
  583   1HB   ALA  80          1HB       ALA  80   8.721 -10.796  -3.016
  584   2HB   ALA  80          2HB       ALA  80   7.176 -10.204  -3.628
  585   3HB   ALA  80          3HB       ALA  80   7.617  -9.936  -1.942
  586    H    ARG  81           H        ARG  81  10.546  -8.145  -4.936
  587    HA   ARG  81           HA       ARG  81   8.766  -8.032  -7.279
  588   1HB   ARG  81          2HB       ARG  81  10.414  -6.446  -8.264
  589   2HB   ARG  81          1HB       ARG  81   9.610  -5.834  -6.827
  590   1HG   ARG  81          2HG       ARG  81  11.582  -6.382  -5.488
  591   2HG   ARG  81          1HG       ARG  81  12.390  -6.989  -6.933
  592   1HD   ARG  81          2HD       ARG  81  12.215  -4.764  -7.955
  593   2HD   ARG  81          1HD       ARG  81  11.432  -4.161  -6.493
  594    HE   ARG  81           HE       ARG  81  13.877  -5.302  -5.767
  595   1HH1  ARG  81          1HH1      ARG  81  12.674  -2.578  -7.586
  596   2HH1  ARG  81          2HH1      ARG  81  14.060  -1.592  -7.264
  597   1HH2  ARG  81          1HH2      ARG  81  15.702  -4.008  -5.343
  598   2HH2  ARG  81          2HH2      ARG  81  15.780  -2.403  -5.992
  599    HA   PRO  82           HA       PRO  82  11.600 -11.462  -8.297
  600   1HB   PRO  82          2HB       PRO  82   9.840 -12.927  -9.703
  601   2HB   PRO  82          1HB       PRO  82   9.802 -12.881  -7.939
  602   1HG   PRO  82          2HG       PRO  82   8.118 -11.365  -9.899
  603   2HG   PRO  82          1HG       PRO  82   7.619 -12.234  -8.435
  604   1HD   PRO  82          2HD       PRO  82   7.999  -9.536  -8.514
  605   2HD   PRO  82          1HD       PRO  82   8.229 -10.506  -7.050
  606    H    GLU  83           H        GLU  83  10.201 -12.292 -11.114
  607    HA   GLU  83           HA       GLU  83  11.776 -10.328 -12.622
  608   1HB   GLU  83          2HB       GLU  83  11.049 -13.164 -13.355
  609   2HB   GLU  83          1HB       GLU  83  11.976 -12.063 -14.366
  610   1HG   GLU  83          2HG       GLU  83  13.726 -11.972 -12.667
  611   2HG   GLU  83          1HG       GLU  83  12.795 -13.072 -11.649
  612    H    GLU  84           H        GLU  84   8.642 -11.740 -12.274
  613    HA   GLU  84           HA       GLU  84   7.675 -10.683 -14.798
  614   1HB   GLU  84          2HB       GLU  84   6.833 -12.839 -14.001
  615   2HB   GLU  84          1HB       GLU  84   6.208 -12.069 -12.548
  616   1HG   GLU  84          2HG       GLU  84   4.671 -10.746 -13.906
  617   2HG   GLU  84          1HG       GLU  84   5.298 -11.517 -15.363
  618    H    ARG  85           H        ARG  85   7.011 -10.151 -11.347
  619    HA   ARG  85           HA       ARG  85   6.787  -7.359 -11.590
  620   1HB   ARG  85          2HB       ARG  85   4.694  -7.957 -12.780
  621   2HB   ARG  85          1HB       ARG  85   4.139  -8.799 -11.342
  622   1HG   ARG  85          2HG       ARG  85   4.228  -6.667 -10.101
  623   2HG   ARG  85          1HG       ARG  85   4.685  -5.851 -11.595
  624   1HD   ARG  85          2HD       ARG  85   2.589  -6.573 -12.631
  625   2HD   ARG  85          1HD       ARG  85   2.134  -7.395 -11.139
  626    HE   ARG  85           HE       ARG  85   1.397  -5.394 -10.355
  627   1HH1  ARG  85          1HH1      ARG  85   3.750  -4.762 -12.856
  628   2HH1  ARG  85          2HH1      ARG  85   3.582  -3.043 -12.751
  629   1HH2  ARG  85          1HH2      ARG  85   1.171  -3.134 -10.221
  630   2HH2  ARG  85          2HH2      ARG  85   2.119  -2.118 -11.257
  631    H    ILE  86           H        ILE  86   4.772  -9.639  -9.738
  632    HA   ILE  86           HA       ILE  86   6.220  -8.799  -7.310
  633    HB   ILE  86           HB       ILE  86   3.336  -9.682  -7.366
  634   1HG1  ILE  86          2HG1      ILE  86   3.498  -7.591  -8.599
  635   2HG1  ILE  86          1HG1      ILE  86   2.773  -7.292  -7.025
  636   1HG2  ILE  86          1HG2      ILE  86   3.551  -8.312  -5.118
  637   2HG2  ILE  86          2HG2      ILE  86   5.251  -8.751  -5.291
  638   3HG2  ILE  86          3HG2      ILE  86   4.019 -10.010  -5.209
  639   1HD1  ILE  86          1HD1      ILE  86   5.697  -6.884  -7.533
  640   2HD1  ILE  86          2HD1      ILE  86   4.711  -6.265  -6.208
  641   3HD1  ILE  86          3HD1      ILE  86   4.496  -5.629  -7.840
  Start of MODEL   21
    1    H    ARG   9           H        ARG   9 -13.690 -15.377  -4.463
    2    HA   ARG   9           HA       ARG   9 -13.417 -14.712  -1.701
    3   1HB   ARG   9          2HB       ARG   9 -11.585 -15.738  -2.969
    4   2HB   ARG   9          1HB       ARG   9 -11.493 -14.319  -4.002
    5   1HG   ARG   9          2HG       ARG   9 -10.847 -12.959  -2.079
    6   2HG   ARG   9          1HG       ARG   9 -10.944 -14.382  -1.041
    7   1HD   ARG   9          2HD       ARG   9  -8.637 -13.937  -1.672
    8   2HD   ARG   9          1HD       ARG   9  -9.188 -15.462  -2.362
    9    HE   ARG   9           HE       ARG   9  -8.759 -14.594  -4.417
   10   1HH1  ARG   9          1HH1      ARG   9  -9.242 -11.932  -2.211
   11   2HH1  ARG   9          2HH1      ARG   9  -8.946 -10.722  -3.412
   12   1HH2  ARG   9          1HH2      ARG   9  -8.361 -13.002  -5.995
   13   2HH2  ARG   9          2HH2      ARG   9  -8.443 -11.327  -5.558
   14    H    HIS  10           H        HIS  10 -12.865 -12.698  -0.787
   15    HA   HIS  10           HA       HIS  10 -14.329 -10.503  -1.781
   16   1HB   HIS  10          2HB       HIS  10 -12.160 -10.571   0.327
   17   2HB   HIS  10          1HB       HIS  10 -13.263  -9.228   0.049
   18    HD1  HIS  10           1HD      HIS  10 -15.954 -10.233   0.110
   19    HD2  HIS  10           2HD      HIS  10 -13.008 -12.042   2.415
   20    HE1  HIS  10           1HE      HIS  10 -17.183 -11.467   1.924
   21    HE2  HIS  10           2HE      HIS  10 -15.383 -12.626   3.254
   22    H    GLU  11           H        GLU  11 -13.189  -8.257  -1.909
   23    HA   GLU  11           HA       GLU  11 -10.922  -8.526  -3.775
   24   1HB   GLU  11          2HB       GLU  11 -12.957  -7.750  -4.882
   25   2HB   GLU  11          1HB       GLU  11 -13.111  -6.440  -3.720
   26   1HG   GLU  11          2HG       GLU  11 -11.038  -5.459  -4.533
   27   2HG   GLU  11          1HG       GLU  11 -10.854  -6.784  -5.682
   28    H    LEU  12           H        LEU  12  -9.114  -7.353  -3.414
   29    HA   LEU  12           HA       LEU  12  -8.845  -6.045  -0.866
   30   1HB   LEU  12          2HB       LEU  12  -7.091  -7.494  -1.971
   31   2HB   LEU  12          1HB       LEU  12  -6.816  -6.177  -3.094
   32    HG   LEU  12           HG       LEU  12  -6.449  -5.961  -0.104
   33   1HD1  LEU  12          1HD1      LEU  12  -4.003  -5.891  -0.753
   34   2HD1  LEU  12          2HD1      LEU  12  -4.498  -6.540  -2.317
   35   3HD1  LEU  12          3HD1      LEU  12  -4.792  -7.465  -0.844
   36   1HD2  LEU  12          1HD2      LEU  12  -4.958  -4.000  -1.199
   37   2HD2  LEU  12          2HD2      LEU  12  -6.616  -3.778  -0.643
   38   3HD2  LEU  12          3HD2      LEU  12  -6.289  -4.064  -2.353
   39    H    ILE  13           H        ILE  13  -9.125  -5.081  -4.224
   40    HA   ILE  13           HA       ILE  13  -8.347  -2.379  -3.901
   41    HB   ILE  13           HB       ILE  13 -10.232  -3.526  -5.966
   42   1HG1  ILE  13          2HG1      ILE  13  -8.090  -4.715  -5.956
   43   2HG1  ILE  13          1HG1      ILE  13  -8.234  -3.710  -7.395
   44   1HG2  ILE  13          1HG2      ILE  13  -9.215  -1.572  -7.302
   45   2HG2  ILE  13          2HG2      ILE  13  -8.761  -0.928  -5.724
   46   3HG2  ILE  13          3HG2      ILE  13 -10.459  -1.214  -6.105
   47   1HD1  ILE  13          1HD1      ILE  13  -5.997  -3.648  -6.364
   48   2HD1  ILE  13          2HD1      ILE  13  -6.713  -2.937  -4.918
   49   3HD1  ILE  13          3HD1      ILE  13  -6.766  -2.064  -6.449
   50    H    GLY  14           H        GLY  14  -9.784  -0.492  -4.066
   51   1HA   GLY  14          2HA       GLY  14 -11.699   0.714  -3.564
   52   2HA   GLY  14          1HA       GLY  14 -12.558  -0.803  -3.339
   53    H    LEU  15           H        LEU  15  -9.829  -1.074  -1.547
   54    HA   LEU  15           HA       LEU  15 -11.253  -0.413   0.909
   55   1HB   LEU  15          2HB       LEU  15  -8.626  -1.847   0.529
   56   2HB   LEU  15          1HB       LEU  15  -9.542  -1.733   2.020
   57    HG   LEU  15           HG       LEU  15 -10.486  -3.149  -0.472
   58   1HD1  LEU  15          1HD1      LEU  15  -8.500  -4.148   0.731
   59   2HD1  LEU  15          2HD1      LEU  15  -9.919  -5.185   0.569
   60   3HD1  LEU  15          3HD1      LEU  15  -9.576  -4.392   2.107
   61   1HD2  LEU  15          1HD2      LEU  15 -12.275  -2.234   0.962
   62   2HD2  LEU  15          2HD2      LEU  15 -11.614  -3.143   2.320
   63   3HD2  LEU  15          3HD2      LEU  15 -12.261  -3.998   0.920
   64    H    SER  16           H        SER  16  -9.922   0.512   2.717
   65    HA   SER  16           HA       SER  16  -8.478   2.839   1.716
   66   1HB   SER  16          2HB       SER  16 -10.251   3.225   3.369
   67   2HB   SER  16          1HB       SER  16  -9.431   2.162   4.511
   68    HG   SER  16           HG       SER  16  -9.002   4.413   4.857
   69    H    VAL  17           H        VAL  17  -6.464   3.509   2.722
   70    HA   VAL  17           HA       VAL  17  -4.876   1.233   3.710
   71    HB   VAL  17           HB       VAL  17  -3.868   3.419   1.894
   72   1HG1  VAL  17          1HG1      VAL  17  -2.037   1.525   1.660
   73   2HG1  VAL  17          2HG1      VAL  17  -2.608   1.117   3.278
   74   3HG1  VAL  17          3HG1      VAL  17  -1.971   2.727   2.946
   75   1HG2  VAL  17          1HG2      VAL  17  -3.682   1.463   0.248
   76   2HG2  VAL  17          2HG2      VAL  17  -5.281   2.160   0.518
   77   3HG2  VAL  17          3HG2      VAL  17  -4.835   0.643   1.302
   78    H    ARG  18           H        ARG  18  -3.232   1.712   5.212
   79    HA   ARG  18           HA       ARG  18  -3.194   4.452   6.267
   80   1HB   ARG  18          2HB       ARG  18  -3.465   1.959   7.960
   81   2HB   ARG  18          1HB       ARG  18  -3.309   3.601   8.566
   82   1HG   ARG  18          2HG       ARG  18  -5.593   2.605   6.876
   83   2HG   ARG  18          1HG       ARG  18  -5.619   2.748   8.635
   84   1HD   ARG  18          2HD       ARG  18  -5.206   5.007   6.682
   85   2HD   ARG  18          1HD       ARG  18  -6.693   4.664   7.563
   86    HE   ARG  18           HE       ARG  18  -4.579   4.963   9.391
   87   1HH1  ARG  18          1HH1      ARG  18  -6.532   6.854   7.203
   88   2HH1  ARG  18          2HH1      ARG  18  -6.359   8.316   8.113
   89   1HH2  ARG  18          1HH2      ARG  18  -4.352   6.885  10.592
   90   2HH2  ARG  18          2HH2      ARG  18  -5.122   8.334  10.037
   91    H    ILE  19           H        ILE  19  -1.148   5.120   6.146
   92    HA   ILE  19           HA       ILE  19   1.035   3.193   6.282
   93    HB   ILE  19           HB       ILE  19   1.008   6.140   5.609
   94   1HG1  ILE  19          2HG1      ILE  19   1.616   5.347   3.351
   95   2HG1  ILE  19          1HG1      ILE  19   1.501   3.683   3.913
   96   1HG2  ILE  19          1HG2      ILE  19   3.105   5.574   6.708
   97   2HG2  ILE  19          2HG2      ILE  19   3.364   5.875   4.990
   98   3HG2  ILE  19          3HG2      ILE  19   3.336   4.221   5.600
   99   1HD1  ILE  19          1HD1      ILE  19  -0.485   4.658   2.616
  100   2HD1  ILE  19          2HD1      ILE  19  -0.841   5.552   4.096
  101   3HD1  ILE  19          3HD1      ILE  19  -0.829   3.789   4.114
  102    H    ALA  20           H        ALA  20   2.427   3.013   7.951
  103    HA   ALA  20           HA       ALA  20   2.010   4.799  10.250
  104   1HB   ALA  20          1HB       ALA  20   2.312   3.051  11.683
  105   2HB   ALA  20          2HB       ALA  20   3.391   2.194  10.583
  106   3HB   ALA  20          3HB       ALA  20   1.650   2.179  10.301
  107    H    ARG  21           H        ARG  21   4.374   3.406   8.127
  108    HA   ARG  21           HA       ARG  21   6.290   5.412   8.867
  109   1HB   ARG  21          2HB       ARG  21   6.988   2.488   9.185
  110   2HB   ARG  21          1HB       ARG  21   8.109   3.831   9.347
  111   1HG   ARG  21          2HG       ARG  21   6.845   4.650  11.277
  112   2HG   ARG  21          1HG       ARG  21   5.734   3.287  11.117
  113   1HD   ARG  21          2HD       ARG  21   8.698   3.102  11.655
  114   2HD   ARG  21          1HD       ARG  21   7.416   2.861  12.842
  115    HE   ARG  21           HE       ARG  21   6.989   1.104  10.705
  116   1HH1  ARG  21          1HH1      ARG  21   9.271   1.623  13.296
  117   2HH1  ARG  21          2HH1      ARG  21   9.699  -0.051  13.422
  118   1HH2  ARG  21          1HH2      ARG  21   7.553  -1.097  10.869
  119   2HH2  ARG  21          2HH2      ARG  21   8.725  -1.594  12.043
  120    H    SER  22           H        SER  22   7.640   5.922   7.192
  121    HA   SER  22           HA       SER  22   7.747   4.101   4.902
  122   1HB   SER  22          2HB       SER  22   7.017   7.031   4.693
  123   2HB   SER  22          1HB       SER  22   7.277   5.934   3.337
  124    HG   SER  22           HG       SER  22   5.102   5.982   3.696
  125    H    VAL  23           H        VAL  23   9.397   4.774   3.290
  126    HA   VAL  23           HA       VAL  23  11.888   5.168   4.513
  127    HB   VAL  23           HB       VAL  23  11.668   3.991   2.392
  128   1HG1  VAL  23          1HG1      VAL  23  11.194   5.130   0.315
  129   2HG1  VAL  23          2HG1      VAL  23  11.046   6.672   1.158
  130   3HG1  VAL  23          3HG1      VAL  23   9.867   5.392   1.447
  131   1HG2  VAL  23          1HG2      VAL  23  13.362   5.837   1.165
  132   2HG2  VAL  23          2HG2      VAL  23  13.831   4.503   2.219
  133   3HG2  VAL  23          3HG2      VAL  23  13.569   6.110   2.895
  134    H    HIS  24           H        HIS  24   9.869   7.399   2.618
  135    HA   HIS  24           HA       HIS  24  11.654   9.596   3.405
  136   1HB   HIS  24          2HB       HIS  24   9.574   9.460   1.213
  137   2HB   HIS  24          1HB       HIS  24  10.546  10.878   1.593
  138    HD1  HIS  24           1HD      HIS  24  10.983  10.166  -1.143
  139    HD2  HIS  24           2HD      HIS  24  12.968   8.104   1.869
  140    HE1  HIS  24           1HE      HIS  24  12.979   9.114  -2.253
  141    HE2  HIS  24           2HE      HIS  24  14.127   7.814  -0.426
  142    H    ARG  25           H        ARG  25  10.944  11.281   4.604
  143    HA   ARG  25           HA       ARG  25   8.581  10.947   6.142
  144   1HB   ARG  25          2HB       ARG  25  10.542  13.225   5.900
  145   2HB   ARG  25          1HB       ARG  25   9.162  13.271   6.986
  146   1HG   ARG  25          2HG       ARG  25  11.159  12.633   8.184
  147   2HG   ARG  25          1HG       ARG  25  10.015  11.290   8.148
  148   1HD   ARG  25          2HD       ARG  25  12.319  10.554   7.744
  149   2HD   ARG  25          1HD       ARG  25  11.275  10.234   6.364
  150    HE   ARG  25           HE       ARG  25  12.514  12.717   5.988
  151   1HH1  ARG  25          1HH1      ARG  25  13.341   9.329   6.114
  152   2HH1  ARG  25          2HH1      ARG  25  14.697   9.491   5.049
  153   1HH2  ARG  25          1HH2      ARG  25  14.297  12.932   4.585
  154   2HH2  ARG  25          2HH2      ARG  25  15.240  11.537   4.182
  155    H    ASP  26           H        ASP  26   9.218  12.448   3.129
  156    HA   ASP  26           HA       ASP  26   7.223  14.433   3.141
  157   1HB   ASP  26          2HB       ASP  26   7.410  14.333   0.660
  158   2HB   ASP  26          1HB       ASP  26   8.966  14.482   1.471
  159    H    ILE  27           H        ILE  27   7.005  11.034   2.980
  160    HA   ILE  27           HA       ILE  27   4.156  11.253   2.429
  161    HB   ILE  27           HB       ILE  27   4.276   9.059   1.199
  162   1HG1  ILE  27          2HG1      ILE  27   6.505   8.590   0.104
  163   2HG1  ILE  27          1HG1      ILE  27   7.226   9.737   1.232
  164   1HG2  ILE  27          1HG2      ILE  27   5.610  11.472  -0.021
  165   2HG2  ILE  27          2HG2      ILE  27   3.883  11.124   0.025
  166   3HG2  ILE  27          3HG2      ILE  27   4.959  10.108  -0.932
  167   1HD1  ILE  27          1HD1      ILE  27   5.646   7.374   2.185
  168   2HD1  ILE  27          2HD1      ILE  27   6.816   8.353   3.070
  169   3HD1  ILE  27          3HD1      ILE  27   7.365   7.257   1.802
  170    H    GLN  28           H        GLN  28   6.111  10.706   4.780
  171    HA   GLN  28           HA       GLN  28   5.302   8.091   5.659
  172   1HB   GLN  28          2HB       GLN  28   7.535   8.859   6.210
  173   2HB   GLN  28          1HB       GLN  28   6.882  10.273   7.024
  174   1HG   GLN  28          2HG       GLN  28   5.836   8.812   8.695
  175   2HG   GLN  28          1HG       GLN  28   6.538   7.411   7.889
  176   1HE2  GLN  28          1HE2      GLN  28   8.243   6.664   8.908
  177   2HE2  GLN  28          2HE2      GLN  28   9.426   7.600   9.749
  178    H    GLY  29           H        GLY  29   3.968   7.621   7.415
  179   1HA   GLY  29          2HA       GLY  29   2.176   7.888   8.822
  180   2HA   GLY  29          1HA       GLY  29   2.758   9.523   9.094
  181    H    ILE  30           H        ILE  30   2.087   8.761   5.828
  182    HA   ILE  30           HA       ILE  30  -0.328  10.382   5.967
  183    HB   ILE  30           HB       ILE  30   1.380   9.726   3.568
  184   1HG1  ILE  30          2HG1      ILE  30   2.546  11.185   5.147
  185   2HG1  ILE  30          1HG1      ILE  30   2.088  12.083   3.703
  186   1HG2  ILE  30          1HG2      ILE  30  -0.879  10.109   2.873
  187   2HG2  ILE  30          2HG2      ILE  30   0.067  11.547   2.484
  188   3HG2  ILE  30          3HG2      ILE  30  -1.001  11.545   3.889
  189   1HD1  ILE  30          1HD1      ILE  30   0.639  12.139   6.347
  190   2HD1  ILE  30          2HD1      ILE  30   0.180  13.039   4.901
  191   3HD1  ILE  30          3HD1      ILE  30   1.703  13.398   5.716
  192    H    SER  31           H        SER  31  -2.210   9.354   5.872
  193    HA   SER  31           HA       SER  31  -2.332   6.649   4.783
  194   1HB   SER  31          2HB       SER  31  -4.610   6.618   5.775
  195   2HB   SER  31          1HB       SER  31  -3.364   7.007   6.963
  196    HG   SER  31           HG       SER  31  -4.199   8.928   7.203
  197    H    GLY  32           H        GLY  32  -4.432   6.129   3.527
  198   1HA   GLY  32          2HA       GLY  32  -5.737   8.156   2.063
  199   2HA   GLY  32          1HA       GLY  32  -4.379   7.570   1.118
  200    H    ARG  33           H        ARG  33  -6.286   7.123  -0.313
  201    HA   ARG  33           HA       ARG  33  -7.632   4.624   0.367
  202   1HB   ARG  33          2HB       ARG  33  -8.838   6.752  -0.454
  203   2HB   ARG  33          1HB       ARG  33  -8.284   6.274  -2.044
  204   1HG   ARG  33          2HG       ARG  33 -10.549   5.500  -1.662
  205   2HG   ARG  33          1HG       ARG  33  -9.462   4.124  -1.787
  206   1HD   ARG  33          2HD       ARG  33 -11.051   3.829   0.034
  207   2HD   ARG  33          1HD       ARG  33  -9.405   3.948   0.645
  208    HE   ARG  33           HE       ARG  33 -10.062   5.769   1.835
  209   1HH1  ARG  33          1HH1      ARG  33 -12.260   5.388  -0.851
  210   2HH1  ARG  33          2HH1      ARG  33 -13.240   6.743  -0.400
  211   1HH2  ARG  33          1HH2      ARG  33 -11.354   7.544   2.431
  212   2HH2  ARG  33          2HH2      ARG  33 -12.728   7.965   1.464
  213    H    VAL  34           H        VAL  34  -7.969   3.145  -1.663
  214    HA   VAL  34           HA       VAL  34  -5.266   2.617  -2.670
  215    HB   VAL  34           HB       VAL  34  -6.389   0.870  -1.288
  216   1HG1  VAL  34          1HG1      VAL  34  -8.180  -0.421  -2.148
  217   2HG1  VAL  34          2HG1      VAL  34  -8.113   0.401  -3.706
  218   3HG1  VAL  34          3HG1      VAL  34  -8.663   1.269  -2.273
  219   1HG2  VAL  34          1HG2      VAL  34  -5.663  -0.979  -2.656
  220   2HG2  VAL  34          2HG2      VAL  34  -4.557   0.377  -2.879
  221   3HG2  VAL  34          3HG2      VAL  34  -5.764   0.011  -4.111
  222    H    VAL  35           H        VAL  35  -4.863   1.820  -4.789
  223    HA   VAL  35           HA       VAL  35  -7.039   2.059  -6.711
  224    HB   VAL  35           HB       VAL  35  -5.607   4.214  -6.731
  225   1HG1  VAL  35          1HG1      VAL  35  -3.655   4.165  -8.120
  226   2HG1  VAL  35          2HG1      VAL  35  -3.783   2.413  -8.277
  227   3HG1  VAL  35          3HG1      VAL  35  -3.448   3.138  -6.711
  228   1HG2  VAL  35          1HG2      VAL  35  -7.277   3.318  -8.459
  229   2HG2  VAL  35          2HG2      VAL  35  -5.852   2.849  -9.387
  230   3HG2  VAL  35          3HG2      VAL  35  -6.123   4.544  -8.986
  231    H    ASP  36           H        ASP  36  -3.612   1.221  -6.229
  232    HA   ASP  36           HA       ASP  36  -4.050  -1.413  -7.244
  233   1HB   ASP  36          2HB       ASP  36  -2.549  -1.357  -9.123
  234   2HB   ASP  36          1HB       ASP  36  -3.741  -0.083  -9.348
  235    H    GLU  37           H        GLU  37  -1.942  -2.690  -7.201
  236    HA   GLU  37           HA       GLU  37  -0.100  -1.576  -5.192
  237   1HB   GLU  37          2HB       GLU  37  -1.196  -4.394  -5.244
  238   2HB   GLU  37          1HB       GLU  37   0.022  -3.794  -4.126
  239   1HG   GLU  37          2HG       GLU  37  -1.591  -2.218  -3.203
  240   2HG   GLU  37          1HG       GLU  37  -2.812  -2.804  -4.331
  241    H    THR  38           H        THR  38   2.023  -1.811  -5.640
  242    HA   THR  38           HA       THR  38   2.747  -3.654  -7.823
  243    HB   THR  38           HB       THR  38   4.068  -1.015  -7.170
  244    HG1  THR  38           1HG      THR  38   3.072  -0.329  -9.119
  245   1HG2  THR  38          1HG2      THR  38   5.304  -1.239  -9.160
  246   2HG2  THR  38          2HG2      THR  38   4.376  -2.650  -9.664
  247   3HG2  THR  38          3HG2      THR  38   5.482  -2.765  -8.297
  248    H    ARG  39           H        ARG  39   4.668  -4.802  -7.602
  249    HA   ARG  39           HA       ARG  39   5.347  -5.665  -5.059
  250   1HB   ARG  39          2HB       ARG  39   7.020  -5.790  -7.567
  251   2HB   ARG  39          1HB       ARG  39   7.294  -6.742  -6.114
  252   1HG   ARG  39          2HG       ARG  39   4.874  -6.865  -7.896
  253   2HG   ARG  39          1HG       ARG  39   6.165  -8.060  -7.792
  254   1HD   ARG  39          2HD       ARG  39   5.583  -8.498  -5.463
  255   2HD   ARG  39          1HD       ARG  39   4.309  -7.283  -5.546
  256    HE   ARG  39           HE       ARG  39   4.129  -9.973  -6.396
  257   1HH1  ARG  39          1HH1      ARG  39   3.081  -6.753  -7.247
  258   2HH1  ARG  39          2HH1      ARG  39   1.692  -7.303  -8.121
  259   1HH2  ARG  39          1HH2      ARG  39   2.298 -10.695  -7.541
  260   2HH2  ARG  39          2HH2      ARG  39   1.245  -9.538  -8.285
  261    H    ASN  40           H        ASN  40   6.293  -2.739  -6.541
  262    HA   ASN  40           HA       ASN  40   8.270  -2.380  -4.414
  263   1HB   ASN  40          2HB       ASN  40   9.787  -1.195  -5.926
  264   2HB   ASN  40          1HB       ASN  40   9.545  -2.864  -6.413
  265   1HD2  ASN  40          1HD2      ASN  40   6.775  -1.214  -7.267
  266   2HD2  ASN  40          2HD2      ASN  40   7.196  -0.823  -8.887
  267    H    THR  41           H        THR  41   5.415  -1.270  -5.527
  268    HA   THR  41           HA       THR  41   5.783   1.234  -4.156
  269    HB   THR  41           HB       THR  41   6.582   1.805  -6.422
  270    HG1  THR  41           1HG      THR  41   5.703   3.674  -6.127
  271   1HG2  THR  41          1HG2      THR  41   3.809   1.023  -7.265
  272   2HG2  THR  41          2HG2      THR  41   5.339   0.363  -7.846
  273   3HG2  THR  41          3HG2      THR  41   4.891   2.025  -8.230
  274    H    LEU  42           H        LEU  42   3.787   2.430  -3.878
  275    HA   LEU  42           HA       LEU  42   1.419   0.690  -4.069
  276   1HB   LEU  42          2HB       LEU  42   2.326   2.605  -1.960
  277   2HB   LEU  42          1HB       LEU  42   0.609   2.347  -2.193
  278    HG   LEU  42           HG       LEU  42   2.663   0.299  -1.381
  279   1HD1  LEU  42          1HD1      LEU  42   2.123   1.317   0.581
  280   2HD1  LEU  42          2HD1      LEU  42   0.775   0.185   0.489
  281   3HD1  LEU  42          3HD1      LEU  42   0.552   1.860  -0.007
  282   1HD2  LEU  42          1HD2      LEU  42   1.183  -0.846  -2.850
  283   2HD2  LEU  42          2HD2      LEU  42  -0.227  -0.040  -2.160
  284   3HD2  LEU  42          3HD2      LEU  42   0.665  -1.227  -1.208
  285    H    ARG  43           H        ARG  43  -0.515   1.579  -4.764
  286    HA   ARG  43           HA       ARG  43  -0.350   4.345  -5.738
  287   1HB   ARG  43          2HB       ARG  43  -0.242   2.338  -7.440
  288   2HB   ARG  43          1HB       ARG  43  -1.976   2.292  -7.186
  289   1HG   ARG  43          2HG       ARG  43  -1.792   3.664  -9.030
  290   2HG   ARG  43          1HG       ARG  43  -1.846   4.839  -7.714
  291   1HD   ARG  43          2HD       ARG  43   0.604   4.952  -7.729
  292   2HD   ARG  43          1HD       ARG  43   0.640   3.796  -9.062
  293    HE   ARG  43           HE       ARG  43  -0.973   5.960  -9.806
  294   1HH1  ARG  43          1HH1      ARG  43   2.380   5.260  -9.136
  295   2HH1  ARG  43          2HH1      ARG  43   2.978   6.494 -10.194
  296   1HH2  ARG  43          1HH2      ARG  43  -0.189   7.581 -11.198
  297   2HH2  ARG  43          2HH2      ARG  43   1.519   7.812 -11.364
  298    H    ILE  44           H        ILE  44  -1.829   5.574  -4.834
  299    HA   ILE  44           HA       ILE  44  -4.053   4.344  -3.385
  300    HB   ILE  44           HB       ILE  44  -2.629   6.980  -3.133
  301   1HG1  ILE  44          2HG1      ILE  44  -3.044   4.675  -1.225
  302   2HG1  ILE  44          1HG1      ILE  44  -1.562   5.046  -2.100
  303   1HG2  ILE  44          1HG2      ILE  44  -4.330   7.995  -2.175
  304   2HG2  ILE  44          2HG2      ILE  44  -4.504   6.679  -1.018
  305   3HG2  ILE  44          3HG2      ILE  44  -5.361   6.617  -2.555
  306   1HD1  ILE  44          1HD1      ILE  44  -2.750   6.368   0.271
  307   2HD1  ILE  44          2HD1      ILE  44  -1.814   7.352  -0.853
  308   3HD1  ILE  44          3HD1      ILE  44  -1.072   5.954  -0.076
  309    H    GLU  45           H        GLU  45  -6.104   4.513  -4.066
  310    HA   GLU  45           HA       GLU  45  -6.846   6.922  -5.539
  311   1HB   GLU  45          2HB       GLU  45  -6.799   5.370  -7.312
  312   2HB   GLU  45          1HB       GLU  45  -7.553   4.104  -6.352
  313   1HG   GLU  45          2HG       GLU  45  -9.642   5.377  -6.346
  314   2HG   GLU  45          1HG       GLU  45  -8.871   6.636  -7.310
  315    H    MET  46           H        MET  46  -8.703   7.776  -5.019
  316    HA   MET  46           HA       MET  46 -10.184   6.640  -2.762
  317   1HB   MET  46          2HB       MET  46  -9.681   9.466  -3.657
  318   2HB   MET  46          1HB       MET  46 -10.920   9.071  -2.477
  319   1HG   MET  46          2HG       MET  46  -9.382   8.430  -0.879
  320   2HG   MET  46          1HG       MET  46  -8.106   8.161  -2.064
  321   1HE   MET  46          1HE       MET  46  -6.919   9.641  -3.238
  322   2HE   MET  46          2HE       MET  46  -6.079  10.840  -2.254
  323   3HE   MET  46          3HE       MET  46  -7.287  11.356  -3.427
  324    H    ASP  47           H        ASP  47 -12.292   6.189  -2.947
  325    HA   ASP  47           HA       ASP  47 -13.593   5.819  -5.308
  326   1HB   ASP  47          2HB       ASP  47 -14.388   4.926  -3.167
  327   2HB   ASP  47          1HB       ASP  47 -14.876   6.542  -2.669
  328    H    ASP  48           H        ASP  48 -13.235   8.798  -3.586
  329    HA   ASP  48           HA       ASP  48 -15.313  10.275  -4.768
  330   1HB   ASP  48          2HB       ASP  48 -12.631  11.236  -3.753
  331   2HB   ASP  48          1HB       ASP  48 -14.015  12.268  -4.102
  332    H    GLY  49           H        GLY  49 -12.514   8.977  -6.157
  333   1HA   GLY  49          2HA       GLY  49 -12.209   9.009  -8.519
  334   2HA   GLY  49          1HA       GLY  49 -12.943  10.605  -8.561
  335    H    ARG  50           H        ARG  50 -10.613   9.881  -6.117
  336    HA   ARG  50           HA       ARG  50  -8.714  11.688  -7.455
  337   1HB   ARG  50          2HB       ARG  50  -8.888  10.923  -4.538
  338   2HB   ARG  50          1HB       ARG  50  -7.761  12.079  -5.233
  339   1HG   ARG  50          2HG       ARG  50  -9.621  13.519  -5.870
  340   2HG   ARG  50          1HG       ARG  50 -10.761  12.355  -5.193
  341   1HD   ARG  50          2HD       ARG  50 -10.373  14.170  -3.626
  342   2HD   ARG  50          1HD       ARG  50  -9.744  12.653  -2.984
  343    HE   ARG  50           HE       ARG  50  -7.691  13.627  -2.914
  344   1HH1  ARG  50          1HH1      ARG  50  -9.612  15.343  -5.272
  345   2HH1  ARG  50          2HH1      ARG  50  -8.364  16.484  -5.640
  346   1HH2  ARG  50          1HH2      ARG  50  -6.054  15.132  -3.394
  347   2HH2  ARG  50          2HH2      ARG  50  -6.345  16.368  -4.573
  348    H    GLU  51           H        GLU  51  -6.382  11.220  -7.147
  349    HA   GLU  51           HA       GLU  51  -5.705   8.466  -6.548
  350   1HB   GLU  51          2HB       GLU  51  -5.269   9.638  -9.298
  351   2HB   GLU  51          1HB       GLU  51  -4.596   8.113  -8.739
  352   1HG   GLU  51          2HG       GLU  51  -6.856   7.227  -8.443
  353   2HG   GLU  51          1HG       GLU  51  -7.525   8.756  -9.011
  354    H    ILE  52           H        ILE  52  -3.612   8.177  -5.962
  355    HA   ILE  52           HA       ILE  52  -1.553  10.119  -6.490
  356    HB   ILE  52           HB       ILE  52  -2.707  11.195  -4.613
  357   1HG1  ILE  52          2HG1      ILE  52  -0.761  11.423  -3.107
  358   2HG1  ILE  52          1HG1      ILE  52  -0.032  10.000  -3.849
  359   1HG2  ILE  52          1HG2      ILE  52  -1.906   9.081  -2.704
  360   2HG2  ILE  52          2HG2      ILE  52  -3.318   8.764  -3.712
  361   3HG2  ILE  52          3HG2      ILE  52  -3.280  10.184  -2.666
  362   1HD1  ILE  52          1HD1      ILE  52  -0.643  12.608  -5.244
  363   2HD1  ILE  52          2HD1      ILE  52   0.068  11.182  -6.000
  364   3HD1  ILE  52          3HD1      ILE  52   0.953  12.045  -4.739
  365    H    THR  53           H        THR  53   0.505   9.244  -6.218
  366    HA   THR  53           HA       THR  53   0.564   6.384  -5.618
  367    HB   THR  53           HB       THR  53   1.507   7.085  -7.742
  368    HG1  THR  53           1HG      THR  53   3.562   6.315  -5.949
  369   1HG2  THR  53          1HG2      THR  53   2.502   9.278  -6.386
  370   2HG2  THR  53          2HG2      THR  53   2.833   8.824  -8.058
  371   3HG2  THR  53          3HG2      THR  53   3.926   8.312  -6.772
  372    H    VAL  54           H        VAL  54   2.220   5.437  -4.301
  373    HA   VAL  54           HA       VAL  54   3.682   7.204  -2.494
  374    HB   VAL  54           HB       VAL  54   1.805   5.068  -1.462
  375   1HG1  VAL  54          1HG1      VAL  54   3.449   7.057   0.099
  376   2HG1  VAL  54          2HG1      VAL  54   3.921   5.380  -0.174
  377   3HG1  VAL  54          3HG1      VAL  54   2.459   5.747   0.742
  378   1HG2  VAL  54          1HG2      VAL  54   0.528   6.973  -2.187
  379   2HG2  VAL  54          2HG2      VAL  54   1.624   8.078  -1.359
  380   3HG2  VAL  54          3HG2      VAL  54   0.603   6.986  -0.425
  381    HA   PRO  55           HA       PRO  55   6.613   3.888  -3.067
  382   1HB   PRO  55          2HB       PRO  55   8.571   4.757  -1.466
  383   2HB   PRO  55          1HB       PRO  55   8.138   5.629  -2.942
  384   1HG   PRO  55          2HG       PRO  55   7.385   6.218  -0.106
  385   2HG   PRO  55          1HG       PRO  55   7.914   7.334  -1.377
  386   1HD   PRO  55          2HD       PRO  55   5.289   6.932  -0.677
  387   2HD   PRO  55          1HD       PRO  55   5.815   7.490  -2.276
  388    H    LYS  56           H        LYS  56   6.171   1.917  -2.258
  389    HA   LYS  56           HA       LYS  56   5.918   1.576   0.641
  390   1HB   LYS  56          2HB       LYS  56   4.850  -0.534   0.184
  391   2HB   LYS  56          1HB       LYS  56   4.090   0.726  -0.773
  392   1HG   LYS  56          2HG       LYS  56   5.192  -0.011  -2.752
  393   2HG   LYS  56          1HG       LYS  56   6.200  -1.132  -1.839
  394   1HD   LYS  56          2HD       LYS  56   3.202  -1.298  -2.153
  395   2HD   LYS  56          1HD       LYS  56   4.387  -2.298  -2.990
  396   1HE   LYS  56          2HE       LYS  56   5.159  -3.159  -0.813
  397   2HE   LYS  56          1HE       LYS  56   3.915  -2.201  -0.012
  398   1HZ   LYS  56          1HZ       LYS  56   2.984  -3.947  -2.133
  399   2HZ   LYS  56          2HZ       LYS  56   2.306  -3.627  -0.618
  400   3HZ   LYS  56          3HZ       LYS  56   3.579  -4.732  -0.757
  401    H    GLY  57           H        GLY  57   8.351   1.320  -1.594
  402   1HA   GLY  57          2HA       GLY  57   9.519  -1.143  -1.300
  403   2HA   GLY  57          1HA       GLY  57  10.441   0.345  -1.440
  404    H    ILE  58           H        ILE  58   9.262   1.328   1.125
  405    HA   ILE  58           HA       ILE  58  10.228  -0.509   3.108
  406    HB   ILE  58           HB       ILE  58  11.518   2.211   2.927
  407   1HG1  ILE  58          2HG1      ILE  58  13.637   0.776   2.538
  408   2HG1  ILE  58          1HG1      ILE  58  12.517  -0.496   2.063
  409   1HG2  ILE  58          1HG2      ILE  58  12.757   1.647   4.821
  410   2HG2  ILE  58          2HG2      ILE  58  12.388  -0.071   4.665
  411   3HG2  ILE  58          3HG2      ILE  58  11.134   1.056   5.180
  412   1HD1  ILE  58          1HD1      ILE  58  13.489   1.728   0.555
  413   2HD1  ILE  58          2HD1      ILE  58  11.730   1.789   0.653
  414   3HD1  ILE  58          3HD1      ILE  58  12.527   0.349   0.023
  415    H    ALA  59           H        ALA  59   7.736  -0.019   3.078
  416    HA   ALA  59           HA       ALA  59   7.314   1.885   5.231
  417   1HB   ALA  59          1HB       ALA  59   6.984   3.126   3.111
  418   2HB   ALA  59          2HB       ALA  59   5.562   3.097   4.153
  419   3HB   ALA  59          3HB       ALA  59   5.642   2.043   2.740
  420    H    VAL  60           H        VAL  60   6.230   0.880   6.790
  421    HA   VAL  60           HA       VAL  60   4.577  -1.425   6.224
  422    HB   VAL  60           HB       VAL  60   5.944  -1.380   8.271
  423   1HG1  VAL  60          1HG1      VAL  60   5.392   0.075  10.125
  424   2HG1  VAL  60          2HG1      VAL  60   4.095   0.819   9.191
  425   3HG1  VAL  60          3HG1      VAL  60   5.775   1.044   8.703
  426   1HG2  VAL  60          1HG2      VAL  60   4.223  -2.147   9.823
  427   2HG2  VAL  60          2HG2      VAL  60   3.917  -2.750   8.196
  428   3HG2  VAL  60          3HG2      VAL  60   2.976  -1.398   8.824
  429    H    PHE  61           H        PHE  61   2.363  -1.516   6.237
  430    HA   PHE  61           HA       PHE  61   0.812   0.732   7.180
  431   1HB   PHE  61          2HB       PHE  61  -0.322   1.013   4.940
  432   2HB   PHE  61          1HB       PHE  61   1.333   1.610   5.029
  433    HD1  PHE  61           1HD      PHE  61   2.850   0.984   3.419
  434    HD2  PHE  61           2HD      PHE  61  -0.600  -1.420   4.061
  435    HE1  PHE  61           1HE      PHE  61   3.466  -0.407   1.490
  436    HE2  PHE  61           2HE      PHE  61   0.010  -2.818   2.131
  437    HZ   PHE  61           HZ       PHE  61   2.047  -2.314   0.843
  438    H    HIS  62           H        HIS  62  -1.568   0.357   6.789
  439    HA   HIS  62           HA       HIS  62  -2.212  -2.505   6.649
  440   1HB   HIS  62          2HB       HIS  62  -3.336  -0.630   8.738
  441   2HB   HIS  62          1HB       HIS  62  -3.605  -2.366   8.614
  442    HD1  HIS  62           1HD      HIS  62  -1.001  -3.643   8.604
  443    HD2  HIS  62           2HD      HIS  62  -1.622  -0.141  10.747
  444    HE1  HIS  62           1HE      HIS  62   0.812  -3.593  10.344
  445    HE2  HIS  62           2HE      HIS  62   0.469  -1.421  11.573
  446    H    PHE  63           H        PHE  63  -3.933  -2.933   5.397
  447    HA   PHE  63           HA       PHE  63  -5.463  -0.678   4.341
  448   1HB   PHE  63          2HB       PHE  63  -5.094  -3.533   3.469
  449   2HB   PHE  63          1HB       PHE  63  -6.414  -2.561   2.832
  450    HD1  PHE  63           1HD      PHE  63  -2.938  -1.494   3.613
  451    HD2  PHE  63           2HD      PHE  63  -5.845  -2.283   0.605
  452    HE1  PHE  63           1HE      PHE  63  -1.429  -0.558   1.908
  453    HE2  PHE  63           2HE      PHE  63  -4.340  -1.350  -1.101
  454    HZ   PHE  63           HZ       PHE  63  -2.128  -0.486  -0.450
  455    H    ARG  64           H        ARG  64  -7.335  -0.158   5.252
  456    HA   ARG  64           HA       ARG  64  -8.727  -2.118   6.907
  457   1HB   ARG  64          2HB       ARG  64  -8.321   0.160   7.796
  458   2HB   ARG  64          1HB       ARG  64  -9.286   0.827   6.491
  459   1HG   ARG  64          2HG       ARG  64 -10.656   0.768   8.418
  460   2HG   ARG  64          1HG       ARG  64 -11.217  -0.506   7.337
  461   1HD   ARG  64          2HD       ARG  64 -11.208  -1.487   9.466
  462   2HD   ARG  64          1HD       ARG  64  -9.742  -2.082   8.692
  463    HE   ARG  64           HE       ARG  64  -9.925  -0.318  10.975
  464   1HH1  ARG  64          1HH1      ARG  64  -7.856  -1.642   8.494
  465   2HH1  ARG  64          2HH1      ARG  64  -6.396  -1.158   9.283
  466   1HH2  ARG  64          1HH2      ARG  64  -8.008   0.308  12.013
  467   2HH2  ARG  64          2HH2      ARG  64  -6.481  -0.056  11.281
  468    H    THR  65           H        THR  65 -10.874  -2.722   6.596
  469    HA   THR  65           HA       THR  65 -11.990  -2.080   3.946
  470    HB   THR  65           HB       THR  65 -12.229  -4.682   5.460
  471    HG1  THR  65           1HG      THR  65 -10.251  -4.736   4.606
  472   1HG2  THR  65          1HG2      THR  65 -12.839  -4.969   2.719
  473   2HG2  THR  65          2HG2      THR  65 -13.816  -3.645   3.356
  474   3HG2  THR  65          3HG2      THR  65 -13.884  -5.237   4.115
  475    HA   PRO  66           HA       PRO  66 -15.357  -0.205   6.220
  476   1HB   PRO  66          2HB       PRO  66 -16.812  -1.090   3.764
  477   2HB   PRO  66          1HB       PRO  66 -16.837   0.477   4.581
  478   1HG   PRO  66          2HG       PRO  66 -15.436   0.144   2.345
  479   2HG   PRO  66          1HG       PRO  66 -14.804   1.131   3.676
  480   1HD   PRO  66          2HD       PRO  66 -14.012  -1.602   2.800
  481   2HD   PRO  66          1HD       PRO  66 -13.027  -0.317   3.527
  482    H    GLN  67           H        GLN  67 -15.628  -3.344   4.620
  483    HA   GLN  67           HA       GLN  67 -17.992  -4.206   5.874
  484   1HB   GLN  67          2HB       GLN  67 -15.666  -5.841   4.849
  485   2HB   GLN  67          1HB       GLN  67 -17.249  -6.485   5.265
  486   1HG   GLN  67          2HG       GLN  67 -18.263  -5.116   3.512
  487   2HG   GLN  67          1HG       GLN  67 -16.672  -4.483   3.091
  488   1HE2  GLN  67          1HE2      GLN  67 -15.832  -5.397   1.373
  489   2HE2  GLN  67          2HE2      GLN  67 -16.056  -7.034   0.867
  490    H    GLY  68           H        GLY  68 -14.868  -3.715   7.133
  491   1HA   GLY  68          2HA       GLY  68 -14.533  -3.728   9.504
  492   2HA   GLY  68          1HA       GLY  68 -15.676  -5.056   9.619
  493    H    GLU  69           H        GLU  69 -12.836  -4.610   7.519
  494    HA   GLU  69           HA       GLU  69 -11.678  -7.018   8.774
  495   1HB   GLU  69          2HB       GLU  69 -11.475  -6.266   5.854
  496   2HB   GLU  69          1HB       GLU  69 -10.781  -7.690   6.611
  497   1HG   GLU  69          2HG       GLU  69 -13.018  -8.514   7.128
  498   2HG   GLU  69          1HG       GLU  69 -13.720  -7.082   6.378
  499    H    LEU  70           H        LEU  70  -9.362  -7.157   8.762
  500    HA   LEU  70           HA       LEU  70  -8.015  -4.559   8.435
  501   1HB   LEU  70          2HB       LEU  70  -8.381  -4.936  10.794
  502   2HB   LEU  70          1HB       LEU  70  -7.697  -6.545  10.681
  503    HG   LEU  70           HG       LEU  70  -5.495  -5.575  10.161
  504   1HD1  LEU  70          1HD1      LEU  70  -6.780  -2.907  10.729
  505   2HD1  LEU  70          2HD1      LEU  70  -6.377  -3.495   9.115
  506   3HD1  LEU  70          3HD1      LEU  70  -5.097  -3.213  10.297
  507   1HD2  LEU  70          1HD2      LEU  70  -5.029  -4.688  12.382
  508   2HD2  LEU  70          2HD2      LEU  70  -6.107  -6.081  12.481
  509   3HD2  LEU  70          3HD2      LEU  70  -6.754  -4.452  12.664
  510    H    VAL  71           H        VAL  71  -6.421  -4.658   7.005
  511    HA   VAL  71           HA       VAL  71  -5.025  -7.233   6.634
  512    HB   VAL  71           HB       VAL  71  -5.381  -5.047   4.578
  513   1HG1  VAL  71          1HG1      VAL  71  -3.914  -6.123   3.298
  514   2HG1  VAL  71          2HG1      VAL  71  -4.698  -7.675   3.586
  515   3HG1  VAL  71          3HG1      VAL  71  -3.485  -7.076   4.718
  516   1HG2  VAL  71          1HG2      VAL  71  -7.022  -7.394   5.279
  517   2HG2  VAL  71          2HG2      VAL  71  -6.714  -7.150   3.560
  518   3HG2  VAL  71          3HG2      VAL  71  -7.480  -5.876   4.508
  519    H    GLU  72           H        GLU  72  -2.789  -7.233   6.605
  520    HA   GLU  72           HA       GLU  72  -1.471  -4.634   7.021
  521   1HB   GLU  72          2HB       GLU  72  -0.034  -5.659   8.733
  522   2HB   GLU  72          1HB       GLU  72  -1.732  -5.692   9.194
  523   1HG   GLU  72          2HG       GLU  72  -1.871  -8.035   8.520
  524   2HG   GLU  72          1HG       GLU  72  -0.170  -8.003   8.055
  525    H    ILE  73           H        ILE  73   0.374  -4.303   5.952
  526    HA   ILE  73           HA       ILE  73   1.841  -6.573   4.829
  527    HB   ILE  73           HB       ILE  73   1.093  -4.176   3.151
  528   1HG1  ILE  73          2HG1      ILE  73  -0.210  -5.922   1.816
  529   2HG1  ILE  73          1HG1      ILE  73  -0.062  -6.960   3.232
  530   1HG2  ILE  73          1HG2      ILE  73   3.208  -5.081   2.504
  531   2HG2  ILE  73          2HG2      ILE  73   2.010  -5.570   1.305
  532   3HG2  ILE  73          3HG2      ILE  73   2.565  -6.723   2.520
  533   1HD1  ILE  73          1HD1      ILE  73  -1.825  -5.981   4.147
  534   2HD1  ILE  73          2HD1      ILE  73  -1.998  -4.974   2.709
  535   3HD1  ILE  73          3HD1      ILE  73  -1.023  -4.412   4.068
  536    H    ASP  74           H        ASP  74   3.980  -6.316   5.143
  537    HA   ASP  74           HA       ASP  74   4.896  -3.792   6.238
  538   1HB   ASP  74          2HB       ASP  74   5.540  -5.910   7.324
  539   2HB   ASP  74          1HB       ASP  74   6.401  -6.384   5.863
  540    H    GLY  75           H        GLY  75   5.187  -2.304   4.695
  541   1HA   GLY  75          2HA       GLY  75   6.141  -2.721   2.099
  542   2HA   GLY  75          1HA       GLY  75   6.174  -1.192   2.953
  543    H    ARG  76           H        ARG  76   7.848  -2.912   5.028
  544    HA   ARG  76           HA       ARG  76  10.347  -2.011   3.981
  545   1HB   ARG  76          2HB       ARG  76   9.787  -1.693   6.343
  546   2HB   ARG  76          1HB       ARG  76   9.729  -3.437   6.555
  547   1HG   ARG  76          2HG       ARG  76  12.103  -3.590   6.012
  548   2HG   ARG  76          1HG       ARG  76  12.164  -1.843   5.786
  549   1HD   ARG  76          2HD       ARG  76  11.474  -1.541   8.134
  550   2HD   ARG  76          1HD       ARG  76  11.491  -3.292   8.345
  551    HE   ARG  76           HE       ARG  76  13.738  -3.152   8.646
  552   1HH1  ARG  76          1HH1      ARG  76  12.723  -0.344   6.837
  553   2HH1  ARG  76          2HH1      ARG  76  14.311   0.340   6.770
  554   1HH2  ARG  76          1HH2      ARG  76  15.827  -2.247   8.565
  555   2HH2  ARG  76          2HH2      ARG  76  16.072  -0.738   7.750
  556    H    ALA  77           H        ALA  77   9.475  -5.124   5.401
  557    HA   ALA  77           HA       ALA  77  11.494  -6.376   3.737
  558   1HB   ALA  77          1HB       ALA  77  12.007  -7.064   5.827
  559   2HB   ALA  77          2HB       ALA  77  10.891  -8.356   5.380
  560   3HB   ALA  77          3HB       ALA  77  10.329  -7.007   6.370
  561    H    LEU  78           H        LEU  78   8.111  -6.793   4.596
  562    HA   LEU  78           HA       LEU  78   7.596  -9.148   3.246
  563   1HB   LEU  78          2HB       LEU  78   5.925  -6.855   4.087
  564   2HB   LEU  78          1HB       LEU  78   5.233  -7.949   2.909
  565    HG   LEU  78           HG       LEU  78   4.588  -8.517   5.220
  566   1HD1  LEU  78          1HD1      LEU  78   6.345 -10.550   3.853
  567   2HD1  LEU  78          2HD1      LEU  78   4.630 -10.270   3.552
  568   3HD1  LEU  78          3HD1      LEU  78   5.158 -10.906   5.110
  569   1HD2  LEU  78          1HD2      LEU  78   6.192  -8.122   6.749
  570   2HD2  LEU  78          2HD2      LEU  78   7.504  -8.423   5.610
  571   3HD2  LEU  78          3HD2      LEU  78   6.679  -9.776   6.378
  572    H    VAL  79           H        VAL  79   8.285  -6.074   1.883
  573    HA   VAL  79           HA       VAL  79   6.921  -6.280  -0.557
  574    HB   VAL  79           HB       VAL  79   9.606  -4.984  -0.064
  575   1HG1  VAL  79          1HG1      VAL  79   9.630  -4.383  -2.205
  576   2HG1  VAL  79          2HG1      VAL  79   8.001  -3.722  -2.082
  577   3HG1  VAL  79          3HG1      VAL  79   8.234  -5.426  -2.478
  578   1HG2  VAL  79          1HG2      VAL  79   8.300  -2.914   0.187
  579   2HG2  VAL  79          2HG2      VAL  79   7.905  -4.108   1.425
  580   3HG2  VAL  79          3HG2      VAL  79   6.813  -3.854   0.064
  581    H    ALA  80           H        ALA  80   6.985  -8.175  -1.635
  582    HA   ALA  80           HA       ALA  80   9.566  -9.464  -2.119
  583   1HB   ALA  80          1HB       ALA  80   8.291 -11.378  -2.876
  584   2HB   ALA  80          2HB       ALA  80   6.793 -10.454  -2.772
  585   3HB   ALA  80          3HB       ALA  80   7.691 -10.842  -1.306
  586    H    ARG  81           H        ARG  81  10.641  -8.767  -3.843
  587    HA   ARG  81           HA       ARG  81   9.149  -7.862  -6.195
  588   1HB   ARG  81          2HB       ARG  81  11.325  -6.909  -6.929
  589   2HB   ARG  81          1HB       ARG  81  10.760  -6.266  -5.394
  590   1HG   ARG  81          2HG       ARG  81  12.293  -7.796  -4.218
  591   2HG   ARG  81          1HG       ARG  81  12.896  -8.351  -5.781
  592   1HD   ARG  81          2HD       ARG  81  14.374  -6.660  -4.822
  593   2HD   ARG  81          1HD       ARG  81  13.628  -6.080  -6.310
  594    HE   ARG  81           HE       ARG  81  12.046  -5.263  -4.153
  595   1HH1  ARG  81          1HH1      ARG  81  15.204  -4.649  -5.505
  596   2HH1  ARG  81          2HH1      ARG  81  15.278  -3.023  -4.914
  597   1HH2  ARG  81          1HH2      ARG  81  12.143  -3.125  -3.374
  598   2HH2  ARG  81          2HH2      ARG  81  13.541  -2.158  -3.705
  599    HA   PRO  82           HA       PRO  82  10.424 -11.886  -7.838
  600   1HB   PRO  82          2HB       PRO  82   8.466 -12.139  -9.643
  601   2HB   PRO  82          1HB       PRO  82   8.162 -12.370  -7.917
  602   1HG   PRO  82          2HG       PRO  82   7.597  -9.987  -9.637
  603   2HG   PRO  82          1HG       PRO  82   6.585 -10.727  -8.382
  604   1HD   PRO  82          2HD       PRO  82   8.149  -8.498  -7.993
  605   2HD   PRO  82          1HD       PRO  82   7.650  -9.605  -6.699
  606    H    GLU  83           H        GLU  83  11.998  -9.783  -8.599
  607    HA   GLU  83           HA       GLU  83  11.922  -9.837 -11.536
  608   1HB   GLU  83          2HB       GLU  83  13.306  -7.809 -11.475
  609   2HB   GLU  83          1HB       GLU  83  11.782  -7.581 -10.630
  610   1HG   GLU  83          2HG       GLU  83  12.910  -7.897  -8.494
  611   2HG   GLU  83          1HG       GLU  83  14.439  -8.144  -9.335
  612    H    GLU  84           H        GLU  84  13.982 -10.166  -8.733
  613    HA   GLU  84           HA       GLU  84  16.076 -11.359 -10.419
  614   1HB   GLU  84          2HB       GLU  84  16.817  -9.450  -9.075
  615   2HB   GLU  84          1HB       GLU  84  16.255 -10.250  -7.612
  616   1HG   GLU  84          2HG       GLU  84  17.891 -12.028  -7.950
  617   2HG   GLU  84          1HG       GLU  84  18.452 -11.231  -9.420
  618    H    ARG  85           H        ARG  85  14.430 -11.775  -7.294
  619    HA   ARG  85           HA       ARG  85  13.927 -14.499  -7.595
  620   1HB   ARG  85          2HB       ARG  85  16.362 -14.766  -7.476
  621   2HB   ARG  85          1HB       ARG  85  16.388 -13.913  -5.939
  622   1HG   ARG  85          2HG       ARG  85  15.061 -15.692  -4.923
  623   2HG   ARG  85          1HG       ARG  85  15.025 -16.545  -6.467
  624   1HD   ARG  85          2HD       ARG  85  16.727 -17.472  -4.985
  625   2HD   ARG  85          1HD       ARG  85  17.455 -16.750  -6.420
  626    HE   ARG  85           HE       ARG  85  17.403 -14.823  -4.395
  627   1HH1  ARG  85          1HH1      ARG  85  18.963 -17.861  -5.113
  628   2HH1  ARG  85          2HH1      ARG  85  20.387 -17.488  -4.200
  629   1HH2  ARG  85          1HH2      ARG  85  19.275 -14.331  -3.195
  630   2HH2  ARG  85          2HH2      ARG  85  20.564 -15.485  -3.112
  631    H    ILE  86           H        ILE  86  12.882 -15.417  -5.761
  632    HA   ILE  86           HA       ILE  86  12.060 -13.394  -3.789
  633    HB   ILE  86           HB       ILE  86  10.638 -15.930  -4.614
  634   1HG1  ILE  86          2HG1      ILE  86  10.595 -14.244  -6.379
  635   2HG1  ILE  86          1HG1      ILE  86   9.001 -14.394  -5.645
  636   1HG2  ILE  86          1HG2      ILE  86   8.746 -14.570  -3.354
  637   2HG2  ILE  86          2HG2      ILE  86  10.138 -13.916  -2.489
  638   3HG2  ILE  86          3HG2      ILE  86   9.842 -15.654  -2.497
  639   1HD1  ILE  86          1HD1      ILE  86   9.550 -12.074  -6.060
  640   2HD1  ILE  86          2HD1      ILE  86  11.013 -12.228  -5.088
  641   3HD1  ILE  86          3HD1      ILE  86   9.428 -12.380  -4.329
  Start of MODEL   22
    1    H    ARG   9           H        ARG   9 -14.377 -11.045  -1.617
    2    HA   ARG   9           HA       ARG   9 -12.059  -9.967  -0.268
    3   1HB   ARG   9          2HB       ARG   9 -12.417 -12.955  -0.563
    4   2HB   ARG   9          1HB       ARG   9 -10.934 -12.158  -0.057
    5   1HG   ARG   9          2HG       ARG   9 -12.079 -11.287   1.920
    6   2HG   ARG   9          1HG       ARG   9 -13.560 -12.101   1.415
    7   1HD   ARG   9          2HD       ARG   9 -12.387 -13.405   3.107
    8   2HD   ARG   9          1HD       ARG   9 -12.433 -14.262   1.568
    9    HE   ARG   9           HE       ARG   9 -10.162 -14.250   1.584
   10   1HH1  ARG   9          1HH1      ARG   9 -11.260 -11.626   3.610
   11   2HH1  ARG   9          2HH1      ARG   9  -9.661 -11.136   4.054
   12   1HH2  ARG   9          1HH2      ARG   9  -8.059 -13.608   2.174
   13   2HH2  ARG   9          2HH2      ARG   9  -7.844 -12.260   3.241
   14    H    HIS  10           H        HIS  10 -13.410  -9.787  -2.900
   15    HA   HIS  10           HA       HIS  10 -11.246 -10.800  -4.623
   16   1HB   HIS  10          2HB       HIS  10 -14.095 -10.062  -5.322
   17   2HB   HIS  10          1HB       HIS  10 -12.869 -10.529  -6.496
   18    HD1  HIS  10           1HD      HIS  10 -14.226 -12.065  -3.276
   19    HD2  HIS  10           2HD      HIS  10 -13.154 -13.125  -7.147
   20    HE1  HIS  10           1HE      HIS  10 -14.676 -14.533  -3.445
   21    HE2  HIS  10           2HE      HIS  10 -13.953 -15.166  -5.774
   22    H    GLU  11           H        GLU  11 -10.173  -9.432  -5.994
   23    HA   GLU  11           HA       GLU  11  -9.296  -7.487  -6.782
   24   1HB   GLU  11          2HB       GLU  11 -12.081  -6.422  -6.272
   25   2HB   GLU  11          1HB       GLU  11 -10.840  -5.613  -7.220
   26   1HG   GLU  11          2HG       GLU  11 -10.848  -7.464  -8.812
   27   2HG   GLU  11          1HG       GLU  11 -12.094  -8.273  -7.863
   28    H    LEU  12           H        LEU  12  -7.846  -6.347  -5.701
   29    HA   LEU  12           HA       LEU  12  -8.305  -5.607  -2.947
   30   1HB   LEU  12          2HB       LEU  12  -6.145  -6.516  -3.644
   31   2HB   LEU  12          1HB       LEU  12  -5.921  -5.173  -4.748
   32    HG   LEU  12           HG       LEU  12  -5.859  -3.622  -2.826
   33   1HD1  LEU  12          1HD1      LEU  12  -7.018  -5.734  -1.441
   34   2HD1  LEU  12          2HD1      LEU  12  -6.445  -4.210  -0.765
   35   3HD1  LEU  12          3HD1      LEU  12  -5.383  -5.617  -0.791
   36   1HD2  LEU  12          1HD2      LEU  12  -3.858  -5.062  -3.807
   37   2HD2  LEU  12          2HD2      LEU  12  -3.842  -5.694  -2.159
   38   3HD2  LEU  12          3HD2      LEU  12  -3.641  -3.965  -2.442
   39    H    ILE  13           H        ILE  13  -8.365  -4.071  -6.050
   40    HA   ILE  13           HA       ILE  13  -7.979  -1.395  -5.225
   41    HB   ILE  13           HB       ILE  13  -9.544  -2.400  -7.607
   42   1HG1  ILE  13          2HG1      ILE  13  -7.272  -3.297  -7.600
   43   2HG1  ILE  13          1HG1      ILE  13  -7.442  -2.075  -8.856
   44   1HG2  ILE  13          1HG2      ILE  13  -9.374   0.169  -6.625
   45   2HG2  ILE  13          2HG2      ILE  13  -9.786  -0.283  -8.279
   46   3HG2  ILE  13          3HG2      ILE  13  -8.122   0.127  -7.866
   47   1HD1  ILE  13          1HD1      ILE  13  -5.375  -1.643  -7.880
   48   2HD1  ILE  13          2HD1      ILE  13  -5.990  -1.888  -6.246
   49   3HD1  ILE  13          3HD1      ILE  13  -6.454  -0.450  -7.158
   50    H    GLY  14           H        GLY  14  -9.368   0.135  -4.488
   51   1HA   GLY  14          2HA       GLY  14 -11.555   1.079  -4.229
   52   2HA   GLY  14          1HA       GLY  14 -12.227  -0.540  -4.334
   53    H    LEU  15           H        LEU  15  -9.467  -0.421  -2.375
   54    HA   LEU  15           HA       LEU  15 -11.165  -0.407   0.029
   55   1HB   LEU  15          2HB       LEU  15  -8.477  -1.713  -0.409
   56   2HB   LEU  15          1HB       LEU  15  -9.399  -1.762   1.083
   57    HG   LEU  15           HG       LEU  15 -10.230  -2.984  -1.551
   58   1HD1  LEU  15          1HD1      LEU  15  -9.466  -4.974  -0.819
   59   2HD1  LEU  15          2HD1      LEU  15  -9.845  -4.622   0.867
   60   3HD1  LEU  15          3HD1      LEU  15  -8.380  -3.965   0.136
   61   1HD2  LEU  15          1HD2      LEU  15 -11.947  -4.059   0.098
   62   2HD2  LEU  15          2HD2      LEU  15 -12.254  -2.465  -0.591
   63   3HD2  LEU  15          3HD2      LEU  15 -11.635  -2.611   1.054
   64    H    SER  16           H        SER  16 -10.009   0.310   2.047
   65    HA   SER  16           HA       SER  16  -8.621   2.815   1.471
   66   1HB   SER  16          2HB       SER  16  -9.831   1.771   4.044
   67   2HB   SER  16          1HB       SER  16  -9.091   3.359   3.846
   68    HG   SER  16           HG       SER  16 -11.287   3.585   3.569
   69    H    VAL  17           H        VAL  17  -6.755   3.445   2.768
   70    HA   VAL  17           HA       VAL  17  -5.167   1.146   3.703
   71    HB   VAL  17           HB       VAL  17  -4.066   3.478   2.133
   72   1HG1  VAL  17          1HG1      VAL  17  -2.821   0.932   3.150
   73   2HG1  VAL  17          2HG1      VAL  17  -2.415   2.586   3.609
   74   3HG1  VAL  17          3HG1      VAL  17  -2.054   2.007   1.982
   75   1HG2  VAL  17          1HG2      VAL  17  -3.641   1.348   0.545
   76   2HG2  VAL  17          2HG2      VAL  17  -5.044   2.411   0.405
   77   3HG2  VAL  17          3HG2      VAL  17  -5.177   0.885   1.280
   78    H    ARG  18           H        ARG  18  -3.535   1.620   5.248
   79    HA   ARG  18           HA       ARG  18  -3.582   4.251   6.511
   80   1HB   ARG  18          2HB       ARG  18  -5.319   2.721   7.595
   81   2HB   ARG  18          1HB       ARG  18  -3.968   1.747   8.157
   82   1HG   ARG  18          2HG       ARG  18  -4.407   4.653   8.820
   83   2HG   ARG  18          1HG       ARG  18  -4.808   3.293   9.867
   84   1HD   ARG  18          2HD       ARG  18  -2.404   2.634   9.820
   85   2HD   ARG  18          1HD       ARG  18  -2.065   4.112   8.922
   86    HE   ARG  18           HE       ARG  18  -2.422   3.889  11.717
   87   1HH1  ARG  18          1HH1      ARG  18  -3.084   6.007   9.021
   88   2HH1  ARG  18          2HH1      ARG  18  -3.184   7.429  10.005
   89   1HH2  ARG  18          1HH2      ARG  18  -2.548   5.759  13.007
   90   2HH2  ARG  18          2HH2      ARG  18  -2.876   7.289  12.266
   91    H    ILE  19           H        ILE  19  -1.463   4.589   5.960
   92    HA   ILE  19           HA       ILE  19   0.562   2.595   6.353
   93    HB   ILE  19           HB       ILE  19   0.834   5.533   5.714
   94   1HG1  ILE  19          2HG1      ILE  19   0.825   3.074   3.952
   95   2HG1  ILE  19          1HG1      ILE  19  -0.405   4.337   3.998
   96   1HG2  ILE  19          1HG2      ILE  19   3.021   3.983   4.769
   97   2HG2  ILE  19          2HG2      ILE  19   2.802   3.644   6.484
   98   3HG2  ILE  19          3HG2      ILE  19   3.031   5.306   5.936
   99   1HD1  ILE  19          1HD1      ILE  19   2.455   4.683   3.104
  100   2HD1  ILE  19          2HD1      ILE  19   1.236   5.956   3.160
  101   3HD1  ILE  19          3HD1      ILE  19   1.039   4.594   2.054
  102    H    ALA  20           H        ALA  20   1.979   2.352   7.973
  103    HA   ALA  20           HA       ALA  20   1.690   4.120  10.302
  104   1HB   ALA  20          1HB       ALA  20   3.093   1.927  11.184
  105   2HB   ALA  20          2HB       ALA  20   1.980   1.237  10.002
  106   3HB   ALA  20          3HB       ALA  20   1.357   2.176  11.357
  107    H    ARG  21           H        ARG  21   3.887   2.878   7.953
  108    HA   ARG  21           HA       ARG  21   5.909   4.743   8.823
  109   1HB   ARG  21          2HB       ARG  21   6.527   2.672   9.977
  110   2HB   ARG  21          1HB       ARG  21   6.522   1.818   8.442
  111   1HG   ARG  21          2HG       ARG  21   8.361   3.211   7.653
  112   2HG   ARG  21          1HG       ARG  21   8.370   4.068   9.196
  113   1HD   ARG  21          2HD       ARG  21   8.875   1.956  10.348
  114   2HD   ARG  21          1HD       ARG  21   8.895   1.122   8.794
  115    HE   ARG  21           HE       ARG  21  11.032   1.844   8.524
  116   1HH1  ARG  21          1HH1      ARG  21   9.448   3.998  10.770
  117   2HH1  ARG  21          2HH1      ARG  21  10.860   4.966  11.028
  118   1HH2  ARG  21          1HH2      ARG  21  12.890   3.114   8.869
  119   2HH2  ARG  21          2HH2      ARG  21  12.814   4.464   9.951
  120    H    SER  22           H        SER  22   7.217   5.458   7.192
  121    HA   SER  22           HA       SER  22   6.873   4.284   4.532
  122   1HB   SER  22          2HB       SER  22   6.488   7.229   5.118
  123   2HB   SER  22          1HB       SER  22   6.459   6.479   3.522
  124    HG   SER  22           HG       SER  22   4.422   6.172   3.890
  125    H    VAL  23           H        VAL  23   8.424   5.199   2.929
  126    HA   VAL  23           HA       VAL  23  11.046   5.015   3.850
  127    HB   VAL  23           HB       VAL  23  10.151   6.317   1.318
  128   1HG1  VAL  23          1HG1      VAL  23  12.292   6.500   0.713
  129   2HG1  VAL  23          2HG1      VAL  23  12.652   4.857   1.242
  130   3HG1  VAL  23          3HG1      VAL  23  12.686   6.185   2.403
  131   1HG2  VAL  23          1HG2      VAL  23   9.349   3.916   1.817
  132   2HG2  VAL  23          2HG2      VAL  23  11.030   3.471   1.528
  133   3HG2  VAL  23          3HG2      VAL  23  10.098   4.251   0.256
  134    H    HIS  24           H        HIS  24   9.371   7.914   2.639
  135    HA   HIS  24           HA       HIS  24  11.378   9.565   4.002
  136   1HB   HIS  24          2HB       HIS  24  10.629   9.775   1.470
  137   2HB   HIS  24          1HB       HIS  24   9.323  10.727   2.169
  138    HD1  HIS  24           1HD      HIS  24  10.642  12.464   4.179
  139    HD2  HIS  24           2HD      HIS  24  12.471  11.515   0.574
  140    HE1  HIS  24           1HE      HIS  24  12.324  14.286   3.781
  141    HE2  HIS  24           2HE      HIS  24  13.359  13.739   1.551
  142    H    ARG  25           H        ARG  25  10.850  10.963   5.607
  143    HA   ARG  25           HA       ARG  25   8.666  10.527   7.231
  144   1HB   ARG  25          2HB       ARG  25  10.264  13.074   6.955
  145   2HB   ARG  25          1HB       ARG  25   9.235  12.661   8.321
  146   1HG   ARG  25          2HG       ARG  25  10.659  10.787   8.872
  147   2HG   ARG  25          1HG       ARG  25  11.659  11.100   7.452
  148   1HD   ARG  25          2HD       ARG  25  11.265  12.981   9.778
  149   2HD   ARG  25          1HD       ARG  25  12.681  11.967   9.508
  150    HE   ARG  25           HE       ARG  25  12.270  13.549   7.234
  151   1HH1  ARG  25          1HH1      ARG  25  13.205  13.897  10.578
  152   2HH1  ARG  25          2HH1      ARG  25  14.170  15.305  10.292
  153   1HH2  ARG  25          1HH2      ARG  25  13.540  15.400   6.855
  154   2HH2  ARG  25          2HH2      ARG  25  14.360  16.159   8.179
  155    H    ASP  26           H        ASP  26   8.836  12.428   4.363
  156    HA   ASP  26           HA       ASP  26   6.570  14.066   4.888
  157   1HB   ASP  26          2HB       ASP  26   7.942  13.401   2.279
  158   2HB   ASP  26          1HB       ASP  26   6.724  14.655   2.490
  159    H    ILE  27           H        ILE  27   6.884  10.810   4.073
  160    HA   ILE  27           HA       ILE  27   4.131  10.732   3.103
  161    HB   ILE  27           HB       ILE  27   4.804   8.542   1.995
  162   1HG1  ILE  27          2HG1      ILE  27   7.554   9.732   2.414
  163   2HG1  ILE  27          1HG1      ILE  27   6.945   8.267   3.172
  164   1HG2  ILE  27          1HG2      ILE  27   4.312  10.306   0.556
  165   2HG2  ILE  27          2HG2      ILE  27   5.930   9.809   0.065
  166   3HG2  ILE  27          3HG2      ILE  27   5.715  11.243   1.069
  167   1HD1  ILE  27          1HD1      ILE  27   6.799   8.286   0.244
  168   2HD1  ILE  27          2HD1      ILE  27   7.335   7.019   1.350
  169   3HD1  ILE  27          3HD1      ILE  27   8.431   8.330   0.912
  170    H    GLN  28           H        GLN  28   5.895  10.135   5.749
  171    HA   GLN  28           HA       GLN  28   4.850   7.529   6.406
  172   1HB   GLN  28          2HB       GLN  28   7.094   8.046   7.134
  173   2HB   GLN  28          1HB       GLN  28   6.533   9.488   7.969
  174   1HG   GLN  28          2HG       GLN  28   5.256   8.085   9.516
  175   2HG   GLN  28          1HG       GLN  28   5.848   6.649   8.689
  176   1HE2  GLN  28          1HE2      GLN  28   7.396   5.681   9.767
  177   2HE2  GLN  28          2HE2      GLN  28   8.626   6.447  10.706
  178    H    GLY  29           H        GLY  29   3.498   7.094   8.206
  179   1HA   GLY  29          2HA       GLY  29   1.681   7.427   9.562
  180   2HA   GLY  29          1HA       GLY  29   2.308   9.042   9.837
  181    H    ILE  30           H        ILE  30   1.635   8.233   6.565
  182    HA   ILE  30           HA       ILE  30  -0.701   9.970   6.666
  183    HB   ILE  30           HB       ILE  30   0.949   9.192   4.267
  184   1HG1  ILE  30          2HG1      ILE  30   0.919  11.721   5.928
  185   2HG1  ILE  30          1HG1      ILE  30   2.246  10.570   5.790
  186   1HG2  ILE  30          1HG2      ILE  30  -0.571  10.181   2.976
  187   2HG2  ILE  30          2HG2      ILE  30  -0.639  11.596   4.026
  188   3HG2  ILE  30          3HG2      ILE  30  -1.644  10.191   4.377
  189   1HD1  ILE  30          1HD1      ILE  30   2.873  12.330   4.402
  190   2HD1  ILE  30          2HD1      ILE  30   1.242  12.530   3.760
  191   3HD1  ILE  30          3HD1      ILE  30   2.209  11.135   3.287
  192    H    SER  31           H        SER  31  -2.673   9.236   6.231
  193    HA   SER  31           HA       SER  31  -2.947   6.457   5.328
  194   1HB   SER  31          2HB       SER  31  -5.249   6.604   6.218
  195   2HB   SER  31          1HB       SER  31  -4.052   6.990   7.453
  196    HG   SER  31           HG       SER  31  -5.196   8.738   7.683
  197    H    GLY  32           H        GLY  32  -4.708   5.966   3.787
  198   1HA   GLY  32          2HA       GLY  32  -5.936   8.046   2.286
  199   2HA   GLY  32          1HA       GLY  32  -4.508   7.456   1.454
  200    H    ARG  33           H        ARG  33  -6.026   6.898  -0.218
  201    HA   ARG  33           HA       ARG  33  -7.372   4.362   0.324
  202   1HB   ARG  33          2HB       ARG  33  -8.269   6.581  -1.460
  203   2HB   ARG  33          1HB       ARG  33  -8.871   4.938  -1.641
  204   1HG   ARG  33          2HG       ARG  33  -9.412   5.035   0.832
  205   2HG   ARG  33          1HG       ARG  33  -9.185   6.779   0.697
  206   1HD   ARG  33          2HD       ARG  33 -11.539   6.163   0.493
  207   2HD   ARG  33          1HD       ARG  33 -10.941   6.875  -0.999
  208    HE   ARG  33           HE       ARG  33 -10.644   4.141  -1.267
  209   1HH1  ARG  33          1HH1      ARG  33 -13.275   6.377  -0.767
  210   2HH1  ARG  33          2HH1      ARG  33 -14.433   5.397  -1.603
  211   1HH2  ARG  33          1HH2      ARG  33 -12.162   2.854  -2.373
  212   2HH2  ARG  33          2HH2      ARG  33 -13.798   3.398  -2.520
  213    H    VAL  34           H        VAL  34  -7.796   3.162  -1.836
  214    HA   VAL  34           HA       VAL  34  -5.098   2.706  -2.888
  215    HB   VAL  34           HB       VAL  34  -7.501   0.892  -3.052
  216   1HG1  VAL  34          1HG1      VAL  34  -4.604   0.527  -3.763
  217   2HG1  VAL  34          2HG1      VAL  34  -6.023   0.284  -4.780
  218   3HG1  VAL  34          3HG1      VAL  34  -5.683  -0.834  -3.459
  219   1HG2  VAL  34          1HG2      VAL  34  -6.754  -0.232  -1.158
  220   2HG2  VAL  34          2HG2      VAL  34  -6.534   1.466  -0.738
  221   3HG2  VAL  34          3HG2      VAL  34  -5.149   0.495  -1.241
  222    H    VAL  35           H        VAL  35  -4.647   2.270  -5.055
  223    HA   VAL  35           HA       VAL  35  -6.729   2.855  -7.007
  224    HB   VAL  35           HB       VAL  35  -5.427   4.971  -6.639
  225   1HG1  VAL  35          1HG1      VAL  35  -3.227   3.791  -8.220
  226   2HG1  VAL  35          2HG1      VAL  35  -3.247   3.654  -6.469
  227   3HG1  VAL  35          3HG1      VAL  35  -3.251   5.241  -7.219
  228   1HG2  VAL  35          1HG2      VAL  35  -5.868   5.579  -8.760
  229   2HG2  VAL  35          2HG2      VAL  35  -6.519   3.945  -8.888
  230   3HG2  VAL  35          3HG2      VAL  35  -4.878   4.286  -9.437
  231    H    ASP  36           H        ASP  36  -3.357   1.822  -6.497
  232    HA   ASP  36           HA       ASP  36  -3.785  -0.523  -8.084
  233   1HB   ASP  36          2HB       ASP  36  -3.274   1.272  -9.780
  234   2HB   ASP  36          1HB       ASP  36  -1.692   1.442  -9.028
  235    H    GLU  37           H        GLU  37  -1.833  -1.942  -8.068
  236    HA   GLU  37           HA       GLU  37  -0.022  -1.306  -5.836
  237   1HB   GLU  37          2HB       GLU  37  -1.346  -3.971  -6.370
  238   2HB   GLU  37          1HB       GLU  37  -0.107  -3.689  -5.157
  239   1HG   GLU  37          2HG       GLU  37  -2.242  -3.730  -4.090
  240   2HG   GLU  37          1HG       GLU  37  -1.617  -2.082  -4.043
  241    H    THR  38           H        THR  38   2.094  -1.584  -6.275
  242    HA   THR  38           HA       THR  38   2.797  -3.177  -8.653
  243    HB   THR  38           HB       THR  38   4.189  -0.683  -7.658
  244    HG1  THR  38           1HG      THR  38   2.739   0.315  -8.772
  245   1HG2  THR  38          1HG2      THR  38   5.523  -2.453  -8.968
  246   2HG2  THR  38          2HG2      THR  38   5.596  -0.768  -9.485
  247   3HG2  THR  38          3HG2      THR  38   4.570  -1.913 -10.350
  248    H    ARG  39           H        ARG  39   4.739  -4.364  -8.554
  249    HA   ARG  39           HA       ARG  39   5.294  -5.604  -6.132
  250   1HB   ARG  39          2HB       ARG  39   6.799  -5.459  -8.722
  251   2HB   ARG  39          1HB       ARG  39   7.436  -6.353  -7.349
  252   1HG   ARG  39          2HG       ARG  39   5.504  -7.779  -7.315
  253   2HG   ARG  39          1HG       ARG  39   4.740  -6.828  -8.592
  254   1HD   ARG  39          2HD       ARG  39   7.319  -8.370  -8.862
  255   2HD   ARG  39          1HD       ARG  39   5.745  -8.914  -9.441
  256    HE   ARG  39           HE       ARG  39   7.498  -7.128 -10.756
  257   1HH1  ARG  39          1HH1      ARG  39   4.106  -7.711 -10.172
  258   2HH1  ARG  39          2HH1      ARG  39   3.589  -6.874 -11.595
  259   1HH2  ARG  39          1HH2      ARG  39   6.820  -6.034 -12.632
  260   2HH2  ARG  39          2HH2      ARG  39   5.129  -5.924 -12.995
  261    H    ASN  40           H        ASN  40   6.421  -2.558  -7.233
  262    HA   ASN  40           HA       ASN  40   8.255  -2.504  -4.949
  263   1HB   ASN  40          2HB       ASN  40   9.902  -1.208  -6.236
  264   2HB   ASN  40          1HB       ASN  40   9.664  -2.823  -6.882
  265   1HD2  ASN  40          1HD2      ASN  40   7.003  -0.991  -7.749
  266   2HD2  ASN  40          2HD2      ASN  40   7.534  -0.495  -9.308
  267    H    THR  41           H        THR  41   5.492  -1.252  -5.951
  268    HA   THR  41           HA       THR  41   5.900   1.148  -4.417
  269    HB   THR  41           HB       THR  41   4.939   2.623  -6.252
  270    HG1  THR  41           1HG      THR  41   5.979   0.631  -7.962
  271   1HG2  THR  41          1HG2      THR  41   7.319   2.653  -5.515
  272   2HG2  THR  41          2HG2      THR  41   7.033   3.183  -7.174
  273   3HG2  THR  41          3HG2      THR  41   7.680   1.571  -6.861
  274    H    LEU  42           H        LEU  42   3.994   2.269  -3.891
  275    HA   LEU  42           HA       LEU  42   1.558   0.641  -4.239
  276   1HB   LEU  42          2HB       LEU  42   2.560   2.269  -1.941
  277   2HB   LEU  42          1HB       LEU  42   0.832   2.076  -2.160
  278    HG   LEU  42           HG       LEU  42   2.858  -0.096  -1.647
  279   1HD1  LEU  42          1HD1      LEU  42   0.686   1.218  -0.069
  280   2HD1  LEU  42          2HD1      LEU  42   2.338   0.829   0.408
  281   3HD1  LEU  42          3HD1      LEU  42   1.134  -0.453   0.267
  282   1HD2  LEU  42          1HD2      LEU  42  -0.049  -0.285  -2.415
  283   2HD2  LEU  42          2HD2      LEU  42   0.829  -1.594  -1.625
  284   3HD2  LEU  42          3HD2      LEU  42   1.333  -1.030  -3.217
  285    H    ARG  43           H        ARG  43  -0.198   1.549  -5.139
  286    HA   ARG  43           HA       ARG  43  -0.045   4.420  -5.741
  287   1HB   ARG  43          2HB       ARG  43  -0.204   2.350  -7.501
  288   2HB   ARG  43          1HB       ARG  43  -1.903   2.711  -7.287
  289   1HG   ARG  43          2HG       ARG  43  -1.479   5.044  -7.934
  290   2HG   ARG  43          1HG       ARG  43   0.226   4.659  -8.143
  291   1HD   ARG  43          2HD       ARG  43  -0.347   3.043  -9.888
  292   2HD   ARG  43          1HD       ARG  43  -2.056   3.421  -9.681
  293    HE   ARG  43           HE       ARG  43  -1.739   5.219 -11.034
  294   1HH1  ARG  43          1HH1      ARG  43   1.352   4.357  -9.658
  295   2HH1  ARG  43          2HH1      ARG  43   2.215   5.592 -10.511
  296   1HH2  ARG  43          1HH2      ARG  43  -0.603   6.838 -12.160
  297   2HH2  ARG  43          2HH2      ARG  43   1.106   6.999 -11.932
  298    H    ILE  44           H        ILE  44  -1.505   5.673  -4.767
  299    HA   ILE  44           HA       ILE  44  -3.722   4.392  -3.316
  300    HB   ILE  44           HB       ILE  44  -2.078   6.848  -2.760
  301   1HG1  ILE  44          2HG1      ILE  44  -2.577   4.319  -1.186
  302   2HG1  ILE  44          1HG1      ILE  44  -1.120   4.701  -2.098
  303   1HG2  ILE  44          1HG2      ILE  44  -3.982   6.234  -0.666
  304   2HG2  ILE  44          2HG2      ILE  44  -4.765   6.748  -2.158
  305   3HG2  ILE  44          3HG2      ILE  44  -3.555   7.777  -1.400
  306   1HD1  ILE  44          1HD1      ILE  44  -2.092   5.840   0.478
  307   2HD1  ILE  44          2HD1      ILE  44  -1.011   6.778  -0.552
  308   3HD1  ILE  44          3HD1      ILE  44  -0.502   5.204   0.058
  309    H    GLU  45           H        GLU  45  -5.764   4.760  -4.049
  310    HA   GLU  45           HA       GLU  45  -6.368   7.472  -4.959
  311   1HB   GLU  45          2HB       GLU  45  -6.351   6.262  -7.027
  312   2HB   GLU  45          1HB       GLU  45  -7.309   4.951  -6.344
  313   1HG   GLU  45          2HG       GLU  45  -9.198   6.509  -6.094
  314   2HG   GLU  45          1HG       GLU  45  -8.228   7.778  -6.836
  315    H    MET  46           H        MET  46  -8.246   8.277  -4.339
  316    HA   MET  46           HA       MET  46  -9.937   6.643  -2.573
  317   1HB   MET  46          2HB       MET  46 -10.405   8.723  -1.297
  318   2HB   MET  46          1HB       MET  46  -8.722   8.233  -1.219
  319   1HG   MET  46          2HG       MET  46  -8.565   9.902  -3.280
  320   2HG   MET  46          1HG       MET  46  -9.957  10.604  -2.459
  321   1HE   MET  46          1HE       MET  46  -6.119   9.849  -2.316
  322   2HE   MET  46          2HE       MET  46  -6.770   8.752  -1.093
  323   3HE   MET  46          3HE       MET  46  -5.761  10.114  -0.607
  324    H    ASP  47           H        ASP  47 -12.063   6.658  -2.898
  325    HA   ASP  47           HA       ASP  47 -13.230   7.112  -5.279
  326   1HB   ASP  47          2HB       ASP  47 -14.322   5.893  -3.476
  327   2HB   ASP  47          1HB       ASP  47 -14.571   7.393  -2.587
  328    H    ASP  48           H        ASP  48 -12.536   9.562  -2.932
  329    HA   ASP  48           HA       ASP  48 -14.304  11.559  -3.781
  330   1HB   ASP  48          2HB       ASP  48 -11.494  11.873  -2.700
  331   2HB   ASP  48          1HB       ASP  48 -12.698  13.154  -2.797
  332    H    GLY  49           H        GLY  49 -11.698  10.103  -5.397
  333   1HA   GLY  49          2HA       GLY  49 -11.314  10.433  -7.710
  334   2HA   GLY  49          1HA       GLY  49 -11.884  12.088  -7.543
  335    H    ARG  50           H        ARG  50  -9.786  10.983  -5.098
  336    HA   ARG  50           HA       ARG  50  -7.621  12.607  -6.262
  337   1HB   ARG  50          2HB       ARG  50  -8.200  11.908  -3.397
  338   2HB   ARG  50          1HB       ARG  50  -6.769  12.774  -3.924
  339   1HG   ARG  50          2HG       ARG  50  -8.153  14.583  -4.761
  340   2HG   ARG  50          1HG       ARG  50  -9.609  13.700  -4.299
  341   1HD   ARG  50          2HD       ARG  50  -9.041  15.415  -2.650
  342   2HD   ARG  50          1HD       ARG  50  -8.942  13.796  -1.959
  343    HE   ARG  50           HE       ARG  50  -6.404  14.522  -2.892
  344   1HH1  ARG  50          1HH1      ARG  50  -8.671  15.415  -0.393
  345   2HH1  ARG  50          2HH1      ARG  50  -7.443  15.949   0.704
  346   1HH2  ARG  50          1HH2      ARG  50  -4.787  15.223  -1.449
  347   2HH2  ARG  50          2HH2      ARG  50  -5.238  15.841   0.104
  348    H    GLU  51           H        GLU  51  -5.803  11.677  -6.904
  349    HA   GLU  51           HA       GLU  51  -5.221   8.968  -5.914
  350   1HB   GLU  51          2HB       GLU  51  -4.256   8.458  -8.082
  351   2HB   GLU  51          1HB       GLU  51  -5.905   9.035  -8.286
  352   1HG   GLU  51          2HG       GLU  51  -5.068  11.234  -8.919
  353   2HG   GLU  51          1HG       GLU  51  -3.413  10.665  -8.712
  354    H    ILE  52           H        ILE  52  -3.088   8.468  -5.426
  355    HA   ILE  52           HA       ILE  52  -0.940  10.335  -5.853
  356    HB   ILE  52           HB       ILE  52  -2.020  11.330  -3.884
  357   1HG1  ILE  52          2HG1      ILE  52  -0.038  11.352  -2.396
  358   2HG1  ILE  52          1HG1      ILE  52   0.618   9.974  -3.278
  359   1HG2  ILE  52          1HG2      ILE  52  -2.466  10.219  -1.915
  360   2HG2  ILE  52          2HG2      ILE  52  -1.302   8.937  -2.250
  361   3HG2  ILE  52          3HG2      ILE  52  -2.836   8.983  -3.118
  362   1HD1  ILE  52          1HD1      ILE  52   0.700  11.342  -5.322
  363   2HD1  ILE  52          2HD1      ILE  52   1.668  12.035  -4.018
  364   3HD1  ILE  52          3HD1      ILE  52   0.089  12.721  -4.409
  365    H    THR  53           H        THR  53   1.120   9.411  -5.449
  366    HA   THR  53           HA       THR  53   1.052   6.495  -5.191
  367    HB   THR  53           HB       THR  53   2.133   7.421  -7.179
  368    HG1  THR  53           1HG      THR  53   2.970   5.488  -6.218
  369   1HG2  THR  53          1HG2      THR  53   3.217   9.351  -6.963
  370   2HG2  THR  53          2HG2      THR  53   4.571   8.359  -6.421
  371   3HG2  THR  53          3HG2      THR  53   3.499   9.110  -5.239
  372    H    VAL  54           H        VAL  54   2.597   5.369  -3.887
  373    HA   VAL  54           HA       VAL  54   4.037   6.895  -1.868
  374    HB   VAL  54           HB       VAL  54   2.003   4.804  -1.078
  375   1HG1  VAL  54          1HG1      VAL  54   3.467   4.602   0.642
  376   2HG1  VAL  54          2HG1      VAL  54   2.664   6.066   1.208
  377   3HG1  VAL  54          3HG1      VAL  54   4.197   6.179   0.345
  378   1HG2  VAL  54          1HG2      VAL  54   0.918   6.776   0.081
  379   2HG2  VAL  54          2HG2      VAL  54   0.792   6.753  -1.678
  380   3HG2  VAL  54          3HG2      VAL  54   1.965   7.811  -0.891
  381    HA   PRO  55           HA       PRO  55   6.945   3.621  -2.779
  382   1HB   PRO  55          2HB       PRO  55   8.250   4.493  -0.272
  383   2HB   PRO  55          1HB       PRO  55   8.900   4.426  -1.914
  384   1HG   PRO  55          2HG       PRO  55   8.313   6.760  -0.769
  385   2HG   PRO  55          1HG       PRO  55   7.998   6.482  -2.492
  386   1HD   PRO  55          2HD       PRO  55   6.082   6.431  -0.187
  387   2HD   PRO  55          1HD       PRO  55   5.884   7.144  -1.803
  388    H    LYS  56           H        LYS  56   6.730   1.538  -2.366
  389    HA   LYS  56           HA       LYS  56   5.757   0.658   0.257
  390   1HB   LYS  56          2HB       LYS  56   5.030  -1.347  -0.814
  391   2HB   LYS  56          1HB       LYS  56   4.519   0.005  -1.812
  392   1HG   LYS  56          2HG       LYS  56   6.410  -0.376  -3.304
  393   2HG   LYS  56          1HG       LYS  56   6.916  -1.740  -2.311
  394   1HD   LYS  56          2HD       LYS  56   4.268  -1.532  -3.741
  395   2HD   LYS  56          1HD       LYS  56   5.674  -2.411  -4.340
  396   1HE   LYS  56          2HE       LYS  56   4.282  -4.027  -3.331
  397   2HE   LYS  56          1HE       LYS  56   5.596  -3.743  -2.194
  398   1HZ   LYS  56          1HZ       LYS  56   4.168  -3.070  -0.654
  399   2HZ   LYS  56          2HZ       LYS  56   2.919  -3.628  -1.649
  400   3HZ   LYS  56          3HZ       LYS  56   3.387  -2.005  -1.713
  401    H    GLY  57           H        GLY  57   8.688   0.994  -1.245
  402   1HA   GLY  57          2HA       GLY  57  10.037  -1.372  -1.100
  403   2HA   GLY  57          1HA       GLY  57  10.775   0.172  -0.718
  404    H    ILE  58           H        ILE  58   9.585   0.834   1.678
  405    HA   ILE  58           HA       ILE  58   9.818  -1.402   3.439
  406    HB   ILE  58           HB       ILE  58  11.335   0.096   4.866
  407   1HG1  ILE  58          2HG1      ILE  58  13.009   1.326   3.349
  408   2HG1  ILE  58          1HG1      ILE  58  11.727   1.282   2.144
  409   1HG2  ILE  58          1HG2      ILE  58  11.874  -2.124   3.803
  410   2HG2  ILE  58          2HG2      ILE  58  13.253  -1.079   4.138
  411   3HG2  ILE  58          3HG2      ILE  58  12.623  -1.208   2.495
  412   1HD1  ILE  58          1HD1      ILE  58  11.932   3.372   3.544
  413   2HD1  ILE  58          2HD1      ILE  58  11.308   2.414   4.885
  414   3HD1  ILE  58          3HD1      ILE  58  10.329   2.645   3.438
  415    H    ALA  59           H        ALA  59   7.494  -0.461   3.110
  416    HA   ALA  59           HA       ALA  59   7.070   1.449   5.299
  417   1HB   ALA  59          1HB       ALA  59   6.787   2.715   3.318
  418   2HB   ALA  59          2HB       ALA  59   5.181   2.418   3.983
  419   3HB   ALA  59          3HB       ALA  59   5.752   1.477   2.604
  420    H    VAL  60           H        VAL  60   6.030   0.455   6.901
  421    HA   VAL  60           HA       VAL  60   4.317  -1.804   6.500
  422    HB   VAL  60           HB       VAL  60   5.568  -1.532   8.590
  423   1HG1  VAL  60          1HG1      VAL  60   4.662   1.106   8.466
  424   2HG1  VAL  60          2HG1      VAL  60   5.626   0.366   9.743
  425   3HG1  VAL  60          3HG1      VAL  60   3.868   0.405   9.876
  426   1HG2  VAL  60          1HG2      VAL  60   3.711  -1.991  10.165
  427   2HG2  VAL  60          2HG2      VAL  60   3.583  -2.899   8.658
  428   3HG2  VAL  60          3HG2      VAL  60   2.571  -1.479   8.921
  429    H    PHE  61           H        PHE  61   2.236  -1.745   5.854
  430    HA   PHE  61           HA       PHE  61   0.609   0.565   6.620
  431   1HB   PHE  61          2HB       PHE  61  -0.315   0.581   4.235
  432   2HB   PHE  61          1HB       PHE  61   1.284   1.272   4.489
  433    HD1  PHE  61           1HD      PHE  61   3.012   0.635   3.122
  434    HD2  PHE  61           2HD      PHE  61  -0.353  -1.936   3.521
  435    HE1  PHE  61           1HE      PHE  61   3.938  -0.838   1.384
  436    HE2  PHE  61           2HE      PHE  61   0.567  -3.414   1.781
  437    HZ   PHE  61           HZ       PHE  61   2.717  -2.868   0.714
  438    H    HIS  62           H        HIS  62  -1.575   0.201   6.796
  439    HA   HIS  62           HA       HIS  62  -2.408  -2.621   6.625
  440   1HB   HIS  62          2HB       HIS  62  -3.579  -0.502   8.437
  441   2HB   HIS  62          1HB       HIS  62  -3.864  -2.238   8.498
  442    HD1  HIS  62           1HD      HIS  62  -1.322  -3.555   8.809
  443    HD2  HIS  62           2HD      HIS  62  -1.924   0.220  10.428
  444    HE1  HIS  62           1HE      HIS  62   0.413  -3.316  10.611
  445    HE2  HIS  62           2HE      HIS  62  -0.029  -1.059  11.638
  446    H    PHE  63           H        PHE  63  -4.180  -3.115   5.435
  447    HA   PHE  63           HA       PHE  63  -5.543  -0.890   4.091
  448   1HB   PHE  63          2HB       PHE  63  -5.167  -3.789   3.388
  449   2HB   PHE  63          1HB       PHE  63  -6.408  -2.820   2.606
  450    HD1  PHE  63           1HD      PHE  63  -3.046  -1.625   3.605
  451    HD2  PHE  63           2HD      PHE  63  -5.589  -2.828   0.413
  452    HE1  PHE  63           1HE      PHE  63  -1.393  -0.806   1.982
  453    HE2  PHE  63           2HE      PHE  63  -3.937  -2.014  -1.215
  454    HZ   PHE  63           HZ       PHE  63  -1.833  -1.003  -0.430
  455    H    ARG  64           H        ARG  64  -7.449  -0.293   4.861
  456    HA   ARG  64           HA       ARG  64  -8.997  -2.066   6.556
  457   1HB   ARG  64          2HB       ARG  64  -9.401   0.800   5.685
  458   2HB   ARG  64          1HB       ARG  64 -10.527  -0.064   6.721
  459   1HG   ARG  64          2HG       ARG  64  -7.627   0.324   7.403
  460   2HG   ARG  64          1HG       ARG  64  -8.903   1.438   7.895
  461   1HD   ARG  64          2HD       ARG  64 -10.038  -0.387   9.067
  462   2HD   ARG  64          1HD       ARG  64  -8.763  -1.497   8.575
  463    HE   ARG  64           HE       ARG  64  -7.536  -0.737  10.332
  464   1HH1  ARG  64          1HH1      ARG  64  -9.873   1.723   9.511
  465   2HH1  ARG  64          2HH1      ARG  64  -9.379   2.792  10.781
  466   1HH2  ARG  64          1HH2      ARG  64  -6.890   0.665  12.006
  467   2HH2  ARG  64          2HH2      ARG  64  -7.688   2.190  12.198
  468    H    THR  65           H        THR  65 -10.869  -3.064   6.030
  469    HA   THR  65           HA       THR  65 -11.841  -2.711   3.273
  470    HB   THR  65           HB       THR  65 -11.937  -5.181   5.007
  471    HG1  THR  65           1HG      THR  65 -10.372  -5.958   3.685
  472   1HG2  THR  65          1HG2      THR  65 -12.424  -5.509   2.162
  473   2HG2  THR  65          2HG2      THR  65 -13.682  -4.590   2.989
  474   3HG2  THR  65          3HG2      THR  65 -13.260  -6.208   3.547
  475    HA   PRO  66           HA       PRO  66 -15.563  -0.889   4.907
  476   1HB   PRO  66          2HB       PRO  66 -16.665  -2.472   2.613
  477   2HB   PRO  66          1HB       PRO  66 -17.012  -0.806   3.097
  478   1HG   PRO  66          2HG       PRO  66 -15.352  -1.315   1.077
  479   2HG   PRO  66          1HG       PRO  66 -15.028   0.005   2.215
  480   1HD   PRO  66          2HD       PRO  66 -13.683  -2.621   1.937
  481   2HD   PRO  66          1HD       PRO  66 -13.048  -1.086   2.557
  482    H    GLN  67           H        GLN  67 -15.255  -4.325   4.194
  483    HA   GLN  67           HA       GLN  67 -17.653  -5.216   5.324
  484   1HB   GLN  67          2HB       GLN  67 -16.032  -6.552   3.930
  485   2HB   GLN  67          1HB       GLN  67 -15.015  -6.683   5.359
  486   1HG   GLN  67          2HG       GLN  67 -16.380  -8.675   5.017
  487   2HG   GLN  67          1HG       GLN  67 -16.767  -7.864   6.535
  488   1HE2  GLN  67          1HE2      GLN  67 -17.952  -9.042   3.607
  489   2HE2  GLN  67          2HE2      GLN  67 -19.569  -8.450   3.734
  490    H    GLY  68           H        GLY  68 -14.884  -3.865   6.789
  491   1HA   GLY  68          2HA       GLY  68 -14.970  -3.137   9.065
  492   2HA   GLY  68          1HA       GLY  68 -15.970  -4.534   9.434
  493    H    GLU  69           H        GLU  69 -13.117  -4.797   7.445
  494    HA   GLU  69           HA       GLU  69 -11.703  -6.042   9.715
  495   1HB   GLU  69          2HB       GLU  69 -10.810  -7.751   8.191
  496   2HB   GLU  69          1HB       GLU  69 -12.563  -7.819   8.295
  497   1HG   GLU  69          2HG       GLU  69 -12.735  -6.632   6.169
  498   2HG   GLU  69          1HG       GLU  69 -10.974  -6.574   6.065
  499    H    LEU  70           H        LEU  70  -9.378  -6.059   9.559
  500    HA   LEU  70           HA       LEU  70  -8.331  -4.001   7.738
  501   1HB   LEU  70          2HB       LEU  70  -8.514  -3.045   9.952
  502   2HB   LEU  70          1HB       LEU  70  -7.664  -4.409  10.652
  503    HG   LEU  70           HG       LEU  70  -6.329  -2.281  10.420
  504   1HD1  LEU  70          1HD1      LEU  70  -4.958  -4.366   8.807
  505   2HD1  LEU  70          2HD1      LEU  70  -5.494  -4.788  10.433
  506   3HD1  LEU  70          3HD1      LEU  70  -4.377  -3.444  10.193
  507   1HD2  LEU  70          1HD2      LEU  70  -6.109  -1.252   8.457
  508   2HD2  LEU  70          2HD2      LEU  70  -7.292  -2.378   7.791
  509   3HD2  LEU  70          3HD2      LEU  70  -5.572  -2.738   7.678
  510    H    VAL  71           H        VAL  71  -6.710  -4.619   6.519
  511    HA   VAL  71           HA       VAL  71  -5.344  -7.146   7.129
  512    HB   VAL  71           HB       VAL  71  -5.358  -5.585   4.538
  513   1HG1  VAL  71          1HG1      VAL  71  -4.818  -8.403   4.311
  514   2HG1  VAL  71          2HG1      VAL  71  -3.672  -7.636   5.407
  515   3HG1  VAL  71          3HG1      VAL  71  -3.859  -7.030   3.763
  516   1HG2  VAL  71          1HG2      VAL  71  -6.781  -8.157   4.709
  517   2HG2  VAL  71          2HG2      VAL  71  -7.204  -6.679   3.845
  518   3HG2  VAL  71          3HG2      VAL  71  -7.525  -6.812   5.575
  519    H    GLU  72           H        GLU  72  -3.087  -7.269   7.211
  520    HA   GLU  72           HA       GLU  72  -1.702  -4.671   7.288
  521   1HB   GLU  72          2HB       GLU  72  -0.273  -5.524   9.064
  522   2HB   GLU  72          1HB       GLU  72  -1.962  -5.610   9.539
  523   1HG   GLU  72          2HG       GLU  72  -0.393  -7.942   8.467
  524   2HG   GLU  72          1HG       GLU  72  -0.593  -7.586  10.180
  525    H    ILE  73           H        ILE  73   0.092  -4.432   6.121
  526    HA   ILE  73           HA       ILE  73   1.493  -6.807   5.122
  527    HB   ILE  73           HB       ILE  73   0.709  -4.504   3.336
  528   1HG1  ILE  73          2HG1      ILE  73  -0.651  -6.323   2.157
  529   2HG1  ILE  73          1HG1      ILE  73  -0.462  -7.262   3.635
  530   1HG2  ILE  73          1HG2      ILE  73   1.604  -5.865   1.531
  531   2HG2  ILE  73          2HG2      ILE  73   2.035  -7.128   2.683
  532   3HG2  ILE  73          3HG2      ILE  73   2.836  -5.557   2.755
  533   1HD1  ILE  73          1HD1      ILE  73  -2.398  -5.299   3.048
  534   2HD1  ILE  73          2HD1      ILE  73  -1.365  -4.648   4.320
  535   3HD1  ILE  73          3HD1      ILE  73  -2.174  -6.196   4.550
  536    H    ASP  74           H        ASP  74   3.446  -6.514   6.028
  537    HA   ASP  74           HA       ASP  74   4.515  -3.969   6.651
  538   1HB   ASP  74          2HB       ASP  74   5.879  -6.662   6.530
  539   2HB   ASP  74          1HB       ASP  74   6.575  -5.209   7.235
  540    H    GLY  75           H        GLY  75   4.838  -2.628   5.000
  541   1HA   GLY  75          2HA       GLY  75   5.711  -3.179   2.430
  542   2HA   GLY  75          1HA       GLY  75   5.895  -1.635   3.232
  543    H    ARG  76           H        ARG  76   7.525  -3.441   5.279
  544    HA   ARG  76           HA       ARG  76  10.041  -2.687   4.197
  545   1HB   ARG  76          2HB       ARG  76   9.389  -4.215   6.701
  546   2HB   ARG  76          1HB       ARG  76  10.965  -3.549   6.297
  547   1HG   ARG  76          2HG       ARG  76  10.021  -1.294   6.334
  548   2HG   ARG  76          1HG       ARG  76   8.442  -1.966   6.745
  549   1HD   ARG  76          2HD       ARG  76   9.567  -1.133   8.734
  550   2HD   ARG  76          1HD       ARG  76   9.376  -2.884   8.813
  551    HE   ARG  76           HE       ARG  76  11.883  -2.330   7.714
  552   1HH1  ARG  76          1HH1      ARG  76  10.192  -1.969  10.746
  553   2HH1  ARG  76          2HH1      ARG  76  11.630  -2.073  11.705
  554   1HH2  ARG  76          1HH2      ARG  76  13.776  -2.468   8.974
  555   2HH2  ARG  76          2HH2      ARG  76  13.665  -2.357  10.697
  556    H    ALA  77           H        ALA  77   8.977  -5.835   5.396
  557    HA   ALA  77           HA       ALA  77  10.985  -7.077   3.708
  558   1HB   ALA  77          1HB       ALA  77   9.421  -8.529   5.795
  559   2HB   ALA  77          2HB       ALA  77  10.778  -7.487   6.221
  560   3HB   ALA  77          3HB       ALA  77  11.032  -8.876   5.166
  561    H    LEU  78           H        LEU  78   7.768  -6.431   3.321
  562    HA   LEU  78           HA       LEU  78   7.183  -9.029   2.108
  563   1HB   LEU  78          2HB       LEU  78   5.453  -6.695   2.841
  564   2HB   LEU  78          1HB       LEU  78   4.874  -7.959   1.772
  565    HG   LEU  78           HG       LEU  78   5.155  -9.628   3.502
  566   1HD1  LEU  78          1HD1      LEU  78   5.655  -8.524   5.867
  567   2HD1  LEU  78          2HD1      LEU  78   6.611  -7.437   4.859
  568   3HD1  LEU  78          3HD1      LEU  78   6.929  -9.171   4.833
  569   1HD2  LEU  78          1HD2      LEU  78   3.658  -8.462   5.309
  570   2HD2  LEU  78          2HD2      LEU  78   3.030  -8.790   3.696
  571   3HD2  LEU  78          3HD2      LEU  78   3.586  -7.171   4.113
  572    H    VAL  79           H        VAL  79   8.709  -6.373   1.043
  573    HA   VAL  79           HA       VAL  79   7.331  -5.942  -1.426
  574    HB   VAL  79           HB       VAL  79  10.176  -5.200  -0.744
  575   1HG1  VAL  79          1HG1      VAL  79   9.088  -3.330  -2.488
  576   2HG1  VAL  79          2HG1      VAL  79   8.536  -4.886  -3.111
  577   3HG1  VAL  79          3HG1      VAL  79  10.259  -4.586  -2.886
  578   1HG2  VAL  79          1HG2      VAL  79   8.982  -4.084   0.883
  579   2HG2  VAL  79          2HG2      VAL  79   7.563  -3.883  -0.145
  580   3HG2  VAL  79          3HG2      VAL  79   9.000  -2.901  -0.425
  581    H    ALA  80           H        ALA  80   7.234  -7.488  -2.926
  582    HA   ALA  80           HA       ALA  80   9.543  -9.263  -3.302
  583   1HB   ALA  80          1HB       ALA  80   7.995 -10.720  -4.524
  584   2HB   ALA  80          2HB       ALA  80   6.701  -9.550  -4.273
  585   3HB   ALA  80          3HB       ALA  80   7.420 -10.379  -2.892
  586    H    ARG  81           H        ARG  81  10.936  -8.555  -4.782
  587    HA   ARG  81           HA       ARG  81  10.055  -6.894  -6.987
  588   1HB   ARG  81          2HB       ARG  81  12.803  -7.909  -6.244
  589   2HB   ARG  81          1HB       ARG  81  12.467  -6.762  -7.532
  590   1HG   ARG  81          2HG       ARG  81  11.591  -5.176  -5.890
  591   2HG   ARG  81          1HG       ARG  81  11.935  -6.329  -4.599
  592   1HD   ARG  81          2HD       ARG  81  14.317  -6.247  -5.161
  593   2HD   ARG  81          1HD       ARG  81  13.971  -5.100  -6.458
  594    HE   ARG  81           HE       ARG  81  12.962  -4.060  -4.065
  595   1HH1  ARG  81          1HH1      ARG  81  16.034  -4.800  -5.545
  596   2HH1  ARG  81          2HH1      ARG  81  16.888  -3.564  -4.683
  597   1HH2  ARG  81          1HH2      ARG  81  14.084  -2.434  -2.930
  598   2HH2  ARG  81          2HH2      ARG  81  15.781  -2.221  -3.199
  599    HA   PRO  82           HA       PRO  82   9.895 -10.153  -9.947
  600   1HB   PRO  82          2HB       PRO  82  10.101  -8.770 -12.239
  601   2HB   PRO  82          1HB       PRO  82   8.693  -8.638 -11.182
  602   1HG   PRO  82          2HG       PRO  82  10.977  -6.759 -11.530
  603   2HG   PRO  82          1HG       PRO  82   9.268  -6.409 -11.228
  604   1HD   PRO  82          2HD       PRO  82  11.291  -6.396  -9.314
  605   2HD   PRO  82          1HD       PRO  82   9.553  -6.486  -8.979
  606    H    GLU  83           H        GLU  83  11.944  -8.277 -12.021
  607    HA   GLU  83           HA       GLU  83  13.624 -10.321 -12.730
  608   1HB   GLU  83          2HB       GLU  83  14.264  -7.371 -12.680
  609   2HB   GLU  83          1HB       GLU  83  15.154  -8.587 -13.586
  610   1HG   GLU  83          2HG       GLU  83  13.157  -9.071 -14.903
  611   2HG   GLU  83          1HG       GLU  83  12.265  -7.851 -13.994
  612    H    GLU  84           H        GLU  84  13.776  -8.358  -9.894
  613    HA   GLU  84           HA       GLU  84  16.513  -8.906  -9.275
  614   1HB   GLU  84          2HB       GLU  84  14.242  -7.881  -7.576
  615   2HB   GLU  84          1HB       GLU  84  15.894  -8.039  -7.000
  616   1HG   GLU  84          2HG       GLU  84  15.441  -5.758  -7.640
  617   2HG   GLU  84          1HG       GLU  84  16.638  -6.468  -8.724
  618    H    ARG  85           H        ARG  85  13.630 -10.705  -9.021
  619    HA   ARG  85           HA       ARG  85  13.152 -12.757  -8.172
  620   1HB   ARG  85          2HB       ARG  85  16.152 -12.940  -7.832
  621   2HB   ARG  85          1HB       ARG  85  15.031 -14.290  -7.722
  622   1HG   ARG  85          2HG       ARG  85  14.405 -13.974 -10.057
  623   2HG   ARG  85          1HG       ARG  85  15.515 -12.607 -10.170
  624   1HD   ARG  85          2HD       ARG  85  16.275 -15.460  -9.549
  625   2HD   ARG  85          1HD       ARG  85  16.504 -14.644 -11.096
  626    HE   ARG  85           HE       ARG  85  17.767 -13.138  -9.105
  627   1HH1  ARG  85          1HH1      ARG  85  18.092 -16.227 -10.696
  628   2HH1  ARG  85          2HH1      ARG  85  19.807 -16.298 -10.480
  629   1HH2  ARG  85          1HH2      ARG  85  20.026 -13.230  -8.822
  630   2HH2  ARG  85          2HH2      ARG  85  20.906 -14.598  -9.416
  631    H    ILE  86           H        ILE  86  13.426 -14.163  -6.142
  632    HA   ILE  86           HA       ILE  86  13.657 -12.367  -3.816
  633    HB   ILE  86           HB       ILE  86  11.983 -14.871  -4.079
  634   1HG1  ILE  86          2HG1      ILE  86  11.086 -13.057  -5.442
  635   2HG1  ILE  86          1HG1      ILE  86  10.060 -13.320  -4.037
  636   1HG2  ILE  86          1HG2      ILE  86  12.159 -14.841  -1.841
  637   2HG2  ILE  86          2HG2      ILE  86  11.011 -13.506  -1.938
  638   3HG2  ILE  86          3HG2      ILE  86  12.739 -13.176  -1.807
  639   1HD1  ILE  86          1HD1      ILE  86  10.182 -11.129  -3.720
  640   2HD1  ILE  86          2HD1      ILE  86  11.517 -10.959  -4.858
  641   3HD1  ILE  86          3HD1      ILE  86  11.839 -11.399  -3.182