*HEADER    DNA EXCISION REPAIR                     13-JUL-00   1E52
*TITLE     SOLUTION STRUCTURE OF ESCHERICHIA COLI UVRB C-TERMINAL
*TITLE    2 DOMAIN
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: EXCINUCLEASE ABC SUBUNIT ;
*COMPND   3 CHAIN: A, B;
*COMPND   4 FRAGMENT: C-TERMINAL DOMAIN RESIDUES 618-673;
*COMPND   5 ENGINEERED: YES
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;
*SOURCE   3 STRAIN: PP3398;
*SOURCE   4 PLASMID: PNP118;
*SOURCE   5 GENE: UVRB;
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21:DE3;
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET-HIS;
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PNP118;
*SOURCE  11 EXPRESSION_SYSTEM_GENE: UVRB(DOMAIN)
*KEYWDS    UVRB, DNA REPAIR, UVRC BINDING DOMAIN
*EXPDTA    NMR, 20 STRUCTURES
*AUTHOR    A.ALEXANDROVICH,G.KELLY,T.A.FRENKIEL,G.F.MOOLENAAR,
*AUTHOR   2 N.GOOSEN,M.R.SANDERSON,A.N.LANE




! 15N HSQC-NOESY
assign (segid  A and resid   35 and name HE21) (segid  A and resid   32 and name HD1#) 3.5 1.7 0.5 !peaknum  576
assign (segid  A and resid   30 and name   HN) (segid  A and resid   28 and name   HN) 3.5 1.7 0.5 !peaknum  568
assign (segid  A and resid   12 and name   HN) (segid  A and resid   11 and name   HN) 3.5 1.7 0.5 !peaknum  102
assign (segid  A and resid   36 and name   HN) (segid  A and resid   34 and name   HN) 5.5 3.7 0.5 !peaknum  621 572
assign (segid  A and resid   38 and name   HN) (segid  A and resid   37 and name   HA) 3.5 1.7 0.5 !peaknum  645
assign (segid  A and resid   49 and name   HN) (segid  A and resid   48 and name   HN) 2.8 1.0 0.2 !peaknum  585 584
assign (segid  A and resid   46 and name   HN) (segid  A and resid   49 and name   HN) 5.5 3.7 0.5 !peaknum  583
assign (segid  A and resid   34 and name   HN) (segid  A and resid   33 and name   HN) 3.5 1.7 0.5 !peaknum  571 620
assign (segid  A and resid   40 and name   HN) (segid  A and resid   39 and name  HB2) 3.5 1.7 0.5 !peaknum  625
assign (segid  A and resid   49 and name   HN) (segid  A and resid   48 and name   HA) 3.5 1.7 0.5 !peaknum  642
assign (segid  A and resid   51 and name HE21) (segid  A and resid   55 and name HD1#) 3.5 1.7 0.5 !peaknum  443
assign (segid  A and resid   49 and name   HE) (segid  A and resid   47 and name  HB*) 5.5 3.7 0.5 !peaknum  586
assign (segid  A and resid   27 and name   HN) (segid  A and resid   26 and name   HA) 3.5 1.7 0.5 !peaknum  649
assign (segid  A and resid   24 and name HE21) (segid  A and resid   28 and name  HG2) 2.8 1.0 0.2 !peaknum  201
assign (segid  A and resid   16 and name   HN) (segid  A and resid   17 and name   HN) 2.8 1.0 0.2 !peaknum  562
assign (segid  A and resid   62 and name   HN) (segid  A and resid   60 and name   HN) 3.5 1.7 0.5 !peaknum  609
assign (segid  A and resid   36 and name   HN) (segid  A and resid   35 and name  HG1) 2.8 1.0 0.2 !peaknum  298
assign (segid  A and resid   29 and name   HN) (segid  A and resid   31 and name   HN) 5.5 3.7 0.5 !peaknum  566
assign (segid  A and resid   58 and name   HN) (segid  A and resid   59 and name  HB2) 5.5 3.7 0.5 !peaknum  606
assign (segid  A and resid   39 and name HD22) (segid  A and resid   38 and name  HB2) 5.5 3.7 0.5 !peaknum  580
assign (segid  A and resid   39 and name HD21) (segid  A and resid   41 and name  HG2) 5.5 3.7 0.5 !peaknum  329
assign (segid  A and resid   27 and name   HN) (segid  A and resid   23 and name   HA) 3.5 1.7 0.5 !peaknum  648
assign (segid  A and resid   29 and name   HN) (segid  A and resid   32 and name   HN) 5.5 3.7 0.5 !peaknum  565
assign (segid  A and resid   36 and name   HN) (segid  A and resid   45 and name  HB*) 3.5 1.7 0.5 !peaknum  308
assign (segid  A and resid   53 and name   HN) (segid  A and resid   52 and name   HA) 3.5 1.7 0.5 !peaknum  640
assign (segid  A and resid   51 and name HE22) (segid  A and resid   32 and name HD2#) 5.5 3.7 0.5 !peaknum  444
assign (segid  A and resid   63 and name   HN) (segid  A and resid   19 and name  HG1) 2.8 1.0 0.2 !peaknum  636
assign (segid  A and resid   29 and name   HN) (segid  A and resid   30 and name   HN) 2.8 1.0 0.2 !peaknum  564 567
assign (segid  A and resid   37 and name   HN) (segid  A and resid   40 and name   HA) 5.5 3.7 0.5 !peaknum  595
assign (segid  A and resid   62 and name   HN) (segid  A and resid   60 and name   HB) 5.5 3.7 0.5 !peaknum  546
assign (segid  A and resid   43 and name   HN) (segid  A and resid   44 and name   HN) 2.8 1.0 0.2 !peaknum  356 357
assign (segid  A and resid   31 and name   HN) (segid  A and resid   30 and name  HG2) 5.5 3.7 0.5 !peaknum  618
assign (segid  A and resid   45 and name   HN) (segid  A and resid   41 and name   HA) 5.5 3.7 0.5 !peaknum  629
assign (segid  A and resid   12 and name   HN) (segid  A and resid   13 and name   HB) 3.5 1.7 0.5 !peaknum  610
assign (segid  A and resid   57 and name   HN) (segid  A and resid   53 and name   HA) 5.5 3.7 0.5 !peaknum  638
assign (segid  A and resid   44 and name   HN) (segid  A and resid   45 and name   HN) 2.8 1.0 0.2 !peaknum  370 373
assign (segid  A and resid   40 and name   HN) (segid  A and resid   36 and name   HA) 5.5 3.7 0.5 !peaknum  644
assign (segid  A and resid   54 and name   HN) (segid  A and resid   50 and name   HA) 5.5 3.7 0.5 !peaknum  469
assign (segid  A and resid   29 and name   HN) (segid  A and resid   52 and name   HG) 5.5 3.7 0.5 !peaknum  237
assign (segid  A and resid   55 and name   HN) (segid  A and resid   52 and name   HA) 3.5 1.7 0.5 !peaknum  639
assign (segid  A and resid   41 and name   HN) (segid  A and resid   37 and name   HA) 3.5 1.7 0.5 !peaknum  345
assign (segid  A and resid   48 and name   HN) (segid  A and resid   45 and name   HA) 3.5 1.7 0.5 !peaknum  643
assign (segid  A and resid   13 and name   HN) (segid  A and resid   14 and name  HD2) 2.8 1.0 0.2 !peaknum  109
assign (segid  A and resid   34 and name   HN) (segid  A and resid   35 and name   HN) 2.8 1.0 0.2 !peaknum  280 282
assign (segid  A and resid   13 and name   HN) (segid  A and resid   14 and name  HD1) 2.8 1.0 0.2 !peaknum  110
assign (segid  A and resid   44 and name   HN) (segid  A and resid   43 and name  HG2) 2.8 1.0 0.2 !peaknum  369
assign (segid  A and resid   52 and name   HN) (segid  A and resid   51 and name   HN) 2.8 1.0 0.2 !peaknum  448 432
assign (segid  A and resid   43 and name   HN) (segid  A and resid   46 and name  HB*) 5.5 3.7 0.5 !peaknum  628
assign (segid  A and resid   49 and name   HN) (segid  A and resid   50 and name   HN) 2.8 1.0 0.2 !peaknum  419
assign (segid  A and resid   42 and name   HN) (segid  A and resid   45 and name  HB*) 3.5 1.7 0.5 !peaknum  581
assign (segid  A and resid   49 and name   HN) (segid  A and resid   46 and name   HA) 3.5 1.7 0.5 !peaknum  641
assign (segid  A and resid   38 and name   HN) (segid  A and resid   37 and name   HN) 2.8 1.0 0.2 !peaknum  310 577
assign (segid  A and resid   30 and name   HN) (segid  A and resid   32 and name   HN) 3.5 1.7 0.5 !peaknum  240
assign (segid  A and resid   36 and name   HN) (segid  A and resid   35 and name   HN) 3.5 1.7 0.5 !peaknum  291 281
assign (segid  A and resid   47 and name   HN) (segid  A and resid   45 and name  HB*) 5.5 3.7 0.5 !peaknum  633
assign (segid  A and resid   30 and name   HN) (segid  A and resid   28 and name   HA) 5.5 3.7 0.5 !peaknum  616
assign (segid  A and resid   45 and name   HN) (segid  A and resid   46 and name  HB*) 5.5 3.7 0.5 !peaknum  378
assign (segid  A and resid   26 and name   HN) (segid  A and resid   23 and name   HA) 3.5 1.7 0.5 !peaknum  591
assign (segid  A and resid   34 and name   HN) (segid  A and resid   30 and name  HG2) 5.5 3.7 0.5 !peaknum  594
assign (segid  A and resid   36 and name   HN) (segid  A and resid   37 and name  HB*) 5.5 3.7 0.5 !peaknum  299
assign (segid  A and resid   57 and name   HN) (segid  A and resid   56 and name   HA) 3.5 1.7 0.5 !peaknum  637
assign (segid  A and resid   40 and name   HN) (segid  A and resid   37 and name   HA) 3.5 1.7 0.5 !peaknum  623
assign (segid  A and resid   57 and name   HN) (segid  A and resid   56 and name  HD*) 3.5 1.7 0.5 !peaknum  603
assign (segid  A and resid   17 and name   HN) (segid  A and resid   18 and name   HN) 2.8 1.0 0.2 !peaknum  140 152
assign (segid  A and resid   49 and name   HN) (segid  A and resid   33 and name  HG2) 3.5 1.7 0.5 !peaknum  635
assign (segid  A and resid   31 and name   HN) (segid  A and resid   27 and name   HA) 5.5 3.7 0.5 !peaknum  646
assign (segid  A and resid   49 and name   HN) (segid  A and resid   45 and name   HA) 5.5 3.7 0.5 !peaknum  634
assign (segid  A and resid   52 and name   HN) (segid  A and resid   53 and name   HN) 2.8 1.0 0.2 !peaknum  449 457
assign (segid  A and resid   33 and name   HN) (segid  A and resid   32 and name   HN) 2.8 1.0 0.2 !peaknum  569 257
assign (segid  A and resid   45 and name   HN) (segid  A and resid   44 and name  HG1) 2.8 1.0 0.2 !peaknum  377
assign (segid  A and resid   46 and name   HN) (segid  A and resid   43 and name  HG2) 5.5 3.7 0.5 !peaknum  384
assign (segid  A and resid   38 and name   HN) (segid  A and resid   40 and name   HN) 3.5 1.7 0.5 !peaknum  590
assign (segid  A and resid   51 and name   HN) (segid  A and resid   50 and name   HA) 3.5 1.7 0.5 !peaknum  433
assign (segid  A and resid   12 and name   HN) (segid  A and resid   13 and name   HA) 5.5 3.7 0.5 !peaknum  611
assign (segid  A and resid   30 and name   HN) (segid  A and resid   29 and name   HA) 3.5 1.7 0.5 !peaknum  647
assign (segid  A and resid   57 and name   HN) (segid  A and resid   55 and name  HB*) 5.5 3.7 0.5 !peaknum  602
assign (segid  A and resid   51 and name   HN) (segid  A and resid   50 and name   HN) 2.8 1.0 0.2 !peaknum  431
assign (segid  A and resid   12 and name HD21) (segid  A and resid   13 and name   HB) 5.5 3.7 0.5 !peaknum  104
assign (segid  A and resid   25 and name   HN) (segid  A and resid   24 and name   HN) 2.8 1.0 0.2 !peaknum  202 196
assign (segid  A and resid   33 and name   HN) (segid  A and resid   32 and name  HB2) 3.5 1.7 0.5 !peaknum  570
assign (segid  A and resid   42 and name   HN) (segid  A and resid   46 and name  HB*) 5.5 3.7 0.5 !peaknum  582
assign (segid  A and resid   38 and name   HN) (segid  A and resid   34 and name   HA) 3.5 1.7 0.5 !peaknum  589
assign (segid  A and resid   27 and name   HN) (segid  A and resid   26 and name   HB) 2.8 1.0 0.2 !peaknum  216
assign (segid  A and resid   27 and name   HN) (segid  A and resid   26 and name HD1#) 5.5 3.7 0.5 !peaknum  218
assign (segid  A and resid   46 and name   HN) (segid  A and resid   45 and name   HN) 2.8 1.0 0.2 !peaknum  380 372
assign (segid  A and resid   53 and name   HN) (segid  A and resid   54 and name  HB*) 5.5 3.7 0.5 !peaknum  463
assign (segid  A and resid   45 and name   HN) (segid  A and resid   41 and name  HB*) 5.5 3.7 0.5 !peaknum  376
assign (segid  A and resid   56 and name   HN) (segid  A and resid   53 and name   HA) 3.5 1.7 0.5 !peaknum  495
assign (segid  A and resid   27 and name   HN) (segid  A and resid   26 and name   HN) 2.8 1.0 0.2 !peaknum  220 615
assign (segid  A and resid   27 and name   HN) (segid  A and resid   24 and name  HB1) 5.5 3.7 0.5 !peaknum  592
assign (segid  A and resid   36 and name   HN) (segid  A and resid   35 and name  HG2) 2.8 1.0 0.2 !peaknum  297
assign (segid  A and resid   55 and name   HN) (segid  A and resid   56 and name   HN) 2.8 1.0 0.2 !peaknum  478 485
assign (segid  A and resid   33 and name   HN) (segid  A and resid   48 and name HG2#) 3.5 1.7 0.5 !peaknum  271
assign (segid  A and resid   58 and name   HN) (segid  A and resid   57 and name  HG1) 3.5 1.7 0.5 !peaknum  604
assign (segid  A and resid   51 and name   HN) (segid  A and resid   48 and name   HA) 2.8 1.0 0.2 !peaknum  435
assign (segid  A and resid   27 and name   HN) (segid  A and resid   28 and name   HN) 2.8 1.0 0.2 !peaknum  219 222
assign (segid  A and resid   49 and name   HN) (segid  A and resid   48 and name HD1#) 5.5 3.7 0.5 !peaknum  423
assign (segid  A and resid   45 and name   HN) (segid  A and resid   42 and name   HA) 2.8 1.0 0.2 !peaknum  374
assign (segid  A and resid   25 and name   HN) (segid  A and resid   26 and name   HN) 2.8 1.0 0.2 !peaknum  203 204
assign (segid  A and resid   33 and name   HN) (segid  A and resid   32 and name   HA) 3.5 1.7 0.5 !peaknum  267
assign (segid  A and resid   40 and name   HN) (segid  A and resid   41 and name   HN) 2.8 1.0 0.2 !peaknum  336 343
assign (segid  A and resid   23 and name   HN) (segid  A and resid   22 and name   HN) 2.8 1.0 0.2 !peaknum  170 167
assign (segid  A and resid   37 and name   HN) (segid  A and resid   40 and name   HN) 5.5 3.7 0.5 !peaknum  301
assign (segid  A and resid   30 and name   HN) (segid  A and resid   32 and name  HB1) 5.5 3.7 0.5 !peaknum  617
assign (segid  A and resid   53 and name   HN) (segid  A and resid   52 and name HD2#) 5.5 3.7 0.5 !peaknum  467
assign (segid  A and resid   34 and name   HN) (segid  A and resid   37 and name  HB*) 5.5 3.7 0.5 !peaknum  278
assign (segid  A and resid   40 and name   HN) (segid  A and resid   37 and name  HB*) 5.5 3.7 0.5 !peaknum  624
assign (segid  A and resid   31 and name   HN) (segid  A and resid   30 and name   HN) 2.8 1.0 0.2 !peaknum  249 239
assign (segid  A and resid   56 and name   HN) (segid  A and resid   26 and name HD1#) 5.5 3.7 0.5 !peaknum  493
assign (segid  A and resid   18 and name   HN) (segid  A and resid   17 and name  HG1) 2.8 1.0 0.2 !peaknum  147
assign (segid  A and resid   56 and name   HN) (segid  A and resid   54 and name  HB*) 5.5 3.7 0.5 !peaknum  600
assign (segid  A and resid   59 and name   HN) (segid  A and resid   57 and name  HB*) 5.5 3.7 0.5 !peaknum  608
assign (segid  A and resid   59 and name   HN) (segid  A and resid   26 and name HD1#) 5.5 3.7 0.5 !peaknum  522
assign (segid  A and resid    9 and name   HN) (segid  A and resid   10 and name  HD1) 2.8 1.0 0.2 !peaknum   82
assign (segid  A and resid   30 and name   HN) (segid  A and resid   27 and name   HA) 3.5 1.7 0.5 !peaknum  241
assign (segid  A and resid   32 and name   HN) (segid  A and resid   29 and name  HB2) 5.5 3.7 0.5 !peaknum  262
assign (segid  A and resid   24 and name   HN) (segid  A and resid   23 and name   HA) 3.5 1.7 0.5 !peaknum  189
assign (segid  A and resid   42 and name   HN) (segid  A and resid   40 and name  HB*) 5.5 3.7 0.5 !peaknum  354
assign (segid  A and resid   29 and name   HN) (segid  A and resid   28 and name   HA) 3.5 1.7 0.5 !peaknum  233
assign (segid  A and resid   51 and name   HN) (segid  A and resid   55 and name HD1#) 5.5 3.7 0.5 !peaknum  440
assign (segid  A and resid   35 and name   HN) (segid  A and resid   37 and name  HB*) 5.5 3.7 0.5 !peaknum  288
assign (segid  A and resid   46 and name   HN) (segid  A and resid   47 and name   HA) 5.5 3.7 0.5 !peaknum  597
assign (segid  A and resid   24 and name   HN) (segid  A and resid   23 and name   HN) 2.8 1.0 0.2 !peaknum  197 171
assign (segid  A and resid   34 and name   HN) (segid  A and resid   31 and name  HA1) 5.5 3.7 0.5 !peaknum  275
assign (segid  A and resid   31 and name   HN) (segid  A and resid   32 and name  HB1) 5.5 3.7 0.5 !peaknum  255
assign (segid  A and resid   29 and name   HN) (segid  A and resid   28 and name   HN) 2.8 1.0 0.2 !peaknum  231 221
assign (segid  A and resid   41 and name   HN) (segid  A and resid   39 and name  HB2) 3.5 1.7 0.5 !peaknum  346
assign (segid  A and resid   50 and name   HN) (segid  A and resid   46 and name   HA) 5.5 3.7 0.5 !peaknum  430
assign (segid  A and resid   53 and name   HN) (segid  A and resid   52 and name  HB*) 3.5 1.7 0.5 !peaknum  464
assign (segid  A and resid   23 and name   HN) (segid  A and resid   22 and name  HB*) 2.8 1.0 0.2 !peaknum  175
assign (segid  A and resid   44 and name   HN) (segid  A and resid   43 and name   HA) 3.5 1.7 0.5 !peaknum  363
assign (segid  A and resid   34 and name   HN) (segid  A and resid   35 and name   HA) 5.5 3.7 0.5 !peaknum  274
assign (segid  A and resid   35 and name   HN) (segid  A and resid   34 and name  HG*) 5.5 3.7 0.5 !peaknum  285
assign (segid  A and resid   39 and name   HN) (segid  A and resid   40 and name   HN) 2.8 1.0 0.2 !peaknum  320 335
assign (segid  A and resid   49 and name   HN) (segid  A and resid   46 and name  HB*) 5.5 3.7 0.5 !peaknum  422
assign (segid  A and resid   40 and name   HN) (segid  A and resid   39 and name   HA) 3.5 1.7 0.5 !peaknum  342
assign (segid  A and resid   29 and name   HN) (segid  A and resid   32 and name  HB1) 5.5 3.7 0.5 !peaknum  236
assign (segid  A and resid   40 and name   HN) (segid  A and resid   38 and name   HA) 3.5 1.7 0.5 !peaknum  337
assign (segid  A and resid   59 and name   HN) (segid  A and resid   58 and name   HN) 2.8 1.0 0.2 !peaknum  512 503
assign (segid  A and resid   53 and name   HN) (segid  A and resid   52 and name HD1#) 5.5 3.7 0.5 !peaknum  466
assign (segid  A and resid   12 and name   HN) (segid  A and resid   13 and name HG1#) 5.5 3.7 0.5 !peaknum  100
assign (segid  A and resid   39 and name   HN) (segid  A and resid   36 and name   HA) 3.5 1.7 0.5 !peaknum  323
assign (segid  A and resid   18 and name   HN) (segid  A and resid   17 and name  HG2) 2.8 1.0 0.2 !peaknum  146
assign (segid  A and resid   59 and name   HN) (segid  A and resid   60 and name   HN) 2.8 1.0 0.2 !peaknum  511 523
assign (segid  A and resid   49 and name   HN) (segid  A and resid   47 and name  HB*) 5.5 3.7 0.5 !peaknum  421
assign (segid  A and resid   53 and name   HN) (segid  A and resid   54 and name   HN) 2.8 1.0 0.2 !peaknum  458 468
assign (segid  A and resid   57 and name   HN) (segid  A and resid   56 and name  HG*) 3.5 1.7 0.5 !peaknum  501
assign (segid  A and resid   56 and name   HN) (segid  A and resid   57 and name  HB*) 5.5 3.7 0.5 !peaknum  494
assign (segid  A and resid   62 and name   HN) (segid  A and resid   60 and name   HA) 3.5 1.7 0.5 !peaknum  545
assign (segid  A and resid   49 and name   HE) (segid  A and resid   51 and name  HG1) 5.5 3.7 0.5 !peaknum  425
assign (segid  A and resid   60 and name   HN) (segid  A and resid   59 and name  HD*) 3.5 1.7 0.5 !peaknum  525
assign (segid  A and resid   31 and name   HN) (segid  A and resid   30 and name  HB*) 3.5 1.7 0.5 !peaknum  254
assign (segid  A and resid   57 and name   HN) (segid  A and resid   58 and name   HN) 2.8 1.0 0.2 !peaknum  496 504
assign (segid  A and resid   22 and name   HN) (segid  A and resid   21 and name   HN) 2.8 1.0 0.2 !peaknum  166 165
assign (segid  A and resid   47 and name   HN) (segid  A and resid   46 and name   HA) 3.5 1.7 0.5 !peaknum  396
assign (segid  A and resid   47 and name   HN) (segid  A and resid   48 and name   HN) 2.8 1.0 0.2 !peaknum  392 410
assign (segid  A and resid   42 and name   HN) (segid  A and resid   41 and name   HA) 3.5 1.7 0.5 !peaknum  351
assign (segid  A and resid   59 and name   HN) (segid  A and resid   56 and name   HA) 3.5 1.7 0.5 !peaknum  516
assign (segid  A and resid   27 and name   HN) (segid  A and resid   23 and name  HG1) 5.5 3.7 0.5 !peaknum  593
assign (segid  A and resid   42 and name   HN) (segid  A and resid   37 and name   HA) 2.8 1.0 0.2 !peaknum  353
assign (segid  A and resid   20 and name   HN) (segid  A and resid   23 and name  HB*) 2.8 1.0 0.2 !peaknum  155
assign (segid  A and resid   55 and name   HN) (segid  A and resid   54 and name   HN) 2.8 1.0 0.2 !peaknum  479
assign (segid  A and resid   15 and name   HN) (segid  A and resid   14 and name  HG1) 3.5 1.7 0.5 !peaknum  126
assign (segid  A and resid   26 and name   HN) (segid  A and resid   22 and name   HA) 3.5 1.7 0.5 !peaknum  205
assign (segid  A and resid   37 and name   HN) (segid  A and resid   45 and name  HB*) 3.5 1.7 0.5 !peaknum  307
assign (segid  A and resid   53 and name   HN) (segid  A and resid   54 and name   HA) 5.5 3.7 0.5 !peaknum  461
assign (segid  A and resid   56 and name   HN) (segid  A and resid   57 and name   HN) 2.8 1.0 0.2 !peaknum  486 497
assign (segid  A and resid   41 and name   HN) (segid  A and resid   40 and name   HA) 2.8 1.0 0.2 !peaknum  347
assign (segid  A and resid   54 and name   HN) (segid  A and resid   55 and name HD1#) 5.5 3.7 0.5 !peaknum  477
assign (segid  A and resid   60 and name   HN) (segid  A and resid   57 and name   HA) 5.5 3.7 0.5 !peaknum  527
assign (segid  A and resid   43 and name   HN) (segid  A and resid   42 and name   HA) 3.5 1.7 0.5 !peaknum  358
assign (segid  A and resid   21 and name   HN) (segid  A and resid   20 and name  HD*) 2.8 1.0 0.2 !peaknum  163
assign (segid  A and resid   36 and name   HN) (segid  A and resid   35 and name   HA) 3.5 1.7 0.5 !peaknum  294
assign (segid  A and resid   26 and name   HN) (segid  A and resid   29 and name  HB2) 5.5 3.7 0.5 !peaknum  207
assign (segid  A and resid   11 and name   HN) (segid  A and resid   10 and name  HG2) 2.8 1.0 0.2 !peaknum   93
assign (segid  A and resid   60 and name   HN) (segid  A and resid   59 and name  HB1) 2.8 1.0 0.2 !peaknum  530
assign (segid  A and resid   28 and name   HN) (segid  A and resid   27 and name   HA) 3.5 1.7 0.5 !peaknum  223
assign (segid  A and resid   38 and name   HN) (segid  A and resid   37 and name  HB*) 3.5 1.7 0.5 !peaknum  311
assign (segid  A and resid   56 and name   HN) (segid  A and resid   55 and name   HA) 3.5 1.7 0.5 !peaknum  487
assign (segid  A and resid   20 and name   HN) (segid  A and resid   19 and name   HA) 2.8 1.0 0.2 !peaknum  153
assign (segid  A and resid   47 and name   HN) (segid  A and resid   45 and name   HA) 5.5 3.7 0.5 !peaknum  397
assign (segid  A and resid   21 and name   HN) (segid  A and resid   20 and name  HB2) 3.5 1.7 0.5 !peaknum  162
assign (segid  A and resid   39 and name   HN) (segid  A and resid   38 and name   HN) 2.8 1.0 0.2 !peaknum  322 309
assign (segid  A and resid   57 and name   HN) (segid  A and resid   54 and name   HA) 3.5 1.7 0.5 !peaknum  498
assign (segid  A and resid   20 and name   HN) (segid  A and resid   21 and name  HB*) 5.5 3.7 0.5 !peaknum  158
assign (segid  A and resid   26 and name   HN) (segid  A and resid   22 and name  HB*) 5.5 3.7 0.5 !peaknum  208
assign (segid  A and resid   53 and name   HN) (segid  A and resid   50 and name   HA) 3.5 1.7 0.5 !peaknum  459
assign (segid  A and resid   22 and name   HN) (segid  A and resid   23 and name  HB*) 5.5 3.7 0.5 !peaknum  557
assign (segid  A and resid   47 and name   HN) (segid  A and resid   46 and name   HN) 2.8 1.0 0.2 !peaknum  391 381
assign (segid  A and resid   35 and name   HN) (segid  A and resid   34 and name   HA) 3.5 1.7 0.5 !peaknum  283
assign (segid  A and resid   33 and name   HN) (segid  A and resid   34 and name  HB*) 5.5 3.7 0.5 !peaknum  269
assign (segid  A and resid   48 and name   HN) (segid  A and resid   47 and name   HA) 3.5 1.7 0.5 !peaknum  411
assign (segid  A and resid   43 and name   HN) (segid  A and resid   44 and name  HG1) 5.5 3.7 0.5 !peaknum  360
assign (segid  A and resid   25 and name   HN) (segid  A and resid   24 and name  HB1) 2.8 1.0 0.2 !peaknum  116
assign (segid  A and resid   39 and name   HN) (segid  A and resid   40 and name   HG) 5.5 3.7 0.5 !peaknum  328
assign (segid  A and resid   27 and name   HN) (segid  A and resid   26 and name HG2#) 5.5 3.7 0.5 !peaknum  217
assign (segid  A and resid   54 and name   HN) (segid  A and resid   53 and name   HA) 3.5 1.7 0.5 !peaknum  470
assign (segid  A and resid   37 and name   HN) (segid  A and resid   35 and name   HA) 5.5 3.7 0.5 !peaknum  303
assign (segid  A and resid   31 and name   HN) (segid  A and resid   28 and name   HA) 3.5 1.7 0.5 !peaknum  251
assign (segid  A and resid   32 and name   HN) (segid  A and resid   31 and name   HN) 2.8 1.0 0.2 !peaknum  258 250
assign (segid  A and resid   21 and name   HN) (segid  A and resid   23 and name  HB*) 5.5 3.7 0.5 !peaknum  161
assign (segid  A and resid   47 and name   HN) (segid  A and resid   46 and name  HB*) 3.5 1.7 0.5 !peaknum  401
assign (segid  A and resid   62 and name   HN) (segid  A and resid   58 and name HD2#) 5.5 3.7 0.5 !peaknum  548
assign (segid  A and resid   46 and name   HN) (segid  A and resid   45 and name   HA) 3.5 1.7 0.5 !peaknum  390
assign (segid  A and resid   12 and name   HN) (segid  A and resid   11 and name  HB2) 2.8 1.0 0.2 !peaknum   99
assign (segid  A and resid   33 and name   HN) (segid  A and resid   32 and name HD1#) 5.5 3.7 0.5 !peaknum  272
assign (segid  A and resid   35 and name   HN) (segid  A and resid   32 and name HD1#) 5.5 3.7 0.5 !peaknum  289
assign (segid  A and resid   21 and name   HN) (segid  A and resid   20 and name   HA) 3.5 1.7 0.5 !peaknum  160
assign (segid  A and resid   11 and name   HN) (segid  A and resid   10 and name  HD1) 3.5 1.7 0.5 !peaknum   90
assign (segid  A and resid   25 and name   HN) (segid  A and resid   22 and name  HB*) 5.5 3.7 0.5 !peaknum  117
assign (segid  A and resid   28 and name   HN) (segid  A and resid   25 and name   HA) 3.5 1.7 0.5 !peaknum  224
assign (segid  A and resid   32 and name   HN) (segid  A and resid   28 and name  HB1) 5.5 3.7 0.5 !peaknum  261
assign (segid  A and resid   23 and name   HN) (segid  A and resid   20 and name  HD*) 5.5 3.7 0.5 !peaknum  176
assign (segid  A and resid   25 and name   HN) (segid  A and resid   55 and name HD2#) 5.5 3.7 0.5 !peaknum  120
assign (segid  A and resid   27 and name   HN) (segid  A and resid   24 and name   HA) 3.5 1.7 0.5 !peaknum  214
assign (segid  A and resid   22 and name   HN) (segid  A and resid   20 and name  HD*) 5.5 3.7 0.5 !peaknum  559
assign (segid  A and resid   46 and name   HN) (segid  A and resid   33 and name  HG1) 5.5 3.7 0.5 !peaknum  383
assign (segid  A and resid   60 and name   HN) (segid  A and resid   59 and name  HB2) 3.5 1.7 0.5 !peaknum  529
assign (segid  A and resid   23 and name   HN) (segid  A and resid   22 and name HD1#) 3.5 1.7 0.5 !peaknum  178
assign (segid  A and resid   37 and name   HN) (segid  A and resid   36 and name   HA) 3.5 1.7 0.5 !peaknum  302
assign (segid  A and resid   33 and name   HN) (segid  A and resid   32 and name  HB1) 2.8 1.0 0.2 !peaknum  270
assign (segid  A and resid   51 and name   HN) (segid  A and resid   50 and name  HB1) 2.8 1.0 0.2 !peaknum  436
assign (segid  A and resid   13 and name   HN) (segid  A and resid   10 and name   HA) 3.5 1.7 0.5 !peaknum  108
assign (segid  A and resid    9 and name   HN) (segid  A and resid    8 and name HD1#) 5.5 3.7 0.5 !peaknum   87
assign (segid  A and resid   48 and name   HN) (segid  A and resid   46 and name  HB*) 5.5 3.7 0.5 !peaknum  414
assign (segid  A and resid   28 and name   HN) (segid  A and resid   52 and name HD2#) 5.5 3.7 0.5 !peaknum  230
assign (segid  A and resid   60 and name   HN) (segid  A and resid   61 and name  HB*) 5.5 3.7 0.5 !peaknum  533
assign (segid  A and resid   15 and name   HN) (segid  A and resid   14 and name  HB2) 2.8 1.0 0.2 !peaknum  124
assign (segid  A and resid   39 and name   HN) (segid  A and resid   38 and name  HB2) 2.8 1.0 0.2 !peaknum  327
assign (segid  A and resid   39 and name   HN) (segid  A and resid   38 and name   HA) 3.5 1.7 0.5 !peaknum  324
assign (segid  A and resid   52 and name   HN) (segid  A and resid   51 and name  HB*) 2.8 1.0 0.2 !peaknum  452
assign (segid  A and resid   46 and name   HN) (segid  A and resid   45 and name  HB*) 2.8 1.0 0.2 !peaknum  387
assign (segid  A and resid   30 and name   HN) (segid  A and resid   52 and name   HG) 3.5 1.7 0.5 !peaknum  247
assign (segid  A and resid   32 and name   HN) (segid  A and resid   30 and name   HA) 5.5 3.7 0.5 !peaknum  260
assign (segid  A and resid   41 and name   HN) (segid  A and resid   40 and name   HG) 5.5 3.7 0.5 !peaknum  350
assign (segid  A and resid   11 and name   HN) (segid  A and resid   10 and name  HB2) 2.8 1.0 0.2 !peaknum   92
assign (segid  A and resid   55 and name   HN) (segid  A and resid   54 and name   HA) 3.5 1.7 0.5 !peaknum  480
assign (segid  A and resid   25 and name   HN) (segid  A and resid   22 and name   HA) 3.5 1.7 0.5 !peaknum  115
assign (segid  A and resid   29 and name   HN) (segid  A and resid   28 and name  HB1) 3.5 1.7 0.5 !peaknum  234
assign (segid  A and resid   16 and name   HN) (segid  A and resid   15 and name   HA) 2.8 1.0 0.2 !peaknum  129
assign (segid  A and resid   62 and name   HN) (segid  A and resid   63 and name   HN) 2.8 1.0 0.2 !peaknum  542 549
assign (segid  A and resid   52 and name   HN) (segid  A and resid   55 and name HD1#) 5.5 3.7 0.5 !peaknum  456
assign (segid  A and resid   51 and name   HN) (segid  A and resid   47 and name  HB*) 5.5 3.7 0.5 !peaknum  439
assign (segid  A and resid   60 and name   HN) (segid  A and resid   59 and name   HA) 3.5 1.7 0.5 !peaknum  526
assign (segid  A and resid   25 and name   HN) (segid  A and resid   21 and name   HA) 5.5 3.7 0.5 !peaknum  114
assign (segid  A and resid   59 and name   HN) (segid  A and resid   58 and name   HA) 3.5 1.7 0.5 !peaknum  515
assign (segid  A and resid   16 and name   HN) (segid  A and resid   15 and name  HG1) 3.5 1.7 0.5 !peaknum  131
assign (segid  A and resid   61 and name   HN) (segid  A and resid   60 and name   HA) 3.5 1.7 0.5 !peaknum  538
assign (segid  A and resid   39 and name   HN) (segid  A and resid   38 and name  HG*) 5.5 3.7 0.5 !peaknum  326
assign (segid  A and resid   61 and name   HN) (segid  A and resid   60 and name   HN) 2.8 1.0 0.2 !peaknum  536 524
assign (segid  A and resid   30 and name   HN) (segid  A and resid   52 and name HD2#) 3.5 1.7 0.5 !peaknum  248
assign (segid  A and resid   55 and name   HN) (segid  A and resid   54 and name  HB*) 2.8 1.0 0.2 !peaknum  481
assign (segid  A and resid   46 and name   HN) (segid  A and resid   47 and name  HB*) 5.5 3.7 0.5 !peaknum  385
assign (segid  A and resid   23 and name   HN) (segid  A and resid   22 and name   HA) 3.5 1.7 0.5 !peaknum  172
assign (segid  A and resid   48 and name   HN) (segid  A and resid   47 and name  HB*) 3.5 1.7 0.5 !peaknum  413
assign (segid  A and resid   12 and name   HN) (segid  A and resid   11 and name   HA) 3.5 1.7 0.5 !peaknum   97
assign (segid  A and resid   58 and name   HN) (segid  A and resid   55 and name  HB*) 5.5 3.7 0.5 !peaknum  509
assign (segid  A and resid   28 and name   HN) (segid  A and resid   27 and name  HB*) 3.5 1.7 0.5 !peaknum  226
assign (segid  A and resid   62 and name   HN) (segid  A and resid   61 and name   HA) 3.5 1.7 0.5 !peaknum  544
assign (segid  A and resid   56 and name   HN) (segid  A and resid   55 and name HD1#) 5.5 3.7 0.5 !peaknum  492
assign (segid  A and resid   35 and name   HN) (segid  A and resid   34 and name  HB*) 2.8 1.0 0.2 !peaknum  286
assign (segid  A and resid   31 and name   HN) (segid  A and resid   28 and name  HB1) 5.5 3.7 0.5 !peaknum  253
assign (segid  A and resid   59 and name   HN) (segid  A and resid   60 and name   HB) 5.5 3.7 0.5 !peaknum  519
assign (segid  A and resid   11 and name   HN) (segid  A and resid   10 and name  HB1) 3.5 1.7 0.5 !peaknum   94
assign (segid  A and resid   18 and name   HN) (segid  A and resid   17 and name   HA) 3.5 1.7 0.5 !peaknum  142
assign (segid  A and resid   58 and name   HN) (segid  A and resid   55 and name   HG) 5.5 3.7 0.5 !peaknum  508
assign (segid  A and resid   30 and name   HN) (segid  A and resid   28 and name  HB2) 5.5 3.7 0.5 !peaknum  244
assign (segid  A and resid   61 and name   HN) (segid  A and resid   60 and name   HB) 2.8 1.0 0.2 !peaknum  539
assign (segid  A and resid   54 and name   HN) (segid  A and resid   53 and name  HB*) 3.5 1.7 0.5 !peaknum  472
assign (segid  A and resid   24 and name   HN) (segid  A and resid   20 and name   HA) 3.5 1.7 0.5 !peaknum  188
assign (segid  A and resid   58 and name   HN) (segid  A and resid   57 and name  HB*) 3.5 1.7 0.5 !peaknum  506
assign (segid  A and resid   63 and name   HN) (segid  A and resid   62 and name   HA) 3.5 1.7 0.5 !peaknum  550
assign (segid  A and resid   38 and name   HN) (segid  A and resid   35 and name   HA) 3.5 1.7 0.5 !peaknum  315
assign (segid  A and resid   17 and name   HN) (segid  A and resid   16 and name   HA) 2.8 1.0 0.2 !peaknum  133
assign (segid  A and resid   58 and name   HN) (segid  A and resid   55 and name   HA) 3.5 1.7 0.5 !peaknum  505
assign (segid  A and resid   63 and name   HN) (segid  A and resid   62 and name  HB*) 2.8 1.0 0.2 !peaknum  553
assign (segid  A and resid   61 and name   HN) (segid  A and resid   60 and name HD1#) 5.5 3.7 0.5 !peaknum  541
assign (segid  A and resid   61 and name   HN) (segid  A and resid   59 and name   HA) 5.5 3.7 0.5 !peaknum  537
assign (segid  A and resid   24 and name   HN) (segid  A and resid   23 and name  HG2) 3.5 1.7 0.5 !peaknum  193
assign (segid  A and resid   31 and name   HN) (segid  A and resid   30 and name   HA) 3.5 1.7 0.5 !peaknum  252
assign (segid  A and resid   49 and name   HE) (segid  A and resid   47 and name   HN) 5.5 3.7 0.5 !peaknum  424
assign (segid  A and resid   15 and name   HN) (segid  A and resid   14 and name  HG2) 2.8 1.0 0.2 !peaknum  125
assign (segid  A and resid   11 and name   HN) (segid  A and resid   10 and name   HA) 3.5 1.7 0.5 !peaknum   89
assign (segid  A and resid   63 and name   HN) (segid  A and resid   60 and name   HA) 3.5 1.7 0.5 !peaknum  552
assign (segid  A and resid    9 and name   HN) (segid  A and resid    8 and name   HA) 2.8 1.0 0.2 !peaknum   81
assign (segid  B and resid   35 and name HE21) (segid  B and resid   32 and name HD1#) 3.5 1.7 0.5 !peaknum  576
assign (segid  B and resid   30 and name   HN) (segid  B and resid   28 and name   HN) 3.5 1.7 0.5 !peaknum  568
assign (segid  B and resid   12 and name   HN) (segid  B and resid   11 and name   HN) 3.5 1.7 0.5 !peaknum  102
assign (segid  B and resid   36 and name   HN) (segid  B and resid   34 and name   HN) 5.5 3.7 0.5 !peaknum  621 572
assign (segid  B and resid   38 and name   HN) (segid  B and resid   37 and name   HA) 3.5 1.7 0.5 !peaknum  645
assign (segid  B and resid   49 and name   HN) (segid  B and resid   48 and name   HN) 2.8 1.0 0.2 !peaknum  585 584
assign (segid  B and resid   46 and name   HN) (segid  B and resid   49 and name   HN) 5.5 3.7 0.5 !peaknum  583
assign (segid  B and resid   34 and name   HN) (segid  B and resid   33 and name   HN) 3.5 1.7 0.5 !peaknum  571 620
assign (segid  B and resid   40 and name   HN) (segid  B and resid   39 and name  HB2) 3.5 1.7 0.5 !peaknum  625
assign (segid  B and resid   49 and name   HN) (segid  B and resid   48 and name   HA) 3.5 1.7 0.5 !peaknum  642
assign (segid  B and resid   51 and name HE21) (segid  B and resid   55 and name HD1#) 3.5 1.7 0.5 !peaknum  443
assign (segid  B and resid   49 and name   HE) (segid  B and resid   47 and name  HB*) 5.5 3.7 0.5 !peaknum  586
assign (segid  B and resid   27 and name   HN) (segid  B and resid   26 and name   HA) 3.5 1.7 0.5 !peaknum  649
assign (segid  B and resid   24 and name HE21) (segid  B and resid   28 and name  HG2) 2.8 1.0 0.2 !peaknum  201
assign (segid  B and resid   16 and name   HN) (segid  B and resid   17 and name   HN) 2.8 1.0 0.2 !peaknum  562
assign (segid  B and resid   62 and name   HN) (segid  B and resid   60 and name   HN) 3.5 1.7 0.5 !peaknum  609
assign (segid  B and resid   36 and name   HN) (segid  B and resid   35 and name  HG1) 2.8 1.0 0.2 !peaknum  298
assign (segid  B and resid   29 and name   HN) (segid  B and resid   31 and name   HN) 5.5 3.7 0.5 !peaknum  566
assign (segid  B and resid   58 and name   HN) (segid  B and resid   59 and name  HB2) 5.5 3.7 0.5 !peaknum  606
assign (segid  B and resid   39 and name HD22) (segid  B and resid   38 and name  HB2) 5.5 3.7 0.5 !peaknum  580
assign (segid  B and resid   39 and name HD21) (segid  B and resid   41 and name  HG2) 5.5 3.7 0.5 !peaknum  329
assign (segid  B and resid   27 and name   HN) (segid  B and resid   23 and name   HA) 3.5 1.7 0.5 !peaknum  648
assign (segid  B and resid   29 and name   HN) (segid  B and resid   32 and name   HN) 5.5 3.7 0.5 !peaknum  565
assign (segid  B and resid   36 and name   HN) (segid  B and resid   45 and name  HB*) 3.5 1.7 0.5 !peaknum  308
assign (segid  B and resid   53 and name   HN) (segid  B and resid   52 and name   HA) 3.5 1.7 0.5 !peaknum  640
assign (segid  B and resid   51 and name HE22) (segid  B and resid   32 and name HD2#) 5.5 3.7 0.5 !peaknum  444
assign (segid  B and resid   63 and name   HN) (segid  B and resid   19 and name  HG1) 2.8 1.0 0.2 !peaknum  636
assign (segid  B and resid   29 and name   HN) (segid  B and resid   30 and name   HN) 2.8 1.0 0.2 !peaknum  564 567
assign (segid  B and resid   37 and name   HN) (segid  B and resid   40 and name   HA) 5.5 3.7 0.5 !peaknum  595
assign (segid  B and resid   62 and name   HN) (segid  B and resid   60 and name   HB) 5.5 3.7 0.5 !peaknum  546
assign (segid  B and resid   43 and name   HN) (segid  B and resid   44 and name   HN) 2.8 1.0 0.2 !peaknum  356 357
assign (segid  B and resid   31 and name   HN) (segid  B and resid   30 and name  HG2) 5.5 3.7 0.5 !peaknum  618
assign (segid  B and resid   45 and name   HN) (segid  B and resid   41 and name   HA) 5.5 3.7 0.5 !peaknum  629
assign (segid  B and resid   12 and name   HN) (segid  B and resid   13 and name   HB) 3.5 1.7 0.5 !peaknum  610
assign (segid  B and resid   57 and name   HN) (segid  B and resid   53 and name   HA) 5.5 3.7 0.5 !peaknum  638
assign (segid  B and resid   44 and name   HN) (segid  B and resid   45 and name   HN) 2.8 1.0 0.2 !peaknum  370 373
assign (segid  B and resid   40 and name   HN) (segid  B and resid   36 and name   HA) 5.5 3.7 0.5 !peaknum  644
assign (segid  B and resid   54 and name   HN) (segid  B and resid   50 and name   HA) 5.5 3.7 0.5 !peaknum  469
assign (segid  B and resid   29 and name   HN) (segid  B and resid   52 and name   HG) 5.5 3.7 0.5 !peaknum  237
assign (segid  B and resid   55 and name   HN) (segid  B and resid   52 and name   HA) 3.5 1.7 0.5 !peaknum  639
assign (segid  B and resid   41 and name   HN) (segid  B and resid   37 and name   HA) 3.5 1.7 0.5 !peaknum  345
assign (segid  B and resid   48 and name   HN) (segid  B and resid   45 and name   HA) 3.5 1.7 0.5 !peaknum  643
assign (segid  B and resid   13 and name   HN) (segid  B and resid   14 and name  HD2) 2.8 1.0 0.2 !peaknum  109
assign (segid  B and resid   34 and name   HN) (segid  B and resid   35 and name   HN) 2.8 1.0 0.2 !peaknum  280 282
assign (segid  B and resid   13 and name   HN) (segid  B and resid   14 and name  HD1) 2.8 1.0 0.2 !peaknum  110
assign (segid  B and resid   44 and name   HN) (segid  B and resid   43 and name  HG2) 2.8 1.0 0.2 !peaknum  369
assign (segid  B and resid   52 and name   HN) (segid  B and resid   51 and name   HN) 2.8 1.0 0.2 !peaknum  448 432
assign (segid  B and resid   43 and name   HN) (segid  B and resid   46 and name  HB*) 5.5 3.7 0.5 !peaknum  628
assign (segid  B and resid   49 and name   HN) (segid  B and resid   50 and name   HN) 2.8 1.0 0.2 !peaknum  419
assign (segid  B and resid   42 and name   HN) (segid  B and resid   45 and name  HB*) 3.5 1.7 0.5 !peaknum  581
assign (segid  B and resid   49 and name   HN) (segid  B and resid   46 and name   HA) 3.5 1.7 0.5 !peaknum  641
assign (segid  B and resid   38 and name   HN) (segid  B and resid   37 and name   HN) 2.8 1.0 0.2 !peaknum  310 577
assign (segid  B and resid   30 and name   HN) (segid  B and resid   32 and name   HN) 3.5 1.7 0.5 !peaknum  240
assign (segid  B and resid   36 and name   HN) (segid  B and resid   35 and name   HN) 3.5 1.7 0.5 !peaknum  291 281
assign (segid  B and resid   47 and name   HN) (segid  B and resid   45 and name  HB*) 5.5 3.7 0.5 !peaknum  633
assign (segid  B and resid   30 and name   HN) (segid  B and resid   28 and name   HA) 5.5 3.7 0.5 !peaknum  616
assign (segid  B and resid   45 and name   HN) (segid  B and resid   46 and name  HB*) 5.5 3.7 0.5 !peaknum  378
assign (segid  B and resid   26 and name   HN) (segid  B and resid   23 and name   HA) 3.5 1.7 0.5 !peaknum  591
assign (segid  B and resid   34 and name   HN) (segid  B and resid   30 and name  HG2) 5.5 3.7 0.5 !peaknum  594
assign (segid  B and resid   36 and name   HN) (segid  B and resid   37 and name  HB*) 5.5 3.7 0.5 !peaknum  299
assign (segid  B and resid   57 and name   HN) (segid  B and resid   56 and name   HA) 3.5 1.7 0.5 !peaknum  637
assign (segid  B and resid   40 and name   HN) (segid  B and resid   37 and name   HA) 3.5 1.7 0.5 !peaknum  623
assign (segid  B and resid   57 and name   HN) (segid  B and resid   56 and name  HD*) 3.5 1.7 0.5 !peaknum  603
assign (segid  B and resid   17 and name   HN) (segid  B and resid   18 and name   HN) 2.8 1.0 0.2 !peaknum  140 152
assign (segid  B and resid   49 and name   HN) (segid  B and resid   33 and name  HG2) 3.5 1.7 0.5 !peaknum  635
assign (segid  B and resid   31 and name   HN) (segid  B and resid   27 and name   HA) 5.5 3.7 0.5 !peaknum  646
assign (segid  B and resid   49 and name   HN) (segid  B and resid   45 and name   HA) 5.5 3.7 0.5 !peaknum  634
assign (segid  B and resid   52 and name   HN) (segid  B and resid   53 and name   HN) 2.8 1.0 0.2 !peaknum  449 457
assign (segid  B and resid   33 and name   HN) (segid  B and resid   32 and name   HN) 2.8 1.0 0.2 !peaknum  569 257
assign (segid  B and resid   45 and name   HN) (segid  B and resid   44 and name  HG1) 2.8 1.0 0.2 !peaknum  377
assign (segid  B and resid   46 and name   HN) (segid  B and resid   43 and name  HG2) 5.5 3.7 0.5 !peaknum  384
assign (segid  B and resid   38 and name   HN) (segid  B and resid   40 and name   HN) 3.5 1.7 0.5 !peaknum  590
assign (segid  B and resid   51 and name   HN) (segid  B and resid   50 and name   HA) 3.5 1.7 0.5 !peaknum  433
assign (segid  B and resid   12 and name   HN) (segid  B and resid   13 and name   HA) 5.5 3.7 0.5 !peaknum  611
assign (segid  B and resid   30 and name   HN) (segid  B and resid   29 and name   HA) 3.5 1.7 0.5 !peaknum  647
assign (segid  B and resid   57 and name   HN) (segid  B and resid   55 and name  HB*) 5.5 3.7 0.5 !peaknum  602
assign (segid  B and resid   51 and name   HN) (segid  B and resid   50 and name   HN) 2.8 1.0 0.2 !peaknum  431
assign (segid  B and resid   12 and name HD21) (segid  B and resid   13 and name   HB) 5.5 3.7 0.5 !peaknum  104
assign (segid  B and resid   25 and name   HN) (segid  B and resid   24 and name   HN) 2.8 1.0 0.2 !peaknum  202 196
assign (segid  B and resid   33 and name   HN) (segid  B and resid   32 and name  HB2) 3.5 1.7 0.5 !peaknum  570
assign (segid  B and resid   42 and name   HN) (segid  B and resid   46 and name  HB*) 5.5 3.7 0.5 !peaknum  582
assign (segid  B and resid   38 and name   HN) (segid  B and resid   34 and name   HA) 3.5 1.7 0.5 !peaknum  589
assign (segid  B and resid   27 and name   HN) (segid  B and resid   26 and name   HB) 2.8 1.0 0.2 !peaknum  216
assign (segid  B and resid   27 and name   HN) (segid  B and resid   26 and name HD1#) 5.5 3.7 0.5 !peaknum  218
assign (segid  B and resid   46 and name   HN) (segid  B and resid   45 and name   HN) 2.8 1.0 0.2 !peaknum  380 372
assign (segid  B and resid   53 and name   HN) (segid  B and resid   54 and name  HB*) 5.5 3.7 0.5 !peaknum  463
assign (segid  B and resid   45 and name   HN) (segid  B and resid   41 and name  HB*) 5.5 3.7 0.5 !peaknum  376
assign (segid  B and resid   56 and name   HN) (segid  B and resid   53 and name   HA) 3.5 1.7 0.5 !peaknum  495
assign (segid  B and resid   27 and name   HN) (segid  B and resid   26 and name   HN) 2.8 1.0 0.2 !peaknum  220 615
assign (segid  B and resid   27 and name   HN) (segid  B and resid   24 and name  HB1) 5.5 3.7 0.5 !peaknum  592
assign (segid  B and resid   36 and name   HN) (segid  B and resid   35 and name  HG2) 2.8 1.0 0.2 !peaknum  297
assign (segid  B and resid   55 and name   HN) (segid  B and resid   56 and name   HN) 2.8 1.0 0.2 !peaknum  478 485
assign (segid  B and resid   33 and name   HN) (segid  B and resid   48 and name HG2#) 3.5 1.7 0.5 !peaknum  271
assign (segid  B and resid   58 and name   HN) (segid  B and resid   57 and name  HG1) 3.5 1.7 0.5 !peaknum  604
assign (segid  B and resid   51 and name   HN) (segid  B and resid   48 and name   HA) 2.8 1.0 0.2 !peaknum  435
assign (segid  B and resid   27 and name   HN) (segid  B and resid   28 and name   HN) 2.8 1.0 0.2 !peaknum  219 222
assign (segid  B and resid   49 and name   HN) (segid  B and resid   48 and name HD1#) 5.5 3.7 0.5 !peaknum  423
assign (segid  B and resid   45 and name   HN) (segid  B and resid   42 and name   HA) 2.8 1.0 0.2 !peaknum  374
assign (segid  B and resid   25 and name   HN) (segid  B and resid   26 and name   HN) 2.8 1.0 0.2 !peaknum  203 204
assign (segid  B and resid   33 and name   HN) (segid  B and resid   32 and name   HA) 3.5 1.7 0.5 !peaknum  267
assign (segid  B and resid   40 and name   HN) (segid  B and resid   41 and name   HN) 2.8 1.0 0.2 !peaknum  336 343
assign (segid  B and resid   23 and name   HN) (segid  B and resid   22 and name   HN) 2.8 1.0 0.2 !peaknum  170 167
assign (segid  B and resid   37 and name   HN) (segid  B and resid   40 and name   HN) 5.5 3.7 0.5 !peaknum  301
assign (segid  B and resid   30 and name   HN) (segid  B and resid   32 and name  HB1) 5.5 3.7 0.5 !peaknum  617
assign (segid  B and resid   53 and name   HN) (segid  B and resid   52 and name HD2#) 5.5 3.7 0.5 !peaknum  467
assign (segid  B and resid   34 and name   HN) (segid  B and resid   37 and name  HB*) 5.5 3.7 0.5 !peaknum  278
assign (segid  B and resid   40 and name   HN) (segid  B and resid   37 and name  HB*) 5.5 3.7 0.5 !peaknum  624
assign (segid  B and resid   31 and name   HN) (segid  B and resid   30 and name   HN) 2.8 1.0 0.2 !peaknum  249 239
assign (segid  B and resid   56 and name   HN) (segid  B and resid   26 and name HD1#) 5.5 3.7 0.5 !peaknum  493
assign (segid  B and resid   18 and name   HN) (segid  B and resid   17 and name  HG1) 2.8 1.0 0.2 !peaknum  147
assign (segid  B and resid   56 and name   HN) (segid  B and resid   54 and name  HB*) 5.5 3.7 0.5 !peaknum  600
assign (segid  B and resid   59 and name   HN) (segid  B and resid   57 and name  HB*) 5.5 3.7 0.5 !peaknum  608
assign (segid  B and resid   59 and name   HN) (segid  B and resid   26 and name HD1#) 5.5 3.7 0.5 !peaknum  522
assign (segid  B and resid    9 and name   HN) (segid  B and resid   10 and name  HD1) 2.8 1.0 0.2 !peaknum   82
assign (segid  B and resid   30 and name   HN) (segid  B and resid   27 and name   HA) 3.5 1.7 0.5 !peaknum  241
assign (segid  B and resid   32 and name   HN) (segid  B and resid   29 and name  HB2) 5.5 3.7 0.5 !peaknum  262
assign (segid  B and resid   24 and name   HN) (segid  B and resid   23 and name   HA) 3.5 1.7 0.5 !peaknum  189
assign (segid  B and resid   42 and name   HN) (segid  B and resid   40 and name  HB*) 5.5 3.7 0.5 !peaknum  354
assign (segid  B and resid   29 and name   HN) (segid  B and resid   28 and name   HA) 3.5 1.7 0.5 !peaknum  233
assign (segid  B and resid   51 and name   HN) (segid  B and resid   55 and name HD1#) 5.5 3.7 0.5 !peaknum  440
assign (segid  B and resid   35 and name   HN) (segid  B and resid   37 and name  HB*) 5.5 3.7 0.5 !peaknum  288
assign (segid  B and resid   46 and name   HN) (segid  B and resid   47 and name   HA) 5.5 3.7 0.5 !peaknum  597
assign (segid  B and resid   24 and name   HN) (segid  B and resid   23 and name   HN) 2.8 1.0 0.2 !peaknum  197 171
assign (segid  B and resid   34 and name   HN) (segid  B and resid   31 and name  HA1) 5.5 3.7 0.5 !peaknum  275
assign (segid  B and resid   31 and name   HN) (segid  B and resid   32 and name  HB1) 5.5 3.7 0.5 !peaknum  255
assign (segid  B and resid   29 and name   HN) (segid  B and resid   28 and name   HN) 2.8 1.0 0.2 !peaknum  231 221
assign (segid  B and resid   41 and name   HN) (segid  B and resid   39 and name  HB2) 3.5 1.7 0.5 !peaknum  346
assign (segid  B and resid   50 and name   HN) (segid  B and resid   46 and name   HA) 5.5 3.7 0.5 !peaknum  430
assign (segid  B and resid   53 and name   HN) (segid  B and resid   52 and name  HB*) 3.5 1.7 0.5 !peaknum  464
assign (segid  B and resid   23 and name   HN) (segid  B and resid   22 and name  HB*) 2.8 1.0 0.2 !peaknum  175
assign (segid  B and resid   44 and name   HN) (segid  B and resid   43 and name   HA) 3.5 1.7 0.5 !peaknum  363
assign (segid  B and resid   34 and name   HN) (segid  B and resid   35 and name   HA) 5.5 3.7 0.5 !peaknum  274
assign (segid  B and resid   35 and name   HN) (segid  B and resid   34 and name  HG*) 5.5 3.7 0.5 !peaknum  285
assign (segid  B and resid   39 and name   HN) (segid  B and resid   40 and name   HN) 2.8 1.0 0.2 !peaknum  320 335
assign (segid  B and resid   49 and name   HN) (segid  B and resid   46 and name  HB*) 5.5 3.7 0.5 !peaknum  422
assign (segid  B and resid   40 and name   HN) (segid  B and resid   39 and name   HA) 3.5 1.7 0.5 !peaknum  342
assign (segid  B and resid   29 and name   HN) (segid  B and resid   32 and name  HB1) 5.5 3.7 0.5 !peaknum  236
assign (segid  B and resid   40 and name   HN) (segid  B and resid   38 and name   HA) 3.5 1.7 0.5 !peaknum  337
assign (segid  B and resid   59 and name   HN) (segid  B and resid   58 and name   HN) 2.8 1.0 0.2 !peaknum  512 503
assign (segid  B and resid   53 and name   HN) (segid  B and resid   52 and name HD1#) 5.5 3.7 0.5 !peaknum  466
assign (segid  B and resid   12 and name   HN) (segid  B and resid   13 and name HG1#) 5.5 3.7 0.5 !peaknum  100
assign (segid  B and resid   39 and name   HN) (segid  B and resid   36 and name   HA) 3.5 1.7 0.5 !peaknum  323
assign (segid  B and resid   18 and name   HN) (segid  B and resid   17 and name  HG2) 2.8 1.0 0.2 !peaknum  146
assign (segid  B and resid   59 and name   HN) (segid  B and resid   60 and name   HN) 2.8 1.0 0.2 !peaknum  511 523
assign (segid  B and resid   49 and name   HN) (segid  B and resid   47 and name  HB*) 5.5 3.7 0.5 !peaknum  421
assign (segid  B and resid   53 and name   HN) (segid  B and resid   54 and name   HN) 2.8 1.0 0.2 !peaknum  458 468
assign (segid  B and resid   57 and name   HN) (segid  B and resid   56 and name  HG*) 3.5 1.7 0.5 !peaknum  501
assign (segid  B and resid   56 and name   HN) (segid  B and resid   57 and name  HB*) 5.5 3.7 0.5 !peaknum  494
assign (segid  B and resid   62 and name   HN) (segid  B and resid   60 and name   HA) 3.5 1.7 0.5 !peaknum  545
assign (segid  B and resid   49 and name   HE) (segid  B and resid   51 and name  HG1) 5.5 3.7 0.5 !peaknum  425
assign (segid  B and resid   60 and name   HN) (segid  B and resid   59 and name  HD*) 3.5 1.7 0.5 !peaknum  525
assign (segid  B and resid   31 and name   HN) (segid  B and resid   30 and name  HB*) 3.5 1.7 0.5 !peaknum  254
assign (segid  B and resid   57 and name   HN) (segid  B and resid   58 and name   HN) 2.8 1.0 0.2 !peaknum  496 504
assign (segid  B and resid   22 and name   HN) (segid  B and resid   21 and name   HN) 2.8 1.0 0.2 !peaknum  166 165
assign (segid  B and resid   47 and name   HN) (segid  B and resid   46 and name   HA) 3.5 1.7 0.5 !peaknum  396
assign (segid  B and resid   47 and name   HN) (segid  B and resid   48 and name   HN) 2.8 1.0 0.2 !peaknum  392 410
assign (segid  B and resid   42 and name   HN) (segid  B and resid   41 and name   HA) 3.5 1.7 0.5 !peaknum  351
assign (segid  B and resid   59 and name   HN) (segid  B and resid   56 and name   HA) 3.5 1.7 0.5 !peaknum  516
assign (segid  B and resid   27 and name   HN) (segid  B and resid   23 and name  HG1) 5.5 3.7 0.5 !peaknum  593
assign (segid  B and resid   42 and name   HN) (segid  B and resid   37 and name   HA) 2.8 1.0 0.2 !peaknum  353
assign (segid  B and resid   20 and name   HN) (segid  B and resid   23 and name  HB*) 2.8 1.0 0.2 !peaknum  155
assign (segid  B and resid   55 and name   HN) (segid  B and resid   54 and name   HN) 2.8 1.0 0.2 !peaknum  479
assign (segid  B and resid   15 and name   HN) (segid  B and resid   14 and name  HG1) 3.5 1.7 0.5 !peaknum  126
assign (segid  B and resid   26 and name   HN) (segid  B and resid   22 and name   HA) 3.5 1.7 0.5 !peaknum  205
assign (segid  B and resid   37 and name   HN) (segid  B and resid   45 and name  HB*) 3.5 1.7 0.5 !peaknum  307
assign (segid  B and resid   53 and name   HN) (segid  B and resid   54 and name   HA) 5.5 3.7 0.5 !peaknum  461
assign (segid  B and resid   56 and name   HN) (segid  B and resid   57 and name   HN) 2.8 1.0 0.2 !peaknum  486 497
assign (segid  B and resid   41 and name   HN) (segid  B and resid   40 and name   HA) 2.8 1.0 0.2 !peaknum  347
assign (segid  B and resid   54 and name   HN) (segid  B and resid   55 and name HD1#) 5.5 3.7 0.5 !peaknum  477
assign (segid  B and resid   60 and name   HN) (segid  B and resid   57 and name   HA) 5.5 3.7 0.5 !peaknum  527
assign (segid  B and resid   43 and name   HN) (segid  B and resid   42 and name   HA) 3.5 1.7 0.5 !peaknum  358
assign (segid  B and resid   21 and name   HN) (segid  B and resid   20 and name  HD*) 2.8 1.0 0.2 !peaknum  163
assign (segid  B and resid   36 and name   HN) (segid  B and resid   35 and name   HA) 3.5 1.7 0.5 !peaknum  294
assign (segid  B and resid   26 and name   HN) (segid  B and resid   29 and name  HB2) 5.5 3.7 0.5 !peaknum  207
assign (segid  B and resid   11 and name   HN) (segid  B and resid   10 and name  HG2) 2.8 1.0 0.2 !peaknum   93
assign (segid  B and resid   60 and name   HN) (segid  B and resid   59 and name  HB1) 2.8 1.0 0.2 !peaknum  530
assign (segid  B and resid   28 and name   HN) (segid  B and resid   27 and name   HA) 3.5 1.7 0.5 !peaknum  223
assign (segid  B and resid   38 and name   HN) (segid  B and resid   37 and name  HB*) 3.5 1.7 0.5 !peaknum  311
assign (segid  B and resid   56 and name   HN) (segid  B and resid   55 and name   HA) 3.5 1.7 0.5 !peaknum  487
assign (segid  B and resid   20 and name   HN) (segid  B and resid   19 and name   HA) 2.8 1.0 0.2 !peaknum  153
assign (segid  B and resid   47 and name   HN) (segid  B and resid   45 and name   HA) 5.5 3.7 0.5 !peaknum  397
assign (segid  B and resid   21 and name   HN) (segid  B and resid   20 and name  HB2) 3.5 1.7 0.5 !peaknum  162
assign (segid  B and resid   39 and name   HN) (segid  B and resid   38 and name   HN) 2.8 1.0 0.2 !peaknum  322 309
assign (segid  B and resid   57 and name   HN) (segid  B and resid   54 and name   HA) 3.5 1.7 0.5 !peaknum  498
assign (segid  B and resid   20 and name   HN) (segid  B and resid   21 and name  HB*) 5.5 3.7 0.5 !peaknum  158
assign (segid  B and resid   26 and name   HN) (segid  B and resid   22 and name  HB*) 5.5 3.7 0.5 !peaknum  208
assign (segid  B and resid   53 and name   HN) (segid  B and resid   50 and name   HA) 3.5 1.7 0.5 !peaknum  459
assign (segid  B and resid   22 and name   HN) (segid  B and resid   23 and name  HB*) 5.5 3.7 0.5 !peaknum  557
assign (segid  B and resid   47 and name   HN) (segid  B and resid   46 and name   HN) 2.8 1.0 0.2 !peaknum  391 381
assign (segid  B and resid   35 and name   HN) (segid  B and resid   34 and name   HA) 3.5 1.7 0.5 !peaknum  283
assign (segid  B and resid   33 and name   HN) (segid  B and resid   34 and name  HB*) 5.5 3.7 0.5 !peaknum  269
assign (segid  B and resid   48 and name   HN) (segid  B and resid   47 and name   HA) 3.5 1.7 0.5 !peaknum  411
assign (segid  B and resid   43 and name   HN) (segid  B and resid   44 and name  HG1) 5.5 3.7 0.5 !peaknum  360
assign (segid  B and resid   25 and name   HN) (segid  B and resid   24 and name  HB1) 2.8 1.0 0.2 !peaknum  116
assign (segid  B and resid   39 and name   HN) (segid  B and resid   40 and name   HG) 5.5 3.7 0.5 !peaknum  328
assign (segid  B and resid   27 and name   HN) (segid  B and resid   26 and name HG2#) 5.5 3.7 0.5 !peaknum  217
assign (segid  B and resid   54 and name   HN) (segid  B and resid   53 and name   HA) 3.5 1.7 0.5 !peaknum  470
assign (segid  B and resid   37 and name   HN) (segid  B and resid   35 and name   HA) 5.5 3.7 0.5 !peaknum  303
assign (segid  B and resid   31 and name   HN) (segid  B and resid   28 and name   HA) 3.5 1.7 0.5 !peaknum  251
assign (segid  B and resid   32 and name   HN) (segid  B and resid   31 and name   HN) 2.8 1.0 0.2 !peaknum  258 250
assign (segid  B and resid   21 and name   HN) (segid  B and resid   23 and name  HB*) 5.5 3.7 0.5 !peaknum  161
assign (segid  B and resid   47 and name   HN) (segid  B and resid   46 and name  HB*) 3.5 1.7 0.5 !peaknum  401
assign (segid  B and resid   62 and name   HN) (segid  B and resid   58 and name HD2#) 5.5 3.7 0.5 !peaknum  548
assign (segid  B and resid   46 and name   HN) (segid  B and resid   45 and name   HA) 3.5 1.7 0.5 !peaknum  390
assign (segid  B and resid   12 and name   HN) (segid  B and resid   11 and name  HB2) 2.8 1.0 0.2 !peaknum   99
assign (segid  B and resid   33 and name   HN) (segid  B and resid   32 and name HD1#) 5.5 3.7 0.5 !peaknum  272
assign (segid  B and resid   35 and name   HN) (segid  B and resid   32 and name HD1#) 5.5 3.7 0.5 !peaknum  289
assign (segid  B and resid   21 and name   HN) (segid  B and resid   20 and name   HA) 3.5 1.7 0.5 !peaknum  160
assign (segid  B and resid   11 and name   HN) (segid  B and resid   10 and name  HD1) 3.5 1.7 0.5 !peaknum   90
assign (segid  B and resid   25 and name   HN) (segid  B and resid   22 and name  HB*) 5.5 3.7 0.5 !peaknum  117
assign (segid  B and resid   28 and name   HN) (segid  B and resid   25 and name   HA) 3.5 1.7 0.5 !peaknum  224
assign (segid  B and resid   32 and name   HN) (segid  B and resid   28 and name  HB1) 5.5 3.7 0.5 !peaknum  261
assign (segid  B and resid   23 and name   HN) (segid  B and resid   20 and name  HD*) 5.5 3.7 0.5 !peaknum  176
assign (segid  B and resid   25 and name   HN) (segid  B and resid   55 and name HD2#) 5.5 3.7 0.5 !peaknum  120
assign (segid  B and resid   27 and name   HN) (segid  B and resid   24 and name   HA) 3.5 1.7 0.5 !peaknum  214
assign (segid  B and resid   22 and name   HN) (segid  B and resid   20 and name  HD*) 5.5 3.7 0.5 !peaknum  559
assign (segid  B and resid   46 and name   HN) (segid  B and resid   33 and name  HG1) 5.5 3.7 0.5 !peaknum  383
assign (segid  B and resid   60 and name   HN) (segid  B and resid   59 and name  HB2) 3.5 1.7 0.5 !peaknum  529
assign (segid  B and resid   23 and name   HN) (segid  B and resid   22 and name HD1#) 3.5 1.7 0.5 !peaknum  178
assign (segid  B and resid   37 and name   HN) (segid  B and resid   36 and name   HA) 3.5 1.7 0.5 !peaknum  302
assign (segid  B and resid   33 and name   HN) (segid  B and resid   32 and name  HB1) 2.8 1.0 0.2 !peaknum  270
assign (segid  B and resid   51 and name   HN) (segid  B and resid   50 and name  HB1) 2.8 1.0 0.2 !peaknum  436
assign (segid  B and resid   13 and name   HN) (segid  B and resid   10 and name   HA) 3.5 1.7 0.5 !peaknum  108
assign (segid  B and resid    9 and name   HN) (segid  B and resid    8 and name HD1#) 5.5 3.7 0.5 !peaknum   87
assign (segid  B and resid   48 and name   HN) (segid  B and resid   46 and name  HB*) 5.5 3.7 0.5 !peaknum  414
assign (segid  B and resid   28 and name   HN) (segid  B and resid   52 and name HD2#) 5.5 3.7 0.5 !peaknum  230
assign (segid  B and resid   60 and name   HN) (segid  B and resid   61 and name  HB*) 5.5 3.7 0.5 !peaknum  533
assign (segid  B and resid   15 and name   HN) (segid  B and resid   14 and name  HB2) 2.8 1.0 0.2 !peaknum  124
assign (segid  B and resid   39 and name   HN) (segid  B and resid   38 and name  HB2) 2.8 1.0 0.2 !peaknum  327
assign (segid  B and resid   39 and name   HN) (segid  B and resid   38 and name   HA) 3.5 1.7 0.5 !peaknum  324
assign (segid  B and resid   52 and name   HN) (segid  B and resid   51 and name  HB*) 2.8 1.0 0.2 !peaknum  452
assign (segid  B and resid   46 and name   HN) (segid  B and resid   45 and name  HB*) 2.8 1.0 0.2 !peaknum  387
assign (segid  B and resid   30 and name   HN) (segid  B and resid   52 and name   HG) 3.5 1.7 0.5 !peaknum  247
assign (segid  B and resid   32 and name   HN) (segid  B and resid   30 and name   HA) 5.5 3.7 0.5 !peaknum  260
assign (segid  B and resid   41 and name   HN) (segid  B and resid   40 and name   HG) 5.5 3.7 0.5 !peaknum  350
assign (segid  B and resid   11 and name   HN) (segid  B and resid   10 and name  HB2) 2.8 1.0 0.2 !peaknum   92
assign (segid  B and resid   55 and name   HN) (segid  B and resid   54 and name   HA) 3.5 1.7 0.5 !peaknum  480
assign (segid  B and resid   25 and name   HN) (segid  B and resid   22 and name   HA) 3.5 1.7 0.5 !peaknum  115
assign (segid  B and resid   29 and name   HN) (segid  B and resid   28 and name  HB1) 3.5 1.7 0.5 !peaknum  234
assign (segid  B and resid   16 and name   HN) (segid  B and resid   15 and name   HA) 2.8 1.0 0.2 !peaknum  129
assign (segid  B and resid   62 and name   HN) (segid  B and resid   63 and name   HN) 2.8 1.0 0.2 !peaknum  542 549
assign (segid  B and resid   52 and name   HN) (segid  B and resid   55 and name HD1#) 5.5 3.7 0.5 !peaknum  456
assign (segid  B and resid   51 and name   HN) (segid  B and resid   47 and name  HB*) 5.5 3.7 0.5 !peaknum  439
assign (segid  B and resid   60 and name   HN) (segid  B and resid   59 and name   HA) 3.5 1.7 0.5 !peaknum  526
assign (segid  B and resid   25 and name   HN) (segid  B and resid   21 and name   HA) 5.5 3.7 0.5 !peaknum  114
assign (segid  B and resid   59 and name   HN) (segid  B and resid   58 and name   HA) 3.5 1.7 0.5 !peaknum  515
assign (segid  B and resid   16 and name   HN) (segid  B and resid   15 and name  HG1) 3.5 1.7 0.5 !peaknum  131
assign (segid  B and resid   61 and name   HN) (segid  B and resid   60 and name   HA) 3.5 1.7 0.5 !peaknum  538
assign (segid  B and resid   39 and name   HN) (segid  B and resid   38 and name  HG*) 5.5 3.7 0.5 !peaknum  326
assign (segid  B and resid   61 and name   HN) (segid  B and resid   60 and name   HN) 2.8 1.0 0.2 !peaknum  536 524
assign (segid  B and resid   30 and name   HN) (segid  B and resid   52 and name HD2#) 3.5 1.7 0.5 !peaknum  248
assign (segid  B and resid   55 and name   HN) (segid  B and resid   54 and name  HB*) 2.8 1.0 0.2 !peaknum  481
assign (segid  B and resid   46 and name   HN) (segid  B and resid   47 and name  HB*) 5.5 3.7 0.5 !peaknum  385
assign (segid  B and resid   23 and name   HN) (segid  B and resid   22 and name   HA) 3.5 1.7 0.5 !peaknum  172
assign (segid  B and resid   48 and name   HN) (segid  B and resid   47 and name  HB*) 3.5 1.7 0.5 !peaknum  413
assign (segid  B and resid   12 and name   HN) (segid  B and resid   11 and name   HA) 3.5 1.7 0.5 !peaknum   97
assign (segid  B and resid   58 and name   HN) (segid  B and resid   55 and name  HB*) 5.5 3.7 0.5 !peaknum  509
assign (segid  B and resid   28 and name   HN) (segid  B and resid   27 and name  HB*) 3.5 1.7 0.5 !peaknum  226
assign (segid  B and resid   62 and name   HN) (segid  B and resid   61 and name   HA) 3.5 1.7 0.5 !peaknum  544
assign (segid  B and resid   56 and name   HN) (segid  B and resid   55 and name HD1#) 5.5 3.7 0.5 !peaknum  492
assign (segid  B and resid   35 and name   HN) (segid  B and resid   34 and name  HB*) 2.8 1.0 0.2 !peaknum  286
assign (segid  B and resid   31 and name   HN) (segid  B and resid   28 and name  HB1) 5.5 3.7 0.5 !peaknum  253
assign (segid  B and resid   59 and name   HN) (segid  B and resid   60 and name   HB) 5.5 3.7 0.5 !peaknum  519
assign (segid  B and resid   11 and name   HN) (segid  B and resid   10 and name  HB1) 3.5 1.7 0.5 !peaknum   94
assign (segid  B and resid   18 and name   HN) (segid  B and resid   17 and name   HA) 3.5 1.7 0.5 !peaknum  142
assign (segid  B and resid   58 and name   HN) (segid  B and resid   55 and name   HG) 5.5 3.7 0.5 !peaknum  508
assign (segid  B and resid   30 and name   HN) (segid  B and resid   28 and name  HB2) 5.5 3.7 0.5 !peaknum  244
assign (segid  B and resid   61 and name   HN) (segid  B and resid   60 and name   HB) 2.8 1.0 0.2 !peaknum  539
assign (segid  B and resid   54 and name   HN) (segid  B and resid   53 and name  HB*) 3.5 1.7 0.5 !peaknum  472
assign (segid  B and resid   24 and name   HN) (segid  B and resid   20 and name   HA) 3.5 1.7 0.5 !peaknum  188
assign (segid  B and resid   58 and name   HN) (segid  B and resid   57 and name  HB*) 3.5 1.7 0.5 !peaknum  506
assign (segid  B and resid   63 and name   HN) (segid  B and resid   62 and name   HA) 3.5 1.7 0.5 !peaknum  550
assign (segid  B and resid   38 and name   HN) (segid  B and resid   35 and name   HA) 3.5 1.7 0.5 !peaknum  315
assign (segid  B and resid   17 and name   HN) (segid  B and resid   16 and name   HA) 2.8 1.0 0.2 !peaknum  133
assign (segid  B and resid   58 and name   HN) (segid  B and resid   55 and name   HA) 3.5 1.7 0.5 !peaknum  505
assign (segid  B and resid   63 and name   HN) (segid  B and resid   62 and name  HB*) 2.8 1.0 0.2 !peaknum  553
assign (segid  B and resid   61 and name   HN) (segid  B and resid   60 and name HD1#) 5.5 3.7 0.5 !peaknum  541
assign (segid  B and resid   61 and name   HN) (segid  B and resid   59 and name   HA) 5.5 3.7 0.5 !peaknum  537
assign (segid  B and resid   24 and name   HN) (segid  B and resid   23 and name  HG2) 3.5 1.7 0.5 !peaknum  193
assign (segid  B and resid   31 and name   HN) (segid  B and resid   30 and name   HA) 3.5 1.7 0.5 !peaknum  252
assign (segid  B and resid   49 and name   HE) (segid  B and resid   47 and name   HN) 5.5 3.7 0.5 !peaknum  424
assign (segid  B and resid   15 and name   HN) (segid  B and resid   14 and name  HG2) 2.8 1.0 0.2 !peaknum  125
assign (segid  B and resid   11 and name   HN) (segid  B and resid   10 and name   HA) 3.5 1.7 0.5 !peaknum   89
assign (segid  B and resid   63 and name   HN) (segid  B and resid   60 and name   HA) 3.5 1.7 0.5 !peaknum  552
assign (segid  B and resid    9 and name   HN) (segid  B and resid    8 and name   HA) 2.8 1.0 0.2 !peaknum   81
! 13C HSQC-NOESY
assign (segid  A and resid   33 and name  HE*) (segid  A and resid   30 and name  HG2) 3.5 1.7 0.5 !peaknum  656 562
assign (segid  A and resid   48 and name HG2#) (segid  A and resid   29 and name HD2#) 5.5 3.7 0.5 !peaknum  393
assign (segid  A and resid   21 and name   HA) (segid  A and resid   25 and name  HD*) 3.5 1.7 0.5 !peaknum  583
assign (segid  A and resid   34 and name   HA) (segid  A and resid   37 and name  HB*) 2.8 1.0 0.2 !peaknum  572 279
assign (segid  A and resid   47 and name  HG2) (segid  A and resid   46 and name  HB*) 5.5 3.7 0.5 !peaknum  425
assign (segid  A and resid   18 and name  HB1) (segid  A and resid   22 and name HD2#) 5.5 3.7 0.5 !peaknum  375
assign (segid  A and resid   35 and name   HA) (segid  A and resid   38 and name  HB1) 5.5 3.7 0.5 !peaknum  416
assign (segid  A and resid   23 and name  HB*) (segid  A and resid   24 and name   HA) 5.5 3.7 0.5 !peaknum  499
assign (segid  A and resid   11 and name   HA) (segid  A and resid   10 and name  HD2) 5.5 3.7 0.5 !peaknum  542
assign (segid  A and resid   52 and name   HG) (segid  A and resid   33 and name  HE*) 3.5 1.7 0.5 !peaknum  560
assign (segid  A and resid   22 and name  HB*) (segid  A and resid   19 and name   HA) 5.5 3.7 0.5 !peaknum  259
assign (segid  A and resid   45 and name  HB*) (segid  A and resid   42 and name   HA) 2.8 1.0 0.2 !peaknum  657 658
assign (segid  A and resid   11 and name   HA) (segid  A and resid   10 and name  HD2) 5.5 3.7 0.5 !peaknum  541
assign (segid  A and resid   32 and name HD1#) (segid  A and resid   29 and name   HA) 5.5 3.7 0.5 !peaknum  654 529
assign (segid  A and resid   55 and name   HA) (segid  A and resid   58 and name HD1#) 3.5 1.7 0.5 !peaknum  537 483
assign (segid  A and resid   58 and name HD1#) (segid  A and resid   55 and name   HG) 3.5 1.7 0.5 !peaknum  477 420
assign (segid  A and resid   26 and name HD1#) (segid  A and resid   23 and name   HA) 3.5 1.7 0.5 !peaknum  498
assign (segid  A and resid   17 and name  HG2) (segid  A and resid   16 and name   HA) 3.5 1.7 0.5 !peaknum  256
assign (segid  A and resid   19 and name  HG1) (segid  A and resid   22 and name HD2#) 3.5 1.7 0.5 !peaknum  367
assign (segid  A and resid   14 and name  HD1) (segid  A and resid   13 and name HG2#) 5.5 3.7 0.5 !peaknum  327
assign (segid  A and resid   43 and name   HA) (segid  A and resid   46 and name  HB*) 5.5 3.7 0.5 !peaknum  659 509
assign (segid  A and resid   19 and name  HG2) (segid  A and resid   22 and name HD2#) 5.5 3.7 0.5 !peaknum  369
assign (segid  A and resid   62 and name  HB*) (segid  A and resid   59 and name   HA) 3.5 1.7 0.5 !peaknum  511 461
assign (segid  A and resid   56 and name  HB*) (segid  A and resid   55 and name   HA) 5.5 3.7 0.5 !peaknum  497
assign (segid  A and resid   24 and name  HB2) (segid  A and resid   20 and name   HA) 5.5 3.7 0.5 !peaknum  494
assign (segid  A and resid   33 and name  HE*) (segid  A and resid   30 and name  HG1) 5.5 3.7 0.5 !peaknum  593 561
assign (segid  A and resid   29 and name   HA) (segid  A and resid   32 and name HD2#) 3.5 1.7 0.5 !peaknum  525
assign (segid  A and resid   32 and name  HB1) (segid  A and resid   45 and name   HA) 5.5 3.7 0.5 !peaknum  280
assign (segid  A and resid   48 and name   HB) (segid  A and resid   32 and name HD2#) 5.5 3.7 0.5 !peaknum  442
assign (segid  A and resid   33 and name  HE*) (segid  A and resid   30 and name   HA) 3.5 1.7 0.5 !peaknum  277
assign (segid  A and resid   13 and name HG1#) (segid  A and resid   14 and name  HG1) 3.5 1.7 0.5 !peaknum  466
assign (segid  A and resid   29 and name  HB2) (segid  A and resid   52 and name HD2#) 3.5 1.7 0.5 !peaknum  437
assign (segid  A and resid   55 and name HD2#) (segid  A and resid   26 and name HG1#) 5.5 3.7 0.5 !peaknum  473
assign (segid  A and resid   25 and name  HB*) (segid  A and resid   55 and name HD2#) 3.5 1.7 0.5 !peaknum  524
assign (segid  A and resid   55 and name HD2#) (segid  A and resid   25 and name  HG*) 5.5 3.7 0.5 !peaknum  380
assign (segid  A and resid   14 and name  HD2) (segid  A and resid   13 and name   HA) 5.5 3.7 0.5 !peaknum  248
assign (segid  A and resid   33 and name  HE*) (segid  A and resid   52 and name HD1#) 5.5 3.7 0.5 !peaknum  434 559
assign (segid  A and resid   32 and name  HB1) (segid  A and resid   48 and name HD1#) 5.5 3.7 0.5 !peaknum  604
assign (segid  A and resid   15 and name   HA) (segid  A and resid   14 and name  HD1) 5.5 3.7 0.5 !peaknum  332
assign (segid  A and resid   55 and name HD2#) (segid  A and resid   25 and name  HD*) 5.5 3.7 0.5 !peaknum  582
assign (segid  A and resid   25 and name  HB*) (segid  A and resid   22 and name   HA) 2.8 1.0 0.2 !peaknum  267
assign (segid  A and resid   61 and name  HB*) (segid  A and resid   58 and name   HA) 3.5 1.7 0.5 !peaknum  286
assign (segid  A and resid   14 and name  HD1) (segid  A and resid   13 and name   HA) 3.5 1.7 0.5 !peaknum  249
assign (segid  A and resid   25 and name  HB*) (segid  A and resid   55 and name  HB*) 5.5 3.7 0.5 !peaknum  519
assign (segid  A and resid   15 and name   HA) (segid  A and resid   14 and name  HD2) 5.5 3.7 0.5 !peaknum  333
assign (segid  A and resid   23 and name  HB*) (segid  A and resid   20 and name   HA) 2.8 1.0 0.2 !peaknum  262
assign (segid  B and resid   33 and name  HE*) (segid  B and resid   30 and name  HG2) 3.5 1.7 0.5 !peaknum  656 562
assign (segid  B and resid   48 and name HG2#) (segid  B and resid   29 and name HD2#) 5.5 3.7 0.5 !peaknum  393
assign (segid  B and resid   21 and name   HA) (segid  B and resid   25 and name  HD*) 3.5 1.7 0.5 !peaknum  583
assign (segid  B and resid   34 and name   HA) (segid  B and resid   37 and name  HB*) 2.8 1.0 0.2 !peaknum  572 279
assign (segid  B and resid   47 and name  HG2) (segid  B and resid   46 and name  HB*) 5.5 3.7 0.5 !peaknum  425
assign (segid  B and resid   18 and name  HB1) (segid  B and resid   22 and name HD2#) 5.5 3.7 0.5 !peaknum  375
assign (segid  B and resid   35 and name   HA) (segid  B and resid   38 and name  HB1) 5.5 3.7 0.5 !peaknum  416
assign (segid  B and resid   23 and name  HB*) (segid  B and resid   24 and name   HA) 5.5 3.7 0.5 !peaknum  499
assign (segid  B and resid   11 and name   HA) (segid  B and resid   10 and name  HD2) 5.5 3.7 0.5 !peaknum  542
assign (segid  B and resid   52 and name   HG) (segid  B and resid   33 and name  HE*) 3.5 1.7 0.5 !peaknum  560
assign (segid  B and resid   22 and name  HB*) (segid  B and resid   19 and name   HA) 5.5 3.7 0.5 !peaknum  259
assign (segid  B and resid   45 and name  HB*) (segid  B and resid   42 and name   HA) 2.8 1.0 0.2 !peaknum  657 658
assign (segid  B and resid   11 and name   HA) (segid  B and resid   10 and name  HD2) 5.5 3.7 0.5 !peaknum  541
assign (segid  B and resid   32 and name HD1#) (segid  B and resid   29 and name   HA) 5.5 3.7 0.5 !peaknum  654 529
assign (segid  B and resid   55 and name   HA) (segid  B and resid   58 and name HD1#) 3.5 1.7 0.5 !peaknum  537 483
assign (segid  B and resid   58 and name HD1#) (segid  B and resid   55 and name   HG) 3.5 1.7 0.5 !peaknum  477 420
assign (segid  B and resid   26 and name HD1#) (segid  B and resid   23 and name   HA) 3.5 1.7 0.5 !peaknum  498
assign (segid  B and resid   17 and name  HG2) (segid  B and resid   16 and name   HA) 3.5 1.7 0.5 !peaknum  256
assign (segid  B and resid   19 and name  HG1) (segid  B and resid   22 and name HD2#) 3.5 1.7 0.5 !peaknum  367
assign (segid  B and resid   14 and name  HD1) (segid  B and resid   13 and name HG2#) 5.5 3.7 0.5 !peaknum  327
assign (segid  B and resid   43 and name   HA) (segid  B and resid   46 and name  HB*) 5.5 3.7 0.5 !peaknum  659 509
assign (segid  B and resid   19 and name  HG2) (segid  B and resid   22 and name HD2#) 5.5 3.7 0.5 !peaknum  369
assign (segid  B and resid   62 and name  HB*) (segid  B and resid   59 and name   HA) 3.5 1.7 0.5 !peaknum  511 461
assign (segid  B and resid   56 and name  HB*) (segid  B and resid   55 and name   HA) 5.5 3.7 0.5 !peaknum  497
assign (segid  B and resid   24 and name  HB2) (segid  B and resid   20 and name   HA) 5.5 3.7 0.5 !peaknum  494
assign (segid  B and resid   33 and name  HE*) (segid  B and resid   30 and name  HG1) 5.5 3.7 0.5 !peaknum  593 561
assign (segid  B and resid   29 and name   HA) (segid  B and resid   32 and name HD2#) 3.5 1.7 0.5 !peaknum  525
assign (segid  B and resid   32 and name  HB1) (segid  B and resid   45 and name   HA) 5.5 3.7 0.5 !peaknum  280
assign (segid  B and resid   48 and name   HB) (segid  B and resid   32 and name HD2#) 5.5 3.7 0.5 !peaknum  442
assign (segid  B and resid   33 and name  HE*) (segid  B and resid   30 and name   HA) 3.5 1.7 0.5 !peaknum  277
assign (segid  B and resid   13 and name HG1#) (segid  B and resid   14 and name  HG1) 3.5 1.7 0.5 !peaknum  466
assign (segid  B and resid   29 and name  HB2) (segid  B and resid   52 and name HD2#) 3.5 1.7 0.5 !peaknum  437
assign (segid  B and resid   55 and name HD2#) (segid  B and resid   26 and name HG1#) 5.5 3.7 0.5 !peaknum  473
assign (segid  B and resid   25 and name  HB*) (segid  B and resid   55 and name HD2#) 3.5 1.7 0.5 !peaknum  524
assign (segid  B and resid   55 and name HD2#) (segid  B and resid   25 and name  HG*) 5.5 3.7 0.5 !peaknum  380
assign (segid  B and resid   14 and name  HD2) (segid  B and resid   13 and name   HA) 5.5 3.7 0.5 !peaknum  248
assign (segid  B and resid   33 and name  HE*) (segid  B and resid   52 and name HD1#) 5.5 3.7 0.5 !peaknum  434 559
assign (segid  B and resid   32 and name  HB1) (segid  B and resid   48 and name HD1#) 5.5 3.7 0.5 !peaknum  604
assign (segid  B and resid   15 and name   HA) (segid  B and resid   14 and name  HD1) 5.5 3.7 0.5 !peaknum  332
assign (segid  B and resid   55 and name HD2#) (segid  B and resid   25 and name  HD*) 5.5 3.7 0.5 !peaknum  582
assign (segid  B and resid   25 and name  HB*) (segid  B and resid   22 and name   HA) 2.8 1.0 0.2 !peaknum  267
assign (segid  B and resid   61 and name  HB*) (segid  B and resid   58 and name   HA) 3.5 1.7 0.5 !peaknum  286
assign (segid  B and resid   14 and name  HD1) (segid  B and resid   13 and name   HA) 3.5 1.7 0.5 !peaknum  249
assign (segid  B and resid   25 and name  HB*) (segid  B and resid   55 and name  HB*) 5.5 3.7 0.5 !peaknum  519
assign (segid  B and resid   15 and name   HA) (segid  B and resid   14 and name  HD2) 5.5 3.7 0.5 !peaknum  333
assign (segid  B and resid   23 and name  HB*) (segid  B and resid   20 and name   HA) 2.8 1.0 0.2 !peaknum  262
! 12C/13C NOESY
assign (segid  A and resid   37 and name  HB*) (segid  B and resid   42 and name  HD*) 5.5 3.7 0.5 !peaknum    5
assign (segid  A and resid   40 and name   HG) (segid  B and resid   34 and name  HE*) 3.5 1.7 0.5 !peaknum   14
assign (segid  A and resid   46 and name  HB*) (segid  B and resid   46 and name   HA) 5.5 3.7 0.5 !peaknum   61
assign (segid  A and resid   40 and name   HG) (segid  B and resid   37 and name  HB*) 5.5 3.7 0.5 !peaknum   56
assign (segid  A and resid   33 and name  HE*) (segid  B and resid   42 and name  HE*) 3.5 1.7 0.5 !peaknum    8
assign (segid  A and resid   33 and name  HE*) (segid  B and resid   42 and name  HD*) 3.5 1.7 0.5 !peaknum    6
assign (segid  A and resid   46 and name  HB*) (segid  B and resid   43 and name   HA) 5.5 3.7 0.5 !peaknum   12
assign (segid  A and resid   37 and name  HB*) (segid  B and resid   37 and name   HA) 5.5 3.7 0.5 !peaknum   59
assign (segid  A and resid   37 and name  HB*) (segid  B and resid   42 and name  HE*) 3.5 1.7 0.5 !peaknum    7
assign (segid  A and resid   34 and name  HE*) (segid  B and resid   38 and name  HG*) 3.5 1.7 0.5 !peaknum   63
assign (segid  A and resid   46 and name  HB*) (segid  B and resid   42 and name   HZ) 3.5 1.7 0.5 !peaknum    3
assign (segid  A and resid   46 and name  HB*) (segid  B and resid   37 and name   HA) 5.5 3.7 0.5 !peaknum    9
assign (segid  A and resid   40 and name   HG) (segid  B and resid   33 and name  HE*) 2.8 1.0 0.2 !peaknum   13
assign (segid  B and resid   37 and name  HB*) (segid  A and resid   42 and name  HD*) 5.5 3.7 0.5 !peaknum    5
assign (segid  B and resid   40 and name   HG) (segid  A and resid   34 and name  HE*) 3.5 1.7 0.5 !peaknum   14
assign (segid  B and resid   46 and name  HB*) (segid  A and resid   46 and name   HA) 5.5 3.7 0.5 !peaknum   61
assign (segid  B and resid   40 and name   HG) (segid  A and resid   37 and name  HB*) 5.5 3.7 0.5 !peaknum   56
assign (segid  B and resid   33 and name  HE*) (segid  A and resid   42 and name  HE*) 3.5 1.7 0.5 !peaknum    8
assign (segid  B and resid   33 and name  HE*) (segid  A and resid   42 and name  HD*) 3.5 1.7 0.5 !peaknum    6
assign (segid  B and resid   46 and name  HB*) (segid  A and resid   43 and name   HA) 5.5 3.7 0.5 !peaknum   12
assign (segid  B and resid   37 and name  HB*) (segid  A and resid   37 and name   HA) 5.5 3.7 0.5 !peaknum   59
assign (segid  B and resid   37 and name  HB*) (segid  A and resid   42 and name  HE*) 3.5 1.7 0.5 !peaknum    7
assign (segid  B and resid   34 and name  HE*) (segid  A and resid   38 and name  HG*) 3.5 1.7 0.5 !peaknum   63
assign (segid  B and resid   46 and name  HB*) (segid  A and resid   42 and name   HZ) 3.5 1.7 0.5 !peaknum    3
assign (segid  B and resid   46 and name  HB*) (segid  A and resid   37 and name   HA) 5.5 3.7 0.5 !peaknum    9
assign (segid  B and resid   40 and name   HG) (segid  A and resid   33 and name  HE*) 2.8 1.0 0.2 !peaknum   13

restraints
   dihedral
     reset

!phi dihedrals

assign (segid  A and resid   20 and name C ) (segid  A and resid   21 and name N )
       (segid  A and resid   21 and name CA) (segid  A and resid   21 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   21 and name C ) (segid  A and resid   22 and name N )
       (segid  A and resid   22 and name CA) (segid  A and resid   22 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   22 and name C ) (segid  A and resid   23 and name N )
       (segid  A and resid   23 and name CA) (segid  A and resid   23 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   23 and name C ) (segid  A and resid   24 and name N )
       (segid  A and resid   24 and name CA) (segid  A and resid   24 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   24 and name C ) (segid  A and resid   25 and name N )
       (segid  A and resid   25 and name CA) (segid  A and resid   25 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   25 and name C ) (segid  A and resid   26 and name N )
       (segid  A and resid   26 and name CA) (segid  A and resid   26 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   26 and name C ) (segid  A and resid   27 and name N )
       (segid  A and resid   27 and name CA) (segid  A and resid   27 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   27 and name C ) (segid  A and resid   28 and name N )
       (segid  A and resid   28 and name CA) (segid  A and resid   28 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   28 and name C ) (segid  A and resid   29 and name N )
       (segid  A and resid   29 and name CA) (segid  A and resid   29 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   29 and name C ) (segid  A and resid   30 and name N )
       (segid  A and resid   30 and name CA) (segid  A and resid   30 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   30 and name C ) (segid  A and resid   31 and name N )
       (segid  A and resid   31 and name CA) (segid  A and resid   31 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   31 and name C ) (segid  A and resid   32 and name N )
       (segid  A and resid   32 and name CA) (segid  A and resid   32 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   32 and name C ) (segid  A and resid   33 and name N )
       (segid  A and resid   33 and name CA) (segid  A and resid   33 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   33 and name C ) (segid  A and resid   34 and name N )
       (segid  A and resid   34 and name CA) (segid  A and resid   34 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   34 and name C ) (segid  A and resid   35 and name N )
       (segid  A and resid   35 and name CA) (segid  A and resid   35 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   35 and name C ) (segid  A and resid   36 and name N )
       (segid  A and resid   36 and name CA) (segid  A and resid   36 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   36 and name C ) (segid  A and resid   37 and name N )
       (segid  A and resid   37 and name CA) (segid  A and resid   37 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   37 and name C ) (segid  A and resid   38 and name N )
       (segid  A and resid   38 and name CA) (segid  A and resid   38 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   43 and name C ) (segid  A and resid   44 and name N )
       (segid  A and resid   44 and name CA) (segid  A and resid   44 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   44 and name C ) (segid  A and resid   45 and name N )
       (segid  A and resid   45 and name CA) (segid  A and resid   45 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   45 and name C ) (segid  A and resid   46 and name N )
       (segid  A and resid   46 and name CA) (segid  A and resid   46 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   46 and name C ) (segid  A and resid   47 and name N )
       (segid  A and resid   47 and name CA) (segid  A and resid   47 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   47 and name C ) (segid  A and resid   48 and name N )
       (segid  A and resid   48 and name CA) (segid  A and resid   48 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   48 and name C ) (segid  A and resid   49 and name N )
       (segid  A and resid   49 and name CA) (segid  A and resid   49 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   49 and name C ) (segid  A and resid   50 and name N )
       (segid  A and resid   50 and name CA) (segid  A and resid   50 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   50 and name C ) (segid  A and resid   51 and name N )
       (segid  A and resid   51 and name CA) (segid  A and resid   51 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   51 and name C ) (segid  A and resid   52 and name N )
       (segid  A and resid   52 and name CA) (segid  A and resid   52 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   52 and name C ) (segid  A and resid   53 and name N )
       (segid  A and resid   53 and name CA) (segid  A and resid   53 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   53 and name C ) (segid  A and resid   54 and name N )
       (segid  A and resid   54 and name CA) (segid  A and resid   54 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   54 and name C ) (segid  A and resid   55 and name N )
       (segid  A and resid   55 and name CA) (segid  A and resid   55 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   55 and name C ) (segid  A and resid   56 and name N )
       (segid  A and resid   56 and name CA) (segid  A and resid   56 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   56 and name C ) (segid  A and resid   57 and name N )
       (segid  A and resid   57 and name CA) (segid  A and resid   57 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   57 and name C ) (segid  A and resid   58 and name N )
       (segid  A and resid   58 and name CA) (segid  A and resid   58 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   58 and name C ) (segid  A and resid   59 and name N )
       (segid  A and resid   59 and name CA) (segid  A and resid   59 and name C )  1.00  -60.00   20.00   2

assign (segid  A and resid   59 and name C ) (segid  A and resid   60 and name N )
       (segid  A and resid   60 and name CA) (segid  A and resid   60 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   20 and name C ) (segid  B and resid   21 and name N )
       (segid  B and resid   21 and name CA) (segid  B and resid   21 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   21 and name C ) (segid  B and resid   22 and name N )
       (segid  B and resid   22 and name CA) (segid  B and resid   22 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   22 and name C ) (segid  B and resid   23 and name N )
       (segid  B and resid   23 and name CA) (segid  B and resid   23 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   23 and name C ) (segid  B and resid   24 and name N )
       (segid  B and resid   24 and name CA) (segid  B and resid   24 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   24 and name C ) (segid  B and resid   25 and name N )
       (segid  B and resid   25 and name CA) (segid  B and resid   25 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   25 and name C ) (segid  B and resid   26 and name N )
       (segid  B and resid   26 and name CA) (segid  B and resid   26 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   26 and name C ) (segid  B and resid   27 and name N )
       (segid  B and resid   27 and name CA) (segid  B and resid   27 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   27 and name C ) (segid  B and resid   28 and name N )
       (segid  B and resid   28 and name CA) (segid  B and resid   28 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   28 and name C ) (segid  B and resid   29 and name N )
       (segid  B and resid   29 and name CA) (segid  B and resid   29 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   29 and name C ) (segid  B and resid   30 and name N )
       (segid  B and resid   30 and name CA) (segid  B and resid   30 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   30 and name C ) (segid  B and resid   31 and name N )
       (segid  B and resid   31 and name CA) (segid  B and resid   31 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   31 and name C ) (segid  B and resid   32 and name N )
       (segid  B and resid   32 and name CA) (segid  B and resid   32 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   32 and name C ) (segid  B and resid   33 and name N )
       (segid  B and resid   33 and name CA) (segid  B and resid   33 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   33 and name C ) (segid  B and resid   34 and name N )
       (segid  B and resid   34 and name CA) (segid  B and resid   34 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   34 and name C ) (segid  B and resid   35 and name N )
       (segid  B and resid   35 and name CA) (segid  B and resid   35 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   35 and name C ) (segid  B and resid   36 and name N )
       (segid  B and resid   36 and name CA) (segid  B and resid   36 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   36 and name C ) (segid  B and resid   37 and name N )
       (segid  B and resid   37 and name CA) (segid  B and resid   37 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   37 and name C ) (segid  B and resid   38 and name N )
       (segid  B and resid   38 and name CA) (segid  B and resid   38 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   43 and name C ) (segid  B and resid   44 and name N )
       (segid  B and resid   44 and name CA) (segid  B and resid   44 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   44 and name C ) (segid  B and resid   45 and name N )
       (segid  B and resid   45 and name CA) (segid  B and resid   45 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   45 and name C ) (segid  B and resid   46 and name N )
       (segid  B and resid   46 and name CA) (segid  B and resid   46 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   46 and name C ) (segid  B and resid   47 and name N )
       (segid  B and resid   47 and name CA) (segid  B and resid   47 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   47 and name C ) (segid  B and resid   48 and name N )
       (segid  B and resid   48 and name CA) (segid  B and resid   48 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   48 and name C ) (segid  B and resid   49 and name N )
       (segid  B and resid   49 and name CA) (segid  B and resid   49 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   49 and name C ) (segid  B and resid   50 and name N )
       (segid  B and resid   50 and name CA) (segid  B and resid   50 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   50 and name C ) (segid  B and resid   51 and name N )
       (segid  B and resid   51 and name CA) (segid  B and resid   51 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   51 and name C ) (segid  B and resid   52 and name N )
       (segid  B and resid   52 and name CA) (segid  B and resid   52 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   52 and name C ) (segid  B and resid   53 and name N )
       (segid  B and resid   53 and name CA) (segid  B and resid   53 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   53 and name C ) (segid  B and resid   54 and name N )
       (segid  B and resid   54 and name CA) (segid  B and resid   54 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   54 and name C ) (segid  B and resid   55 and name N )
       (segid  B and resid   55 and name CA) (segid  B and resid   55 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   55 and name C ) (segid  B and resid   56 and name N )
       (segid  B and resid   56 and name CA) (segid  B and resid   56 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   56 and name C ) (segid  B and resid   57 and name N )
       (segid  B and resid   57 and name CA) (segid  B and resid   57 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   57 and name C ) (segid  B and resid   58 and name N )
       (segid  B and resid   58 and name CA) (segid  B and resid   58 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   58 and name C ) (segid  B and resid   59 and name N )
       (segid  B and resid   59 and name CA) (segid  B and resid   59 and name C )  1.00  -60.00   20.00   2

assign (segid  B and resid   59 and name C ) (segid  B and resid   60 and name N )
       (segid  B and resid   60 and name CA) (segid  B and resid   60 and name C )  1.00  -60.00   20.00   2

!psi dihedrals

assign (segid  A and resid   21 and name N ) (segid  A and resid   21 and name CA)
       (segid  A and resid   21 and name C ) (segid  A and resid   22 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   22 and name N ) (segid  A and resid   22 and name CA)
       (segid  A and resid   22 and name C ) (segid  A and resid   23 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   23 and name N ) (segid  A and resid   23 and name CA)
       (segid  A and resid   23 and name C ) (segid  A and resid   24 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   24 and name N ) (segid  A and resid   24 and name CA)
       (segid  A and resid   24 and name C ) (segid  A and resid   25 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   25 and name N ) (segid  A and resid   25 and name CA)
       (segid  A and resid   25 and name C ) (segid  A and resid   26 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   26 and name N ) (segid  A and resid   26 and name CA)
       (segid  A and resid   26 and name C ) (segid  A and resid   27 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   27 and name N ) (segid  A and resid   27 and name CA)
       (segid  A and resid   27 and name C ) (segid  A and resid   28 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   28 and name N ) (segid  A and resid   28 and name CA)
       (segid  A and resid   28 and name C ) (segid  A and resid   29 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   29 and name N ) (segid  A and resid   29 and name CA)
       (segid  A and resid   29 and name C ) (segid  A and resid   30 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   30 and name N ) (segid  A and resid   30 and name CA)
       (segid  A and resid   30 and name C ) (segid  A and resid   31 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   31 and name N ) (segid  A and resid   31 and name CA)
       (segid  A and resid   31 and name C ) (segid  A and resid   32 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   32 and name N ) (segid  A and resid   32 and name CA)
       (segid  A and resid   32 and name C ) (segid  A and resid   33 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   33 and name N ) (segid  A and resid   33 and name CA)
       (segid  A and resid   33 and name C ) (segid  A and resid   34 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   34 and name N ) (segid  A and resid   34 and name CA)
       (segid  A and resid   34 and name C ) (segid  A and resid   35 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   35 and name N ) (segid  A and resid   35 and name CA)
       (segid  A and resid   35 and name C ) (segid  A and resid   36 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   36 and name N ) (segid  A and resid   36 and name CA)
       (segid  A and resid   36 and name C ) (segid  A and resid   37 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   37 and name N ) (segid  A and resid   37 and name CA)
       (segid  A and resid   37 and name C ) (segid  A and resid   38 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   38 and name N ) (segid  A and resid   38 and name CA)
       (segid  A and resid   38 and name C ) (segid  A and resid   39 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   44 and name N ) (segid  A and resid   44 and name CA)
       (segid  A and resid   44 and name C ) (segid  A and resid   45 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   45 and name N ) (segid  A and resid   45 and name CA)
       (segid  A and resid   45 and name C ) (segid  A and resid   46 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   46 and name N ) (segid  A and resid   46 and name CA)
       (segid  A and resid   46 and name C ) (segid  A and resid   47 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   47 and name N ) (segid  A and resid   47 and name CA)
       (segid  A and resid   47 and name C ) (segid  A and resid   48 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   48 and name N ) (segid  A and resid   48 and name CA)
       (segid  A and resid   48 and name C ) (segid  A and resid   49 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   49 and name N ) (segid  A and resid   49 and name CA)
       (segid  A and resid   49 and name C ) (segid  A and resid   50 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   50 and name N ) (segid  A and resid   50 and name CA)
       (segid  A and resid   50 and name C ) (segid  A and resid   51 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   51 and name N ) (segid  A and resid   51 and name CA)
       (segid  A and resid   51 and name C ) (segid  A and resid   52 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   52 and name N ) (segid  A and resid   52 and name CA)
       (segid  A and resid   52 and name C ) (segid  A and resid   53 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   53 and name N ) (segid  A and resid   53 and name CA)
       (segid  A and resid   53 and name C ) (segid  A and resid   54 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   54 and name N ) (segid  A and resid   54 and name CA)
       (segid  A and resid   54 and name C ) (segid  A and resid   55 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   55 and name N ) (segid  A and resid   55 and name CA)
       (segid  A and resid   55 and name C ) (segid  A and resid   56 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   56 and name N ) (segid  A and resid   56 and name CA)
       (segid  A and resid   56 and name C ) (segid  A and resid   57 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   57 and name N ) (segid  A and resid   57 and name CA)
       (segid  A and resid   57 and name C ) (segid  A and resid   58 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   58 and name N ) (segid  A and resid   58 and name CA)
       (segid  A and resid   58 and name C ) (segid  A and resid   59 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   59 and name N ) (segid  A and resid   59 and name CA)
       (segid  A and resid   59 and name C ) (segid  A and resid   60 and name N )  1.00  -60.00   40.00   2

assign (segid  A and resid   60 and name N ) (segid  A and resid   60 and name CA)
       (segid  A and resid   60 and name C ) (segid  A and resid   61 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   21 and name N ) (segid  B and resid   21 and name CA)
       (segid  B and resid   21 and name C ) (segid  B and resid   22 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   22 and name N ) (segid  B and resid   22 and name CA)
       (segid  B and resid   22 and name C ) (segid  B and resid   23 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   23 and name N ) (segid  B and resid   23 and name CA)
       (segid  B and resid   23 and name C ) (segid  B and resid   24 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   24 and name N ) (segid  B and resid   24 and name CA)
       (segid  B and resid   24 and name C ) (segid  B and resid   25 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   25 and name N ) (segid  B and resid   25 and name CA)
       (segid  B and resid   25 and name C ) (segid  B and resid   26 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   26 and name N ) (segid  B and resid   26 and name CA)
       (segid  B and resid   26 and name C ) (segid  B and resid   27 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   27 and name N ) (segid  B and resid   27 and name CA)
       (segid  B and resid   27 and name C ) (segid  B and resid   28 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   28 and name N ) (segid  B and resid   28 and name CA)
       (segid  B and resid   28 and name C ) (segid  B and resid   29 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   29 and name N ) (segid  B and resid   29 and name CA)
       (segid  B and resid   29 and name C ) (segid  B and resid   30 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   30 and name N ) (segid  B and resid   30 and name CA)
       (segid  B and resid   30 and name C ) (segid  B and resid   31 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   31 and name N ) (segid  B and resid   31 and name CA)
       (segid  B and resid   31 and name C ) (segid  B and resid   32 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   32 and name N ) (segid  B and resid   32 and name CA)
       (segid  B and resid   32 and name C ) (segid  B and resid   33 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   33 and name N ) (segid  B and resid   33 and name CA)
       (segid  B and resid   33 and name C ) (segid  B and resid   34 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   34 and name N ) (segid  B and resid   34 and name CA)
       (segid  B and resid   34 and name C ) (segid  B and resid   35 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   35 and name N ) (segid  B and resid   35 and name CA)
       (segid  B and resid   35 and name C ) (segid  B and resid   36 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   36 and name N ) (segid  B and resid   36 and name CA)
       (segid  B and resid   36 and name C ) (segid  B and resid   37 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   37 and name N ) (segid  B and resid   37 and name CA)
       (segid  B and resid   37 and name C ) (segid  B and resid   38 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   38 and name N ) (segid  B and resid   38 and name CA)
       (segid  B and resid   38 and name C ) (segid  B and resid   39 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   44 and name N ) (segid  B and resid   44 and name CA)
       (segid  B and resid   44 and name C ) (segid  B and resid   45 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   45 and name N ) (segid  B and resid   45 and name CA)
       (segid  B and resid   45 and name C ) (segid  B and resid   46 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   46 and name N ) (segid  B and resid   46 and name CA)
       (segid  B and resid   46 and name C ) (segid  B and resid   47 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   47 and name N ) (segid  B and resid   47 and name CA)
       (segid  B and resid   47 and name C ) (segid  B and resid   48 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   48 and name N ) (segid  B and resid   48 and name CA)
       (segid  B and resid   48 and name C ) (segid  B and resid   49 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   49 and name N ) (segid  B and resid   49 and name CA)
       (segid  B and resid   49 and name C ) (segid  B and resid   50 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   50 and name N ) (segid  B and resid   50 and name CA)
       (segid  B and resid   50 and name C ) (segid  B and resid   51 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   51 and name N ) (segid  B and resid   51 and name CA)
       (segid  B and resid   51 and name C ) (segid  B and resid   52 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   52 and name N ) (segid  B and resid   52 and name CA)
       (segid  B and resid   52 and name C ) (segid  B and resid   53 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   53 and name N ) (segid  B and resid   53 and name CA)
       (segid  B and resid   53 and name C ) (segid  B and resid   54 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   54 and name N ) (segid  B and resid   54 and name CA)
       (segid  B and resid   54 and name C ) (segid  B and resid   55 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   55 and name N ) (segid  B and resid   55 and name CA)
       (segid  B and resid   55 and name C ) (segid  B and resid   56 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   56 and name N ) (segid  B and resid   56 and name CA)
       (segid  B and resid   56 and name C ) (segid  B and resid   57 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   57 and name N ) (segid  B and resid   57 and name CA)
       (segid  B and resid   57 and name C ) (segid  B and resid   58 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   58 and name N ) (segid  B and resid   58 and name CA)
       (segid  B and resid   58 and name C ) (segid  B and resid   59 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   59 and name N ) (segid  B and resid   59 and name CA)
       (segid  B and resid   59 and name C ) (segid  B and resid   60 and name N )  1.00  -60.00   40.00   2

assign (segid  B and resid   60 and name N ) (segid  B and resid   60 and name CA)
       (segid  B and resid   60 and name C ) (segid  B and resid   61 and name N )  1.00  -60.00   40.00   2

end
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    LEU   8           H        LEU   8 -21.287  33.441 -26.620
    2    HA   LEU   8           HA       LEU   8 -22.734  34.346 -24.643
    3   1HB   LEU   8          1HB       LEU   8 -24.502  34.184 -27.052
    4   2HB   LEU   8          2HB       LEU   8 -25.233  33.888 -25.474
    5    HG   LEU   8           HG       LEU   8 -24.068  36.059 -24.723
    6   1HD1  LEU   8          1HD1      LEU   8 -23.375  35.933 -27.581
    7   2HD1  LEU   8          2HD1      LEU   8 -24.065  37.479 -27.084
    8   3HD1  LEU   8          3HD1      LEU   8 -22.623  36.858 -26.281
    9   1HD2  LEU   8          1HD2      LEU   8 -26.562  35.606 -25.505
   10   2HD2  LEU   8          2HD2      LEU   8 -26.001  37.254 -25.218
   11   3HD2  LEU   8          3HD2      LEU   8 -26.090  36.626 -26.864
   12    H    GLU   9           H        GLU   9 -23.617  32.756 -23.208
   13    HA   GLU   9           HA       GLU   9 -23.850  30.561 -22.362
   14   1HB   GLU   9          1HB       GLU   9 -24.839  30.220 -25.214
   15   2HB   GLU   9          2HB       GLU   9 -25.177  29.113 -23.882
   16   1HG   GLU   9          1HG       GLU   9 -25.887  31.588 -22.845
   17   2HG   GLU   9          2HG       GLU   9 -26.428  31.679 -24.522
   18    HA   PRO  10           HA       PRO  10 -20.082  29.259 -24.919
   19   1HB   PRO  10          1HB       PRO  10 -18.111  29.996 -23.169
   20   2HB   PRO  10          2HB       PRO  10 -18.720  31.069 -24.445
   21   1HG   PRO  10          2HG       PRO  10 -19.348  31.038 -21.538
   22   2HG   PRO  10          1HG       PRO  10 -19.141  32.412 -22.635
   23   1HD   PRO  10          1HD       PRO  10 -21.575  31.475 -21.817
   24   2HD   PRO  10          2HD       PRO  10 -21.309  32.334 -23.351
   25    H    ASP  11           H        ASP  11 -20.372  29.245 -21.347
   26    HA   ASP  11           HA       ASP  11 -19.006  26.799 -20.860
   27   1HB   ASP  11          2HB       ASP  11 -21.361  28.055 -19.411
   28   2HB   ASP  11          1HB       ASP  11 -20.221  26.901 -18.718
   29    H    ASN  12           H        ASN  12 -22.144  27.399 -22.233
   30    HA   ASN  12           HA       ASN  12 -22.912  24.531 -21.853
   31   1HB   ASN  12          1HB       ASN  12 -24.380  26.470 -21.087
   32   2HB   ASN  12          2HB       ASN  12 -24.601  26.864 -22.792
   33   2HD2  ASN  12          2HD2      ASN  12 -25.728  25.246 -24.154
   34   1HD2  ASN  12          1HD2      ASN  12 -26.724  24.071 -23.441
   35    H    VAL  13           H        VAL  13 -21.131  26.060 -24.012
   36    HA   VAL  13           HA       VAL  13 -22.614  25.388 -26.470
   37    HB   VAL  13           HB       VAL  13 -20.144  26.864 -25.662
   38   1HG1  VAL  13          1HG1      VAL  13 -20.475  25.448 -28.296
   39   2HG1  VAL  13          2HG1      VAL  13 -19.676  27.020 -28.245
   40   3HG1  VAL  13          3HG1      VAL  13 -19.017  25.665 -27.327
   41   1HG2  VAL  13          1HG2      VAL  13 -22.667  27.567 -26.402
   42   2HG2  VAL  13          2HG2      VAL  13 -21.266  28.627 -26.556
   43   3HG2  VAL  13          3HG2      VAL  13 -21.823  27.694 -27.946
   44    HA   PRO  14           HA       PRO  14 -19.179  22.139 -26.712
   45   1HB   PRO  14          1HB       PRO  14 -17.440  21.832 -24.623
   46   2HB   PRO  14          2HB       PRO  14 -17.165  22.974 -25.952
   47   1HG   PRO  14          2HG       PRO  14 -17.983  23.492 -23.174
   48   2HG   PRO  14          1HG       PRO  14 -17.149  24.540 -24.326
   49   1HD   PRO  14          1HD       PRO  14 -19.879  24.634 -23.615
   50   2HD   PRO  14          2HD       PRO  14 -19.074  25.532 -24.912
   51    H    MET  15           H        MET  15 -18.983  21.864 -23.184
   52    HA   MET  15           HA       MET  15 -21.359  20.291 -22.811
   53   1HB   MET  15          1HB       MET  15 -19.184  19.045 -24.152
   54   2HB   MET  15          2HB       MET  15 -19.250  18.345 -22.534
   55   1HG   MET  15          1HG       MET  15 -21.744  18.025 -22.895
   56   2HG   MET  15          2HG       MET  15 -21.474  18.458 -24.584
   57   1HE   MET  15          1HE       MET  15 -21.519  16.996 -26.112
   58   2HE   MET  15          2HE       MET  15 -21.064  15.294 -26.128
   59   3HE   MET  15          3HE       MET  15 -22.503  15.820 -25.244
   60    H    ASP  16           H        ASP  16 -20.744  18.685 -20.736
   61    HA   ASP  16           HA       ASP  16 -18.820  19.960 -18.906
   62   1HB   ASP  16          1HB       ASP  16 -20.931  21.379 -18.986
   63   2HB   ASP  16          2HB       ASP  16 -21.786  20.004 -18.286
   64    H    MET  17           H        MET  17 -19.186  17.264 -19.950
   65    HA   MET  17           HA       MET  17 -20.567  15.476 -18.251
   66   1HB   MET  17          1HB       MET  17 -18.909  13.844 -19.124
   67   2HB   MET  17          2HB       MET  17 -19.491  14.914 -20.400
   68   1HG   MET  17          1HG       MET  17 -17.446  16.395 -19.802
   69   2HG   MET  17          2HG       MET  17 -16.833  14.961 -18.978
   70   1HE   MET  17          1HE       MET  17 -15.222  16.171 -20.661
   71   2HE   MET  17          2HE       MET  17 -14.728  15.238 -22.080
   72   3HE   MET  17          3HE       MET  17 -15.855  16.581 -22.253
   73    H    SER  18           H        SER  18 -17.312  16.888 -17.905
   74    HA   SER  18           HA       SER  18 -17.400  16.380 -14.998
   75   1HB   SER  18          1HB       SER  18 -15.463  15.057 -16.917
   76   2HB   SER  18          2HB       SER  18 -15.194  15.126 -15.177
   77    HG   SER  18           HG       SER  18 -17.110  13.987 -14.882
   78    HA   PRO  19           HA       PRO  19 -14.891  19.976 -14.942
   79   1HB   PRO  19          1HB       PRO  19 -13.193  19.525 -12.842
   80   2HB   PRO  19          2HB       PRO  19 -14.913  19.912 -12.635
   81   1HG   PRO  19          2HG       PRO  19 -13.547  17.265 -12.541
   82   2HG   PRO  19          1HG       PRO  19 -14.850  17.898 -11.522
   83   1HD   PRO  19          1HD       PRO  19 -15.276  16.153 -13.551
   84   2HD   PRO  19          2HD       PRO  19 -16.479  17.360 -13.045
   85    H    LYS  20           H        LYS  20 -13.531  16.983 -15.675
   86    HA   LYS  20           HA       LYS  20 -11.625  16.376 -16.921
   87   1HB   LYS  20          1HB       LYS  20 -12.475  18.485 -18.122
   88   2HB   LYS  20          2HB       LYS  20 -11.200  19.353 -17.268
   89   1HG   LYS  20          1HG       LYS  20 -10.660  16.879 -18.922
   90   2HG   LYS  20          2HG       LYS  20 -10.583  18.509 -19.592
   91   1HD   LYS  20          1HD       LYS  20  -9.007  19.017 -17.585
   92   2HD   LYS  20          2HD       LYS  20  -8.846  17.264 -17.468
   93   1HE   LYS  20          1HE       LYS  20  -8.227  17.255 -19.935
   94   2HE   LYS  20          2HE       LYS  20  -8.132  19.024 -19.834
   95   1HZ   LYS  20          1HZ       LYS  20  -6.645  18.733 -17.893
   96   2HZ   LYS  20          2HZ       LYS  20  -6.626  17.063 -18.187
   97   3HZ   LYS  20          3HZ       LYS  20  -5.980  18.134 -19.337
   98    H    ALA  21           H        ALA  21 -10.531  19.483 -15.475
   99    HA   ALA  21           HA       ALA  21  -7.930  18.663 -14.800
  100   1HB   ALA  21          1HB       ALA  21  -8.206  20.494 -13.025
  101   2HB   ALA  21          2HB       ALA  21  -8.596  20.964 -14.680
  102   3HB   ALA  21          3HB       ALA  21  -9.890  20.598 -13.539
  103    H    LEU  22           H        LEU  22 -10.686  18.831 -12.517
  104    HA   LEU  22           HA       LEU  22  -9.465  17.424 -10.380
  105   1HB   LEU  22          1HB       LEU  22 -11.441  18.576  -9.890
  106   2HB   LEU  22          2HB       LEU  22 -12.245  18.020 -11.352
  107    HG   LEU  22           HG       LEU  22 -12.505  15.782 -10.398
  108   1HD1  LEU  22          1HD1      LEU  22 -10.929  16.976  -8.110
  109   2HD1  LEU  22          2HD1      LEU  22 -11.869  15.492  -7.949
  110   3HD1  LEU  22          3HD1      LEU  22 -10.520  15.564  -9.084
  111   1HD2  LEU  22          1HD2      LEU  22 -13.461  18.187  -8.899
  112   2HD2  LEU  22          2HD2      LEU  22 -14.387  16.983  -9.797
  113   3HD2  LEU  22          3HD2      LEU  22 -13.765  16.600  -8.191
  114    H    GLN  23           H        GLN  23 -11.863  16.105 -12.697
  115    HA   GLN  23           HA       GLN  23 -11.671  13.386 -12.077
  116   1HB   GLN  23          1HB       GLN  23 -13.272  14.415 -13.640
  117   2HB   GLN  23          2HB       GLN  23 -11.966  14.748 -14.778
  118   1HG   GLN  23          1HG       GLN  23 -11.579  12.097 -14.427
  119   2HG   GLN  23          2HG       GLN  23 -13.318  12.176 -14.147
  120   2HE2  GLN  23          2HE2      GLN  23 -11.731  11.108 -16.536
  121   1HE2  GLN  23          1HE2      GLN  23 -12.387  11.920 -17.875
  122    H    GLN  24           H        GLN  24  -9.464  15.347 -14.042
  123    HA   GLN  24           HA       GLN  24  -7.904  13.118 -15.047
  124   1HB   GLN  24          1HB       GLN  24  -8.024  15.331 -16.117
  125   2HB   GLN  24          2HB       GLN  24  -7.307  16.073 -14.687
  126   1HG   GLN  24          2HG       GLN  24  -5.497  15.790 -16.204
  127   2HG   GLN  24          1HG       GLN  24  -5.332  14.472 -15.043
  128   2HE2  GLN  24          2HE2      GLN  24  -4.893  12.521 -16.066
  129   1HE2  GLN  24          1HE2      GLN  24  -5.480  12.061 -17.590
  130    H    LYS  25           H        LYS  25  -7.662  15.273 -12.232
  131    HA   LYS  25           HA       LYS  25  -5.062  14.332 -11.366
  132   1HB   LYS  25          1HB       LYS  25  -7.217  16.129 -10.518
  133   2HB   LYS  25          2HB       LYS  25  -6.426  15.331  -9.158
  134   1HG   LYS  25          2HG       LYS  25  -5.162  17.315  -9.551
  135   2HG   LYS  25          1HG       LYS  25  -4.207  16.003 -10.243
  136   1HD   LYS  25          1HD       LYS  25  -5.825  16.701 -12.355
  137   2HD   LYS  25          2HD       LYS  25  -5.537  18.261 -11.583
  138   1HE   LYS  25          1HE       LYS  25  -3.093  16.662 -11.725
  139   2HE   LYS  25          2HE       LYS  25  -3.781  16.982 -13.329
  140   1HZ   LYS  25          1HZ       LYS  25  -3.582  19.089 -11.259
  141   2HZ   LYS  25          2HZ       LYS  25  -2.314  18.788 -12.350
  142   3HZ   LYS  25          3HZ       LYS  25  -3.836  19.275 -12.926
  143    H    ILE  26           H        ILE  26  -8.413  13.570 -10.369
  144    HA   ILE  26           HA       ILE  26  -7.869  11.749  -8.285
  145    HB   ILE  26           HB       ILE  26 -10.037  11.783 -10.411
  146   1HG1  ILE  26          1HG1      ILE  26 -10.203  12.779  -7.564
  147   2HG1  ILE  26          2HG1      ILE  26  -9.622  13.818  -8.865
  148   1HG2  ILE  26          1HG2      ILE  26  -9.896  10.371  -7.730
  149   2HG2  ILE  26          2HG2      ILE  26 -11.366  10.538  -8.691
  150   3HG2  ILE  26          3HG2      ILE  26 -10.004   9.609  -9.317
  151   1HD1  ILE  26          1HD1      ILE  26 -12.130  12.348  -9.435
  152   2HD1  ILE  26          2HD1      ILE  26 -12.245  13.592  -8.191
  153   3HD1  ILE  26          3HD1      ILE  26 -11.691  14.015  -9.811
  154    H    HIS  27           H        HIS  27  -8.459  10.954 -11.737
  155    HA   HIS  27           HA       HIS  27  -7.843   8.178 -11.541
  156   1HB   HIS  27          1HB       HIS  27  -8.919   9.670 -13.402
  157   2HB   HIS  27          2HB       HIS  27  -7.258   9.881 -13.958
  158    HD1  HIS  27           HD1      HIS  27  -7.177   8.376 -15.979
  159    HD2  HIS  27           HD2      HIS  27  -8.818   6.461 -12.659
  160    HE1  HIS  27           HE1      HIS  27  -7.474   5.946 -16.628
  161    H    GLU  28           H        GLU  28  -5.773  10.984 -11.624
  162    HA   GLU  28           HA       GLU  28  -3.369   9.549 -12.480
  163   1HB   GLU  28          1HB       GLU  28  -4.239  12.271 -11.729
  164   2HB   GLU  28          2HB       GLU  28  -2.562  11.903 -11.324
  165   1HG   GLU  28          1HG       GLU  28  -3.415  11.006 -14.007
  166   2HG   GLU  28          2HG       GLU  28  -3.380  12.755 -13.786
  167    H    LEU  29           H        LEU  29  -4.641  10.808  -9.384
  168    HA   LEU  29           HA       LEU  29  -2.381   9.936  -7.803
  169   1HB   LEU  29          1HB       LEU  29  -5.231  10.788  -7.276
  170   2HB   LEU  29          2HB       LEU  29  -4.157  10.317  -5.959
  171    HG   LEU  29           HG       LEU  29  -3.184  12.310  -7.976
  172   1HD1  LEU  29          1HD1      LEU  29  -5.047  12.895  -5.654
  173   2HD1  LEU  29          2HD1      LEU  29  -4.128  14.122  -6.527
  174   3HD1  LEU  29          3HD1      LEU  29  -5.370  13.190  -7.363
  175   1HD2  LEU  29          1HD2      LEU  29  -2.695  11.635  -5.074
  176   2HD2  LEU  29          2HD2      LEU  29  -1.539  11.662  -6.405
  177   3HD2  LEU  29          3HD2      LEU  29  -2.166  13.175  -5.751
  178    H    GLU  30           H        GLU  30  -5.614   8.541  -8.434
  179    HA   GLU  30           HA       GLU  30  -5.396   6.282  -6.703
  180   1HB   GLU  30          1HB       GLU  30  -7.398   7.265  -7.976
  181   2HB   GLU  30          2HB       GLU  30  -6.803   6.381  -9.382
  182   1HG   GLU  30          1HG       GLU  30  -6.768   4.556  -7.215
  183   2HG   GLU  30          2HG       GLU  30  -8.323   5.385  -7.147
  184    H    GLY  31           H        GLY  31  -4.510   6.674 -10.146
  185   1HA   GLY  31          2HA       GLY  31  -3.193   5.322 -11.541
  186   2HA   GLY  31          1HA       GLY  31  -3.665   3.958 -10.527
  187    H    LEU  32           H        LEU  32  -2.166   6.692  -8.997
  188    HA   LEU  32           HA       LEU  32   0.583   5.790  -9.238
  189   1HB   LEU  32          1HB       LEU  32  -0.543   8.113  -8.667
  190   2HB   LEU  32          2HB       LEU  32  -0.462   7.513  -7.010
  191    HG   LEU  32           HG       LEU  32   1.996   7.014  -7.436
  192   1HD1  LEU  32          1HD1      LEU  32   1.443   7.347 -10.032
  193   2HD1  LEU  32          2HD1      LEU  32   1.890   9.011  -9.654
  194   3HD1  LEU  32          3HD1      LEU  32   3.040   7.704  -9.375
  195   1HD2  LEU  32          1HD2      LEU  32   0.660   9.598  -7.061
  196   2HD2  LEU  32          2HD2      LEU  32   2.017   8.900  -6.177
  197   3HD2  LEU  32          3HD2      LEU  32   2.300   9.761  -7.690
  198    H    MET  33           H        MET  33  -1.954   5.445  -6.754
  199    HA   MET  33           HA       MET  33  -0.474   4.287  -4.662
  200   1HB   MET  33          1HB       MET  33  -3.255   4.260  -5.687
  201   2HB   MET  33          2HB       MET  33  -2.844   2.943  -4.588
  202   1HG   MET  33          1HG       MET  33  -2.410   4.383  -2.807
  203   2HG   MET  33          2HG       MET  33  -2.050   5.746  -3.867
  204   1HE   MET  33          1HE       MET  33  -4.575   3.082  -3.776
  205   2HE   MET  33          2HE       MET  33  -5.256   3.640  -2.253
  206   3HE   MET  33          3HE       MET  33  -6.164   3.844  -3.758
  207    H    MET  34           H        MET  34  -2.129   2.570  -7.342
  208    HA   MET  34           HA       MET  34  -1.452  -0.072  -6.749
  209   1HB   MET  34          1HB       MET  34  -2.120   1.562  -9.096
  210   2HB   MET  34          2HB       MET  34  -1.191   0.118  -9.499
  211   1HG   MET  34          1HG       MET  34  -3.517  -0.095  -7.609
  212   2HG   MET  34          2HG       MET  34  -3.808  -0.037  -9.348
  213   1HE   MET  34          1HE       MET  34  -3.465  -1.721  -6.485
  214   2HE   MET  34          2HE       MET  34  -3.281  -3.430  -6.874
  215   3HE   MET  34          3HE       MET  34  -1.861  -2.449  -6.488
  216    H    GLN  35           H        GLN  35   0.545   2.296  -8.542
  217    HA   GLN  35           HA       GLN  35   2.723   0.671  -9.243
  218   1HB   GLN  35          1HB       GLN  35   2.428   2.989  -9.945
  219   2HB   GLN  35          2HB       GLN  35   2.603   3.548  -8.283
  220   1HG   GLN  35          2HG       GLN  35   4.804   3.782  -8.740
  221   2HG   GLN  35          1HG       GLN  35   4.890   2.021  -8.693
  222   2HE2  GLN  35          2HE2      GLN  35   4.778   4.818 -10.848
  223   1HE2  GLN  35          1HE2      GLN  35   5.113   3.960 -12.274
  224    H    HIS  36           H        HIS  36   3.009   2.921  -6.493
  225    HA   HIS  36           HA       HIS  36   5.140   1.605  -5.207
  226   1HB   HIS  36          1HB       HIS  36   3.011   3.560  -4.540
  227   2HB   HIS  36          2HB       HIS  36   3.823   2.809  -3.165
  228    HD1  HIS  36           HD1      HIS  36   5.190   4.903  -2.530
  229    HD2  HIS  36           HD2      HIS  36   5.832   3.641  -6.451
  230    HE1  HIS  36           HE1      HIS  36   7.197   6.194  -3.379
  231    H    ALA  37           H        ALA  37   1.660   1.389  -4.320
  232    HA   ALA  37           HA       ALA  37   1.759  -0.496  -2.272
  233   1HB   ALA  37          1HB       ALA  37  -0.518  -1.176  -3.220
  234   2HB   ALA  37          3HB       ALA  37  -0.297   0.553  -2.950
  235   3HB   ALA  37          2HB       ALA  37  -0.169  -0.109  -4.580
  236    H    GLN  38           H        GLN  38   2.190  -1.032  -5.735
  237    HA   GLN  38           HA       GLN  38   2.118  -3.957  -5.532
  238   1HB   GLN  38          1HB       GLN  38   2.667  -1.854  -7.605
  239   2HB   GLN  38          2HB       GLN  38   3.172  -3.512  -7.930
  240   1HG   GLN  38          1HG       GLN  38   0.854  -4.282  -7.440
  241   2HG   GLN  38          2HG       GLN  38   0.367  -2.599  -7.229
  242   2HE2  GLN  38          2HE2      GLN  38   1.450  -1.230  -9.295
  243   1HE2  GLN  38          1HE2      GLN  38   1.009  -1.889 -10.796
  244    H    ASN  39           H        ASN  39   4.554  -1.391  -5.604
  245    HA   ASN  39           HA       ASN  39   6.766  -3.375  -5.503
  246   1HB   ASN  39          1HB       ASN  39   6.385  -0.472  -6.077
  247   2HB   ASN  39          2HB       ASN  39   7.945  -0.950  -5.407
  248   2HD2  ASN  39          2HD2      ASN  39   7.057  -0.122  -8.263
  249   1HD2  ASN  39          1HD2      ASN  39   7.683  -1.354  -9.247
  250    H    LEU  40           H        LEU  40   4.762  -2.803  -3.265
  251    HA   LEU  40           HA       LEU  40   4.803  -2.578  -0.925
  252   1HB   LEU  40          1HB       LEU  40   7.575  -3.446  -1.724
  253   2HB   LEU  40          2HB       LEU  40   7.195  -3.152  -0.027
  254    HG   LEU  40           HG       LEU  40   5.071  -4.660  -0.646
  255   1HD1  LEU  40          1HD1      LEU  40   7.008  -5.038  -2.835
  256   2HD1  LEU  40          2HD1      LEU  40   6.467  -6.540  -2.085
  257   3HD1  LEU  40          3HD1      LEU  40   5.288  -5.424  -2.775
  258   1HD2  LEU  40          1HD2      LEU  40   7.224  -4.965   0.929
  259   2HD2  LEU  40          2HD2      LEU  40   6.090  -6.284   0.638
  260   3HD2  LEU  40          3HD2      LEU  40   7.600  -6.201  -0.270
  261    H    GLU  41           H        GLU  41   5.328  -0.155  -2.614
  262    HA   GLU  41           HA       GLU  41   7.038   1.420  -0.720
  263   1HB   GLU  41          1HB       GLU  41   6.239   1.710  -3.622
  264   2HB   GLU  41          2HB       GLU  41   6.975   3.039  -2.728
  265   1HG   GLU  41          1HG       GLU  41   8.269   0.329  -2.683
  266   2HG   GLU  41          2HG       GLU  41   8.511   1.387  -4.073
  267    H    PHE  42           H        PHE  42   4.042   0.611  -0.632
  268    HA   PHE  42           HA       PHE  42   2.379   2.856  -1.054
  269   1HB   PHE  42          1HB       PHE  42   0.906   1.635   0.574
  270   2HB   PHE  42          2HB       PHE  42   1.532   0.621  -0.721
  271    HD1  PHE  42           HD1      PHE  42   2.491   1.753   2.755
  272    HD2  PHE  42           HD2      PHE  42   2.480  -1.448  -0.147
  273    HE1  PHE  42           HE1      PHE  42   3.493   0.220   4.436
  274    HE2  PHE  42           HE2      PHE  42   3.464  -2.974   1.538
  275    HZ   PHE  42           HZ       PHE  42   3.973  -2.143   3.834
  276    H    GLU  43           H        GLU  43   4.883   2.550   1.286
  277    HA   GLU  43           HA       GLU  43   3.890   3.740   3.613
  278   1HB   GLU  43          1HB       GLU  43   6.195   2.960   3.293
  279   2HB   GLU  43          2HB       GLU  43   6.485   4.237   2.111
  280   1HG   GLU  43          1HG       GLU  43   5.697   5.801   4.105
  281   2HG   GLU  43          2HG       GLU  43   6.222   4.433   5.087
  282    H    GLU  44           H        GLU  44   5.549   5.631   1.090
  283    HA   GLU  44           HA       GLU  44   4.137   8.084   1.885
  284   1HB   GLU  44          1HB       GLU  44   5.567   9.045   0.089
  285   2HB   GLU  44          2HB       GLU  44   6.509   8.057   1.207
  286   1HG   GLU  44          1HG       GLU  44   7.091   6.623  -0.431
  287   2HG   GLU  44          2HG       GLU  44   5.415   6.444  -0.949
  288    H    ALA  45           H        ALA  45   3.712   5.512  -0.404
  289    HA   ALA  45           HA       ALA  45   2.161   6.986  -2.372
  290   1HB   ALA  45          1HB       ALA  45   1.601   4.233  -2.508
  291   2HB   ALA  45          3HB       ALA  45   3.246   4.334  -1.879
  292   3HB   ALA  45          2HB       ALA  45   2.838   5.103  -3.414
  293    H    ALA  46           H        ALA  46   1.241   4.578   0.137
  294    HA   ALA  46           HA       ALA  46  -1.529   4.560  -0.277
  295   1HB   ALA  46          1HB       ALA  46   0.214   4.318   2.177
  296   2HB   ALA  46          3HB       ALA  46  -0.569   3.030   1.257
  297   3HB   ALA  46          2HB       ALA  46  -1.533   4.106   2.270
  298    H    GLN  47           H        GLN  47   0.438   7.120   1.077
  299    HA   GLN  47           HA       GLN  47  -1.461   8.556   2.602
  300   1HB   GLN  47          1HB       GLN  47   0.640   9.640   0.698
  301   2HB   GLN  47          2HB       GLN  47  -0.026  10.471   2.104
  302   1HG   GLN  47          1HG       GLN  47   0.801   8.239   3.330
  303   2HG   GLN  47          2HG       GLN  47   1.939   8.229   1.982
  304   2HE2  GLN  47          2HE2      GLN  47   1.052   9.890   4.945
  305   1HE2  GLN  47          1HE2      GLN  47   2.342  10.993   4.939
  306    H    ILE  48           H        ILE  48  -1.059   8.290  -0.901
  307    HA   ILE  48           HA       ILE  48  -2.674  10.424  -1.804
  308    HB   ILE  48           HB       ILE  48  -2.325   7.581  -2.818
  309   1HG1  ILE  48          1HG1      ILE  48  -1.005  10.029  -3.951
  310   2HG1  ILE  48          2HG1      ILE  48  -0.347   9.303  -2.484
  311   1HG2  ILE  48          1HG2      ILE  48  -3.416  10.063  -4.176
  312   2HG2  ILE  48          2HG2      ILE  48  -2.951   8.593  -5.033
  313   3HG2  ILE  48          3HG2      ILE  48  -4.280   8.555  -3.874
  314   1HD1  ILE  48          1HD1      ILE  48  -0.992   7.357  -4.600
  315   2HD1  ILE  48          2HD1      ILE  48   0.281   8.498  -5.034
  316   3HD1  ILE  48          3HD1      ILE  48   0.452   7.491  -3.596
  317    H    ARG  49           H        ARG  49  -3.541   7.367  -0.316
  318    HA   ARG  49           HA       ARG  49  -6.236   7.026  -0.983
  319   1HB   ARG  49          1HB       ARG  49  -5.072   5.464   0.407
  320   2HB   ARG  49          2HB       ARG  49  -4.666   6.704   1.586
  321   1HG   ARG  49          1HG       ARG  49  -7.511   6.653   1.334
  322   2HG   ARG  49          2HG       ARG  49  -6.957   4.992   1.535
  323   1HD   ARG  49          1HD       ARG  49  -7.371   6.111   3.733
  324   2HD   ARG  49          2HD       ARG  49  -5.668   5.651   3.540
  325    HE   ARG  49           HE       ARG  49  -5.198   8.011   2.890
  326   1HH1  ARG  49          1HH1      ARG  49  -8.471   8.016   2.843
  327   2HH1  ARG  49          2HH1      ARG  49  -8.703   9.292   3.992
  328   1HH2  ARG  49          1HH2      ARG  49  -5.389   9.337   5.010
  329   2HH2  ARG  49          2HH2      ARG  49  -6.958  10.040   5.219
  330    H    ASP  50           H        ASP  50  -4.792   9.406   1.212
  331    HA   ASP  50           HA       ASP  50  -7.298  10.383   2.299
  332   1HB   ASP  50          1HB       ASP  50  -4.969  10.587   3.272
  333   2HB   ASP  50          2HB       ASP  50  -4.621  11.783   2.023
  334    H    GLN  51           H        GLN  51  -5.222  11.311  -0.434
  335    HA   GLN  51           HA       GLN  51  -6.846  13.650  -1.124
  336   1HB   GLN  51          2HB       GLN  51  -4.727  12.117  -2.670
  337   2HB   GLN  51          1HB       GLN  51  -5.275  13.759  -3.008
  338   1HG   GLN  51          1HG       GLN  51  -4.352  14.593  -0.969
  339   2HG   GLN  51          2HG       GLN  51  -4.091  12.965  -0.341
  340   2HE2  GLN  51          2HE2      GLN  51  -3.357  13.942  -3.689
  341   1HE2  GLN  51          1HE2      GLN  51  -1.675  13.759  -3.550
  342    H    LEU  52           H        LEU  52  -6.555  10.282  -2.196
  343    HA   LEU  52           HA       LEU  52  -8.203  10.494  -4.543
  344   1HB   LEU  52          1HB       LEU  52  -6.714   8.565  -3.099
  345   2HB   LEU  52          2HB       LEU  52  -8.355   7.928  -3.219
  346    HG   LEU  52           HG       LEU  52  -6.999   7.245  -5.165
  347   1HD1  LEU  52          1HD1      LEU  52  -9.540   8.260  -5.196
  348   2HD1  LEU  52          2HD1      LEU  52  -8.760   9.255  -6.426
  349   3HD1  LEU  52          3HD1      LEU  52  -8.763   7.499  -6.584
  350   1HD2  LEU  52          1HD2      LEU  52  -6.285  10.086  -5.070
  351   2HD2  LEU  52          2HD2      LEU  52  -5.435   8.743  -5.833
  352   3HD2  LEU  52          3HD2      LEU  52  -6.747   9.555  -6.687
  353    H    HIS  53           H        HIS  53  -8.927   9.827  -1.127
  354    HA   HIS  53           HA       HIS  53 -11.743   9.237  -1.602
  355   1HB   HIS  53          1HB       HIS  53  -9.947   9.751   0.766
  356   2HB   HIS  53          2HB       HIS  53 -11.690   9.589   0.984
  357    HD1  HIS  53           HD1      HIS  53  -9.620   7.626  -1.510
  358    HD2  HIS  53           HD2      HIS  53 -11.729   6.988   2.029
  359    HE1  HIS  53           HE1      HIS  53  -9.683   5.119  -1.157
  360    H    GLN  54           H        GLN  54  -9.930  12.051  -0.339
  361    HA   GLN  54           HA       GLN  54 -12.206  13.713   0.173
  362   1HB   GLN  54          1HB       GLN  54  -9.703  13.883   0.856
  363   2HB   GLN  54          2HB       GLN  54  -9.484  14.682  -0.701
  364   1HG   GLN  54          1HG       GLN  54 -11.589  16.089   0.129
  365   2HG   GLN  54          2HG       GLN  54 -10.977  15.615   1.714
  366   2HE2  GLN  54          2HE2      GLN  54 -10.927  18.340   0.439
  367   1HE2  GLN  54          1HE2      GLN  54  -9.291  18.792   0.405
  368    H    LEU  55           H        LEU  55 -10.077  13.436  -2.689
  369    HA   LEU  55           HA       LEU  55 -11.359  15.483  -4.239
  370   1HB   LEU  55          1HB       LEU  55  -9.654  13.057  -4.809
  371   2HB   LEU  55          2HB       LEU  55 -10.241  14.082  -6.119
  372    HG   LEU  55           HG       LEU  55  -8.896  15.350  -3.754
  373   1HD1  LEU  55          1HD1      LEU  55  -7.657  13.568  -5.763
  374   2HD1  LEU  55          2HD1      LEU  55  -6.865  15.132  -5.569
  375   3HD1  LEU  55          3HD1      LEU  55  -7.062  14.065  -4.178
  376   1HD2  LEU  55          1HD2      LEU  55  -9.163  15.973  -6.711
  377   2HD2  LEU  55          2HD2      LEU  55  -9.934  16.824  -5.372
  378   3HD2  LEU  55          3HD2      LEU  55  -8.188  16.928  -5.594
  379    H    ARG  56           H        ARG  56 -12.190  12.151  -3.568
  380    HA   ARG  56           HA       ARG  56 -13.864  11.579  -5.805
  381   1HB   ARG  56          1HB       ARG  56 -13.005  10.021  -4.016
  382   2HB   ARG  56          2HB       ARG  56 -14.194  10.718  -2.914
  383   1HG   ARG  56          1HG       ARG  56 -15.810  10.149  -5.001
  384   2HG   ARG  56          2HG       ARG  56 -14.596   8.887  -5.222
  385   1HD   ARG  56          1HD       ARG  56 -14.903   8.412  -2.691
  386   2HD   ARG  56          2HD       ARG  56 -16.400   9.355  -2.843
  387    HE   ARG  56           HE       ARG  56 -16.716   7.710  -4.933
  388   1HH1  ARG  56          1HH1      ARG  56 -16.646   7.269  -1.606
  389   2HH1  ARG  56          2HH1      ARG  56 -16.648   5.537  -1.659
  390   1HH2  ARG  56          1HH2      ARG  56 -16.215   5.377  -5.095
  391   2HH2  ARG  56          2HH2      ARG  56 -16.404   4.466  -3.634
  392    H    GLU  57           H        GLU  57 -14.933  12.561  -2.520
  393    HA   GLU  57           HA       GLU  57 -17.627  13.105  -3.149
  394   1HB   GLU  57          1HB       GLU  57 -16.656  12.973  -0.887
  395   2HB   GLU  57          2HB       GLU  57 -15.756  14.462  -1.180
  396   1HG   GLU  57          2HG       GLU  57 -17.767  15.000   0.080
  397   2HG   GLU  57          1HG       GLU  57 -17.929  15.645  -1.553
  398    H    LEU  58           H        LEU  58 -14.769  15.204  -3.442
  399    HA   LEU  58           HA       LEU  58 -16.152  17.627  -4.101
  400   1HB   LEU  58          1HB       LEU  58 -13.397  16.516  -4.699
  401   2HB   LEU  58          2HB       LEU  58 -13.865  18.171  -5.093
  402    HG   LEU  58           HG       LEU  58 -14.240  17.069  -2.311
  403   1HD1  LEU  58          1HD1      LEU  58 -11.741  17.493  -3.653
  404   2HD1  LEU  58          2HD1      LEU  58 -11.941  18.749  -2.431
  405   3HD1  LEU  58          3HD1      LEU  58 -12.017  17.048  -1.969
  406   1HD2  LEU  58          1HD2      LEU  58 -15.199  19.316  -3.366
  407   2HD2  LEU  58          2HD2      LEU  58 -14.579  19.287  -1.715
  408   3HD2  LEU  58          3HD2      LEU  58 -13.570  19.901  -3.025
  409    H    PHE  59           H        PHE  59 -15.524  14.740  -5.934
  410    HA   PHE  59           HA       PHE  59 -15.406  15.624  -8.591
  411   1HB   PHE  59          1HB       PHE  59 -15.262  13.283  -7.719
  412   2HB   PHE  59          2HB       PHE  59 -17.007  13.305  -7.463
  413    HD1  PHE  59           HD1      PHE  59 -18.571  13.521  -9.410
  414    HD2  PHE  59           HD2      PHE  59 -14.313  13.028  -9.924
  415    HE1  PHE  59           HE1      PHE  59 -18.932  12.894 -11.796
  416    HE2  PHE  59           HE2      PHE  59 -14.673  12.401 -12.310
  417    HZ   PHE  59           HZ       PHE  59 -16.983  12.334 -13.246
  418    H    ILE  60           H        ILE  60 -18.331  15.111  -6.591
  419    HA   ILE  60           HA       ILE  60 -20.145  15.996  -8.696
  420    HB   ILE  60           HB       ILE  60 -20.485  15.638  -5.699
  421   1HG1  ILE  60          1HG1      ILE  60 -21.181  13.720  -7.940
  422   2HG1  ILE  60          2HG1      ILE  60 -19.667  13.635  -7.037
  423   1HG2  ILE  60          1HG2      ILE  60 -22.272  16.529  -7.819
  424   2HG2  ILE  60          2HG2      ILE  60 -22.873  15.065  -7.040
  425   3HG2  ILE  60          3HG2      ILE  60 -22.536  16.502  -6.075
  426   1HD1  ILE  60          1HD1      ILE  60 -21.020  13.490  -4.920
  427   2HD1  ILE  60          2HD1      ILE  60 -22.471  13.374  -5.916
  428   3HD1  ILE  60          3HD1      ILE  60 -21.240  12.113  -6.000
  429    H    ALA  61           H        ALA  61 -19.012  17.429  -5.610
  430    HA   ALA  61           HA       ALA  61 -20.367  19.895  -5.740
  431   1HB   ALA  61          1HB       ALA  61 -17.507  19.547  -4.823
  432   2HB   ALA  61          2HB       ALA  61 -18.755  20.582  -4.128
  433   3HB   ALA  61          3HB       ALA  61 -18.855  18.832  -3.938
  434    H    ALA  62           H        ALA  62 -17.642  18.751  -7.614
  435    HA   ALA  62           HA       ALA  62 -16.882  21.429  -8.569
  436   1HB   ALA  62          1HB       ALA  62 -16.033  18.578  -8.935
  437   2HB   ALA  62          3HB       ALA  62 -15.530  19.760 -10.144
  438   3HB   ALA  62          2HB       ALA  62 -15.070  19.975  -8.455
  439    H    SER  63           H        SER  63 -17.622  18.528 -10.511
  440    HA   SER  63           HA       SER  63 -19.890  19.756 -11.869
  441   1HB   SER  63          1HB       SER  63 -17.091  19.957 -12.908
  442   2HB   SER  63          2HB       SER  63 -18.386  19.702 -14.075
  443    HG   SER  63           HG       SER  63 -19.049  21.671 -13.736
  444    H    LEU   8           H        LEU   8  21.635 -35.301  23.805
  445    HA   LEU   8           HA       LEU   8  23.130 -33.674  25.198
  446   1HB   LEU   8          1HB       LEU   8  24.863 -35.942  24.298
  447   2HB   LEU   8          2HB       LEU   8  25.605 -34.348  24.448
  448    HG   LEU   8           HG       LEU   8  24.507 -34.250  26.777
  449   1HD1  LEU   8          1HD1      LEU   8  23.778 -36.948  25.854
  450   2HD1  LEU   8          2HD1      LEU   8  24.515 -36.920  27.456
  451   3HD1  LEU   8          3HD1      LEU   8  23.066 -35.967  27.135
  452   1HD2  LEU   8          1HD2      LEU   8  26.979 -34.878  26.045
  453   2HD2  LEU   8          2HD2      LEU   8  26.466 -35.075  27.721
  454   3HD2  LEU   8          3HD2      LEU   8  26.518 -36.471  26.645
  455    H    GLU   9           H        GLU   9  23.987 -31.846  24.063
  456    HA   GLU   9           HA       GLU   9  24.171 -30.405  22.198
  457   1HB   GLU   9          1HB       GLU   9  25.116 -33.041  21.023
  458   2HB   GLU   9          2HB       GLU   9  25.440 -31.449  20.336
  459   1HG   GLU   9          1HG       GLU   9  26.229 -31.172  22.983
  460   2HG   GLU   9          2HG       GLU   9  26.751 -32.806  22.572
  461    HA   PRO  10           HA       PRO  10  20.338 -32.464  20.327
  462   1HB   PRO  10          1HB       PRO  10  18.409 -30.993  21.593
  463   2HB   PRO  10          2HB       PRO  10  19.032 -32.526  22.236
  464   1HG   PRO  10          2HG       PRO  10  19.694 -29.736  23.024
  465   2HG   PRO  10          1HG       PRO  10  19.511 -31.181  24.030
  466   1HD   PRO  10          1HD       PRO  10  21.928 -30.137  23.297
  467   2HD   PRO  10          2HD       PRO  10  21.668 -31.852  23.686
  468    H    ASP  11           H        ASP  11  20.671 -29.040  21.332
  469    HA   ASP  11           HA       ASP  11  19.245 -27.863  19.171
  470   1HB   ASP  11          2HB       ASP  11  21.652 -26.848  20.721
  471   2HB   ASP  11          1HB       ASP  11  20.490 -25.847  19.849
  472    H    ASN  12           H        ASN  12  22.382 -29.365  19.258
  473    HA   ASN  12           HA       ASN  12  23.077 -28.179  16.599
  474   1HB   ASN  12          1HB       ASN  12  24.605 -28.008  18.632
  475   2HB   ASN  12          2HB       ASN  12  24.816 -29.755  18.515
  476   2HD2  ASN  12          2HD2      ASN  12  25.881 -30.601  16.540
  477   1HD2  ASN  12          1HD2      ASN  12  26.856 -29.584  15.592
  478    H    VAL  13           H        VAL  13  21.313 -30.681  17.496
  479    HA   VAL  13           HA       VAL  13  22.748 -32.847  16.102
  480    HB   VAL  13           HB       VAL  13  20.327 -32.490  17.820
  481   1HG1  VAL  13          1HG1      VAL  13  20.592 -34.606  15.698
  482   2HG1  VAL  13          2HG1      VAL  13  19.835 -35.007  17.240
  483   3HG1  VAL  13          3HG1      VAL  13  19.150 -33.737  16.226
  484   1HG2  VAL  13          1HG2      VAL  13  22.860 -33.408  18.206
  485   2HG2  VAL  13          2HG2      VAL  13  21.487 -33.855  19.218
  486   3HG2  VAL  13          3HG2      VAL  13  22.002 -34.920  17.910
  487    HA   PRO  14           HA       PRO  14  19.225 -32.128  13.022
  488   1HB   PRO  14          1HB       PRO  14  17.503 -30.034  13.380
  489   2HB   PRO  14          2HB       PRO  14  17.243 -31.634  14.098
  490   1HG   PRO  14          2HG       PRO  14  18.106 -29.127  15.371
  491   2HG   PRO  14          1HG       PRO  14  17.288 -30.529  16.066
  492   1HD   PRO  14          1HD       PRO  14  20.029 -29.883  16.279
  493   2HD   PRO  14          2HD       PRO  14  19.233 -31.381  16.792
  494    H    MET  15           H        MET  15  19.059 -28.669  13.777
  495    HA   MET  15           HA       MET  15  21.398 -27.869  12.311
  496   1HB   MET  15          1HB       MET  15  19.174 -28.785  10.796
  497   2HB   MET  15          2HB       MET  15  19.243 -27.034  10.589
  498   1HG   MET  15          1HG       MET  15  21.723 -27.300  10.107
  499   2HG   MET  15          2HG       MET  15  21.442 -29.040  10.044
  500   1HE   MET  15          1HE       MET  15  21.432 -30.082   8.204
  501   2HE   MET  15          2HE       MET  15  20.932 -29.607   6.583
  502   3HE   MET  15          3HE       MET  15  22.395 -28.917   7.300
  503    H    ASP  16           H        ASP  16  20.769 -25.416  11.389
  504    HA   ASP  16           HA       ASP  16  18.902 -24.023  13.192
  505   1HB   ASP  16          1HB       ASP  16  21.051 -24.517  14.463
  506   2HB   ASP  16          2HB       ASP  16  21.876 -23.453  13.323
  507    H    MET  17           H        MET  17  19.184 -24.249  10.299
  508    HA   MET  17           HA       MET  17  20.535 -22.113   9.034
  509   1HB   MET  17          1HB       MET  17  18.821 -22.471   7.271
  510   2HB   MET  17          2HB       MET  17  19.418 -24.004   7.910
  511   1HG   MET  17          1HG       MET  17  17.424 -23.852   9.561
  512   2HG   MET  17          2HG       MET  17  16.780 -22.647   8.446
  513   1HE   MET  17          1HE       MET  17  15.182 -24.600   9.166
  514   2HE   MET  17          2HE       MET  17  14.646 -25.689   7.879
  515   3HE   MET  17          3HE       MET  17  15.807 -26.245   9.082
  516    H    SER  18           H        SER  18  17.324 -22.173  10.580
  517    HA   SER  18           HA       SER  18  17.434 -19.244  10.928
  518   1HB   SER  18          1HB       SER  18  15.438 -20.692   9.166
  519   2HB   SER  18          2HB       SER  18  15.194 -19.045   9.741
  520    HG   SER  18           HG       SER  18  17.083 -18.444   8.679
  521    HA   PRO  19           HA       PRO  19  15.022 -20.218  14.460
  522   1HB   PRO  19          1HB       PRO  19  13.339 -18.071  14.682
  523   2HB   PRO  19          2HB       PRO  19  15.071 -17.990  15.062
  524   1HG   PRO  19          2HG       PRO  19  13.634 -17.131  12.597
  525   2HG   PRO  19          1HG       PRO  19  14.967 -16.343  13.457
  526   1HD   PRO  19          1HD       PRO  19  15.320 -17.786  11.189
  527   2HD   PRO  19          2HD       PRO  19  16.561 -17.653  12.454
  528    H    LYS  20           H        LYS  20  13.574 -20.055  11.424
  529    HA   LYS  20           HA       LYS  20  11.637 -21.065  10.542
  530   1HB   LYS  20          1HB       LYS  20  12.529 -22.826  12.190
  531   2HB   LYS  20          2HB       LYS  20  11.289 -22.252  13.304
  532   1HG   LYS  20          1HG       LYS  20  10.662 -23.124  10.477
  533   2HG   LYS  20          2HG       LYS  20  10.619 -24.233  11.849
  534   1HD   LYS  20          1HD       LYS  20   9.083 -22.450  12.955
  535   2HD   LYS  20          2HD       LYS  20   8.878 -21.833  11.316
  536   1HE   LYS  20          1HE       LYS  20   8.226 -24.189  10.614
  537   2HE   LYS  20          2HE       LYS  20   8.180 -24.602  12.339
  538   1HZ   LYS  20          1HZ       LYS  20   6.711 -22.652  12.664
  539   2HZ   LYS  20          2HZ       LYS  20   6.643 -22.453  10.981
  540   3HZ   LYS  20          3HZ       LYS  20   6.012 -23.860  11.695
  541    H    ALA  21           H        ALA  21  10.644 -20.572  13.963
  542    HA   ALA  21           HA       ALA  21   8.031 -19.678  13.448
  543   1HB   ALA  21          1HB       ALA  21  10.056 -19.037  15.607
  544   2HB   ALA  21          3HB       ALA  21   8.376 -18.509  15.705
  545   3HB   ALA  21          2HB       ALA  21   8.758 -20.230  15.666
  546    H    LEU  22           H        LEU  22  10.820 -17.552  14.186
  547    HA   LEU  22           HA       LEU  22   9.586 -15.095  13.491
  548   1HB   LEU  22          1HB       LEU  22  11.599 -14.964  14.677
  549   2HB   LEU  22          2HB       LEU  22  12.370 -16.207  13.702
  550    HG   LEU  22           HG       LEU  22  12.582 -14.651  11.825
  551   1HD1  LEU  22          1HD1      LEU  22  11.068 -12.793  13.671
  552   2HD1  LEU  22          2HD1      LEU  22  11.967 -12.222  12.265
  553   3HD1  LEU  22          3HD1      LEU  22  10.606 -13.324  12.054
  554   1HD2  LEU  22          1HD2      LEU  22  13.617 -13.906  14.531
  555   2HD2  LEU  22          2HD2      LEU  22  14.502 -14.430  13.098
  556   3HD2  LEU  22          3HD2      LEU  22  13.891 -12.778  13.204
  557    H    GLN  23           H        GLN  23  11.919 -16.943  11.492
  558    HA   GLN  23           HA       GLN  23  11.663 -15.566   9.073
  559   1HB   GLN  23          1HB       GLN  23  13.270 -17.367   9.563
  560   2HB   GLN  23          2HB       GLN  23  11.959 -18.546   9.591
  561   1HG   GLN  23          1HG       GLN  23  11.508 -17.444   7.166
  562   2HG   GLN  23          2HG       GLN  23  13.253 -17.207   7.273
  563   2HE2  GLN  23          2HE2      GLN  23  11.607 -19.180   5.608
  564   1HE2  GLN  23          1HE2      GLN  23  12.268 -20.698   5.981
  565    H    GLN  24           H        GLN  24   9.485 -18.003  10.449
  566    HA   GLN  24           HA       GLN  24   7.854 -18.318   8.071
  567   1HB   GLN  24          1HB       GLN  24   8.020 -19.981   9.878
  568   2HB   GLN  24          2HB       GLN  24   7.340 -18.822  11.021
  569   1HG   GLN  24          2HG       GLN  24   5.504 -20.185  10.366
  570   2HG   GLN  24          1HG       GLN  24   5.319 -18.693   9.442
  571   2HE2  GLN  24          2HE2      GLN  24   4.815 -19.109   7.294
  572   1HE2  GLN  24          1HE2      GLN  24   5.371 -20.439   6.397
  573    H    LYS  25           H        LYS  25   7.704 -16.240  10.950
  574    HA   LYS  25           HA       LYS  25   5.090 -15.131  10.374
  575   1HB   LYS  25          1HB       LYS  25   7.303 -14.843  12.276
  576   2HB   LYS  25          2HB       LYS  25   6.506 -13.308  11.925
  577   1HG   LYS  25          2HG       LYS  25   5.292 -14.251  13.749
  578   2HG   LYS  25          1HG       LYS  25   4.294 -14.533  12.322
  579   1HD   LYS  25          1HD       LYS  25   5.904 -16.762  12.335
  580   2HD   LYS  25          2HD       LYS  25   5.668 -16.471  14.059
  581   1HE   LYS  25          1HE       LYS  25   3.180 -16.138  12.559
  582   2HE   LYS  25          2HE       LYS  25   3.858 -17.769  12.384
  583   1HZ   LYS  25          1HZ       LYS  25   3.740 -16.392  15.002
  584   2HZ   LYS  25          2HZ       LYS  25   2.451 -17.344  14.438
  585   3HZ   LYS  25          3HZ       LYS  25   3.979 -18.042  14.694
  586    H    ILE  26           H        ILE  26   8.432 -13.972   9.832
  587    HA   ILE  26           HA       ILE  26   7.864 -11.449   8.704
  588    HB   ILE  26           HB       ILE  26  10.008 -13.502   8.063
  589   1HG1  ILE  26          1HG1      ILE  26  10.233 -11.063   9.831
  590   2HG1  ILE  26          2HG1      ILE  26   9.666 -12.607  10.468
  591   1HG2  ILE  26          1HG2      ILE  26   9.859 -10.527   7.488
  592   2HG2  ILE  26          2HG2      ILE  26  11.322 -11.499   7.327
  593   3HG2  ILE  26          3HG2      ILE  26   9.928 -11.826   6.298
  594   1HD1  ILE  26          1HD1      ILE  26  12.126 -12.735   8.823
  595   2HD1  ILE  26          2HD1      ILE  26  12.288 -11.905  10.370
  596   3HD1  ILE  26          3HD1      ILE  26  11.727 -13.576  10.321
  597    H    HIS  27           H        HIS  27   8.390 -14.529   6.935
  598    HA   HIS  27           HA       HIS  27   7.702 -13.541   4.352
  599   1HB   HIS  27          1HB       HIS  27   8.795 -15.757   5.212
  600   2HB   HIS  27          2HB       HIS  27   7.134 -16.343   5.303
  601    HD1  HIS  27           HD1      HIS  27   6.988 -17.843   3.282
  602    HD2  HIS  27           HD2      HIS  27   8.617 -14.119   2.358
  603    HE1  HIS  27           HE1      HIS  27   7.212 -17.765   0.761
  604    H    GLU  28           H        GLU  28   5.708 -14.419   7.074
  605    HA   GLU  28           HA       GLU  28   3.255 -14.817   5.526
  606   1HB   GLU  28          1HB       GLU  28   4.208 -14.883   8.321
  607   2HB   GLU  28          2HB       GLU  28   2.527 -14.383   8.135
  608   1HG   GLU  28          1HG       GLU  28   3.323 -16.699   6.481
  609   2HG   GLU  28          2HG       GLU  28   3.336 -16.989   8.221
  610    H    LEU  29           H        LEU  29   4.596 -12.220   7.586
  611    HA   LEU  29           HA       LEU  29   2.335 -10.445   7.272
  612   1HB   LEU  29          1HB       LEU  29   5.213 -10.197   8.154
  613   2HB   LEU  29          2HB       LEU  29   4.144  -8.795   8.112
  614    HG   LEU  29           HG       LEU  29   3.198 -11.295   9.471
  615   1HD1  LEU  29          1HD1      LEU  29   5.105  -9.247  10.643
  616   2HD1  LEU  29          2HD1      LEU  29   4.209 -10.433  11.593
  617   3HD1  LEU  29          3HD1      LEU  29   5.416 -10.970  10.424
  618   1HD2  LEU  29          1HD2      LEU  29   2.729  -8.319   9.671
  619   2HD2  LEU  29          2HD2      LEU  29   1.556  -9.597   9.349
  620   3HD2  LEU  29          3HD2      LEU  29   2.232  -9.407  10.967
  621    H    GLU  30           H        GLU  30   5.521 -10.660   5.660
  622    HA   GLU  30           HA       GLU  30   5.262  -8.353   4.000
  623   1HB   GLU  30          1HB       GLU  30   7.275  -9.860   4.518
  624   2HB   GLU  30          2HB       GLU  30   6.641 -10.951   3.285
  625   1HG   GLU  30          1HG       GLU  30   6.582  -8.350   2.163
  626   2HG   GLU  30          2HG       GLU  30   8.160  -8.529   2.930
  627    H    GLY  31           H        GLY  31   4.344 -11.759   3.415
  628   1HA   GLY  31          2HA       GLY  31   2.974 -12.702   1.758
  629   2HA   GLY  31          1HA       GLY  31   3.425 -11.343   0.728
  630    H    LEU  32           H        LEU  32   2.015 -10.657   3.828
  631    HA   LEU  32           HA       LEU  32  -0.759 -10.611   2.973
  632   1HB   LEU  32          1HB       LEU  32   0.438 -10.736   5.328
  633   2HB   LEU  32          2HB       LEU  32   0.359  -8.976   5.231
  634    HG   LEU  32           HG       LEU  32  -2.116  -9.232   4.707
  635   1HD1  LEU  32          1HD1      LEU  32  -1.587 -11.815   4.257
  636   2HD1  LEU  32          2HD1      LEU  32  -1.980 -11.934   5.972
  637   3HD1  LEU  32          3HD1      LEU  32  -3.165 -11.284   4.839
  638   1HD2  LEU  32          1HD2      LEU  32  -0.704  -9.628   7.247
  639   2HD2  LEU  32          2HD2      LEU  32  -2.068  -8.573   6.877
  640   3HD2  LEU  32          3HD2      LEU  32  -2.346 -10.270   7.270
  641    H    MET  33           H        MET  33   1.798  -8.143   3.291
  642    HA   MET  33           HA       MET  33   0.318  -5.800   2.821
  643   1HB   MET  33          1HB       MET  33   3.084  -6.790   2.419
  644   2HB   MET  33          2HB       MET  33   2.654  -5.353   1.491
  645   1HG   MET  33          1HG       MET  33   2.283  -4.065   3.396
  646   2HG   MET  33          2HG       MET  33   1.940  -5.472   4.402
  647   1HE   MET  33          1HE       MET  33   4.414  -4.643   1.811
  648   2HE   MET  33          2HE       MET  33   5.092  -3.330   2.768
  649   3HE   MET  33          3HE       MET  33   6.018  -4.817   2.517
  650    H    MET  34           H        MET  34   1.891  -7.882   0.359
  651    HA   MET  34           HA       MET  34   1.154  -6.550  -1.980
  652   1HB   MET  34          1HB       MET  34   1.832  -9.271  -1.109
  653   2HB   MET  34          2HB       MET  34   0.857  -9.239  -2.578
  654   1HG   MET  34          1HG       MET  34   3.200  -7.378  -2.319
  655   2HG   MET  34          2HG       MET  34   3.472  -9.063  -2.762
  656   1HE   MET  34          1HE       MET  34   3.116  -5.842  -3.560
  657   2HE   MET  34          2HE       MET  34   2.875  -5.732  -5.301
  658   3HE   MET  34          3HE       MET  34   1.490  -5.634  -4.205
  659    H    GLN  35           H        GLN  35  -0.803  -8.943  -0.175
  660    HA   GLN  35           HA       GLN  35  -3.033  -9.135  -1.865
  661   1HB   GLN  35          1HB       GLN  35  -2.682 -10.474   0.143
  662   2HB   GLN  35          2HB       GLN  35  -2.823  -9.042   1.162
  663   1HG   GLN  35          2HG       GLN  35  -5.021  -9.541   1.319
  664   2HG   GLN  35          1HG       GLN  35  -5.155  -8.988  -0.350
  665   2HE2  GLN  35          2HE2      GLN  35  -4.994 -11.858   1.704
  666   1HE2  GLN  35          1HE2      GLN  35  -5.368 -12.975   0.482
  667    H    HIS  36           H        HIS  36  -3.229  -7.148   1.089
  668    HA   HIS  36           HA       HIS  36  -5.377  -5.529   0.261
  669   1HB   HIS  36          1HB       HIS  36  -3.187  -5.462   2.259
  670   2HB   HIS  36          2HB       HIS  36  -4.001  -3.926   1.962
  671    HD1  HIS  36           HD1      HIS  36  -5.303  -3.915   4.190
  672    HD2  HIS  36           HD2      HIS  36  -6.028  -7.304   1.873
  673    HE1  HIS  36           HE1      HIS  36  -7.285  -5.091   5.240
  674    H    ALA  37           H        ALA  37  -1.893  -4.632   0.202
  675    HA   ALA  37           HA       ALA  37  -2.019  -2.126  -1.009
  676   1HB   ALA  37          1HB       ALA  37   0.056  -3.087  -0.266
  677   2HB   ALA  37          3HB       ALA  37  -0.113  -4.457  -1.363
  678   3HB   ALA  37          2HB       ALA  37   0.223  -2.850  -2.005
  679    H    GLN  38           H        GLN  38  -2.498  -5.288  -2.510
  680    HA   GLN  38           HA       GLN  38  -2.506  -4.250  -5.251
  681   1HB   GLN  38          1HB       GLN  38  -3.026  -6.838  -3.816
  682   2HB   GLN  38          2HB       GLN  38  -3.577  -6.670  -5.484
  683   1HG   GLN  38          1HG       GLN  38  -1.272  -5.990  -6.143
  684   2HG   GLN  38          2HG       GLN  38  -0.741  -6.275  -4.485
  685   2HE2  GLN  38          2HE2      GLN  38  -1.812  -8.641  -3.736
  686   1HE2  GLN  38          1HE2      GLN  38  -1.410  -9.892  -4.811
  687    H    ASN  39           H        ASN  39  -4.872  -5.050  -2.744
  688    HA   ASN  39           HA       ASN  39  -7.137  -4.371  -4.547
  689   1HB   ASN  39          1HB       ASN  39  -6.682  -5.759  -1.945
  690   2HB   ASN  39          2HB       ASN  39  -8.247  -4.974  -2.163
  691   2HD2  ASN  39          2HD2      ASN  39  -7.374  -7.951  -2.217
  692   1HD2  ASN  39          1HD2      ASN  39  -8.045  -8.536  -3.662
  693    H    LEU  40           H        LEU  40  -5.091  -2.399  -3.419
  694    HA   LEU  40           HA       LEU  40  -5.096  -0.223  -2.528
  695   1HB   LEU  40          1HB       LEU  40  -7.901  -0.729  -3.505
  696   2HB   LEU  40          2HB       LEU  40  -7.492   0.811  -2.748
  697    HG   LEU  40           HG       LEU  40  -5.417   0.640  -4.433
  698   1HD1  LEU  40          1HD1      LEU  40  -7.394  -1.338  -5.364
  699   2HD1  LEU  40          2HD1      LEU  40  -6.885  -0.191  -6.603
  700   3HD1  LEU  40          3HD1      LEU  40  -5.685  -1.178  -5.770
  701   1HD2  LEU  40          1HD2      LEU  40  -7.556   2.248  -4.208
  702   2HD2  LEU  40          2HD2      LEU  40  -6.461   2.342  -5.588
  703   3HD2  LEU  40          3HD2      LEU  40  -7.980   1.457  -5.727
  704    H    GLU  41           H        GLU  41  -5.579  -2.537  -0.678
  705    HA   GLU  41           HA       GLU  41  -7.219  -1.167   1.425
  706   1HB   GLU  41          1HB       GLU  41  -6.451  -4.034   0.847
  707   2HB   GLU  41          2HB       GLU  41  -7.139  -3.555   2.398
  708   1HG   GLU  41          1HG       GLU  41  -8.506  -2.727  -0.145
  709   2HG   GLU  41          2HG       GLU  41  -8.735  -4.363   0.473
  710    H    PHE  42           H        PHE  42  -4.246  -0.859   0.588
  711    HA   PHE  42           HA       PHE  42  -2.531  -1.919   2.569
  712   1HB   PHE  42          1HB       PHE  42  -1.066  -0.021   1.824
  713   2HB   PHE  42          2HB       PHE  42  -1.739  -0.963   0.498
  714    HD1  PHE  42           HD1      PHE  42  -2.600   2.050   2.610
  715    HD2  PHE  42           HD2      PHE  42  -2.738   0.191  -1.288
  716    HE1  PHE  42           HE1      PHE  42  -3.609   4.113   1.656
  717    HE2  PHE  42           HE2      PHE  42  -3.727   2.253  -2.236
  718    HZ   PHE  42           HZ       PHE  42  -4.165   4.219  -0.765
  719    H    GLU  43           H        GLU  43  -5.014   0.418   3.022
  720    HA   GLU  43           HA       GLU  43  -3.962   2.300   4.802
  721   1HB   GLU  43          1HB       GLU  43  -6.291   2.223   4.030
  722   2HB   GLU  43          2HB       GLU  43  -6.559   0.727   4.925
  723   1HG   GLU  43          1HG       GLU  43  -5.703   2.189   6.968
  724   2HG   GLU  43          2HG       GLU  43  -6.257   3.522   5.954
  725    H    GLU  44           H        GLU  44  -5.600  -0.654   5.936
  726    HA   GLU  44           HA       GLU  44  -4.112  -0.604   8.471
  727   1HB   GLU  44          1HB       GLU  44  -5.537  -2.596   8.917
  728   2HB   GLU  44          2HB       GLU  44  -6.492  -1.238   8.321
  729   1HG   GLU  44          1HG       GLU  44  -7.134  -2.391   6.494
  730   2HG   GLU  44          2HG       GLU  44  -5.469  -2.842   6.124
  731    H    ALA  45           H        ALA  45  -3.786  -2.061   5.339
  732    HA   ALA  45           HA       ALA  45  -2.221  -4.376   6.139
  733   1HB   ALA  45          1HB       ALA  45  -3.365  -3.132   3.773
  734   2HB   ALA  45          3HB       ALA  45  -1.731  -3.712   3.450
  735   3HB   ALA  45          2HB       ALA  45  -2.957  -4.826   4.054
  736    H    ALA  46           H        ALA  46  -1.339  -1.286   4.531
  737    HA   ALA  46           HA       ALA  46   1.423  -1.669   4.311
  738   1HB   ALA  46          1HB       ALA  46   1.435   0.893   4.618
  739   2HB   ALA  46          3HB       ALA  46   0.414   0.243   3.336
  740   3HB   ALA  46          2HB       ALA  46  -0.302   0.746   4.870
  741    H    GLN  47           H        GLN  47  -0.454  -1.114   7.216
  742    HA   GLN  47           HA       GLN  47   1.505  -0.079   8.971
  743   1HB   GLN  47          2HB       GLN  47  -0.589  -2.206   9.525
  744   2HB   GLN  47          1HB       GLN  47   0.116  -1.099  10.703
  745   1HG   GLN  47          1HG       GLN  47  -0.757   0.719   8.942
  746   2HG   GLN  47          2HG       GLN  47  -1.910  -0.566   8.579
  747   2HE2  GLN  47          2HE2      GLN  47  -0.943   1.793  10.994
  748   1HE2  GLN  47          1HE2      GLN  47  -2.204   1.475  12.085
  749    H    ILE  48           H        ILE  48   1.050  -3.356   7.721
  750    HA   ILE  48           HA       ILE  48   2.714  -4.842   9.453
  751    HB   ILE  48           HB       ILE  48   2.277  -4.992   6.450
  752   1HG1  ILE  48          1HG1      ILE  48   1.009  -6.779   8.504
  753   2HG1  ILE  48          2HG1      ILE  48   0.350  -5.162   8.251
  754   1HG2  ILE  48          1HG2      ILE  48   3.416  -7.012   8.402
  755   2HG2  ILE  48          2HG2      ILE  48   2.905  -7.405   6.761
  756   3HG2  ILE  48          3HG2      ILE  48   4.246  -6.290   7.025
  757   1HD1  ILE  48          1HD1      ILE  48   0.918  -6.628   5.760
  758   2HD1  ILE  48          2HD1      ILE  48  -0.330  -7.368   6.763
  759   3HD1  ILE  48          3HD1      ILE  48  -0.510  -5.700   6.219
  760    H    ARG  49           H        ARG  49   3.514  -2.539   6.931
  761    HA   ARG  49           HA       ARG  49   6.190  -3.091   6.332
  762   1HB   ARG  49          1HB       ARG  49   4.999  -1.308   5.268
  763   2HB   ARG  49          2HB       ARG  49   4.644  -0.531   6.807
  764   1HG   ARG  49          1HG       ARG  49   7.483  -0.771   6.599
  765   2HG   ARG  49          2HG       ARG  49   6.885  -0.098   5.084
  766   1HD   ARG  49          1HD       ARG  49   7.361   1.682   6.777
  767   2HD   ARG  49          2HD       ARG  49   5.644   1.640   6.331
  768    HE   ARG  49           HE       ARG  49   5.231   0.336   8.418
  769   1HH1  ARG  49          1HH1      ARG  49   8.502   0.283   8.315
  770   2HH1  ARG  49          2HH1      ARG  49   8.780   1.017   9.858
  771   1HH2  ARG  49          1HH2      ARG  49   5.479   1.988  10.289
  772   2HH2  ARG  49          2HH2      ARG  49   7.069   1.983  10.976
  773    H    ASP  50           H        ASP  50   4.840  -1.666   9.284
  774    HA   ASP  50           HA       ASP  50   7.386  -0.917  10.456
  775   1HB   ASP  50          1HB       ASP  50   5.077  -0.032  11.002
  776   2HB   ASP  50          2HB       ASP  50   4.744  -1.570  11.798
  777    H    GLN  51           H        GLN  51   5.301  -3.793  10.622
  778    HA   GLN  51           HA       GLN  51   6.980  -5.132  12.616
  779   1HB   GLN  51          2HB       GLN  51   4.802  -6.164  10.766
  780   2HB   GLN  51          1HB       GLN  51   5.390  -6.962  12.225
  781   1HG   GLN  51          1HG       GLN  51   4.515  -5.245  13.635
  782   2HG   GLN  51          2HG       GLN  51   4.216  -4.175  12.264
  783   2HE2  GLN  51          2HE2      GLN  51   3.473  -7.661  12.267
  784   1HE2  GLN  51          1HE2      GLN  51   1.788  -7.471  12.179
  785    H    LEU  52           H        LEU  52   6.586  -5.188   9.092
  786    HA   LEU  52           HA       LEU  52   8.210  -7.504   8.573
  787   1HB   LEU  52          1HB       LEU  52   6.687  -5.563   7.184
  788   2HB   LEU  52          2HB       LEU  52   8.308  -5.500   6.491
  789    HG   LEU  52           HG       LEU  52   6.915  -7.165   5.319
  790   1HD1  LEU  52          1HD1      LEU  52   9.481  -7.493   6.210
  791   2HD1  LEU  52          2HD1      LEU  52   8.714  -8.954   6.832
  792   3HD1  LEU  52          3HD1      LEU  52   8.669  -8.601   5.104
  793   1HD2  LEU  52          1HD2      LEU  52   6.276  -7.886   8.087
  794   2HD2  LEU  52          2HD2      LEU  52   5.382  -8.228   6.606
  795   3HD2  LEU  52          3HD2      LEU  52   6.706  -9.284   7.101
  796    H    HIS  53           H        HIS  53   8.958  -4.043   8.895
  797    HA   HIS  53           HA       HIS  53  11.751  -4.340   8.110
  798   1HB   HIS  53          1HB       HIS  53  10.000  -2.213   9.336
  799   2HB   HIS  53          2HB       HIS  53  11.740  -1.965   9.192
  800    HD1  HIS  53           HD1      HIS  53   9.587  -3.780   6.657
  801    HD2  HIS  53           HD2      HIS  53  11.720  -0.215   7.002
  802    HE1  HIS  53           HE1      HIS  53   9.586  -2.719   4.357
  803    H    GLN  54           H        GLN  54  10.029  -3.934  11.220
  804    HA   GLN  54           HA       GLN  54  12.355  -3.931  12.892
  805   1HB   GLN  54          1HB       GLN  54   9.866  -3.315  13.323
  806   2HB   GLN  54          2HB       GLN  54   9.650  -5.036  13.647
  807   1HG   GLN  54          1HG       GLN  54  11.801  -4.653  15.172
  808   2HG   GLN  54          2HG       GLN  54  11.196  -2.996  15.191
  809   2HE2  GLN  54          2HE2      GLN  54  11.204  -5.002  17.436
  810   1HE2  GLN  54          1HE2      GLN  54   9.580  -5.158  17.906
  811    H    LEU  55           H        LEU  55  10.185  -6.584  11.865
  812    HA   LEU  55           HA       LEU  55  11.502  -8.662  13.342
  813   1HB   LEU  55          1HB       LEU  55   9.725  -8.502  10.906
  814   2HB   LEU  55          2HB       LEU  55  10.323 -10.055  11.492
  815    HG   LEU  55           HG       LEU  55   9.043  -8.150  13.427
  816   1HD1  LEU  55          1HD1      LEU  55   7.731  -9.553  11.179
  817   2HD1  LEU  55          2HD1      LEU  55   6.985  -9.818  12.754
  818   3HD1  LEU  55          3HD1      LEU  55   7.168  -8.179  12.130
  819   1HD2  LEU  55          1HD2      LEU  55   9.290 -11.162  13.164
  820   2HD2  LEU  55          2HD2      LEU  55  10.101 -10.128  14.341
  821   3HD2  LEU  55          3HD2      LEU  55   8.355 -10.364  14.429
  822    H    ARG  56           H        ARG  56  12.252  -7.063  10.322
  823    HA   ARG  56           HA       ARG  56  13.883  -9.047   9.082
  824   1HB   ARG  56          1HB       ARG  56  13.005  -6.881   8.131
  825   2HB   ARG  56          2HB       ARG  56  14.226  -6.032   9.080
  826   1HG   ARG  56          1HG       ARG  56  15.799  -7.873   7.887
  827   2HG   ARG  56          2HG       ARG  56  14.549  -7.717   6.652
  828   1HD   ARG  56          1HD       ARG  56  14.874  -5.157   6.915
  829   2HD   ARG  56          2HD       ARG  56  16.394  -5.580   7.730
  830    HE   ARG  56           HE       ARG  56  16.638  -7.110   5.545
  831   1HH1  ARG  56          1HH1      ARG  56  16.598  -3.796   6.081
  832   2HH1  ARG  56          2HH1      ARG  56  16.553  -3.348   4.409
  833   1HH2  ARG  56          1HH2      ARG  56  16.074  -6.592   3.280
  834   2HH2  ARG  56          2HH2      ARG  56  16.256  -4.931   2.823
  835    H    GLU  57           H        GLU  57  15.019  -6.188  10.934
  836    HA   GLU  57           HA       GLU  57  17.718  -6.958  11.197
  837   1HB   GLU  57          1HB       GLU  57  16.770  -4.750  11.750
  838   2HB   GLU  57          2HB       GLU  57  15.907  -5.456  13.117
  839   1HG   GLU  57          1HG       GLU  57  17.947  -4.411  13.935
  840   2HG   GLU  57          2HG       GLU  57  18.107  -6.162  14.079
  841    H    LEU  58           H        LEU  58  14.913  -7.831  13.207
  842    HA   LEU  58           HA       LEU  58  16.353  -9.165  15.296
  843   1HB   LEU  58          1HB       LEU  58  13.562  -9.409  14.140
  844   2HB   LEU  58          2HB       LEU  58  14.069 -10.263  15.598
  845    HG   LEU  58           HG       LEU  58  14.448  -7.283  15.331
  846   1HD1  LEU  58          1HD1      LEU  58  11.946  -8.681  15.423
  847   2HD1  LEU  58          2HD1      LEU  58  12.194  -7.873  16.971
  848   3HD1  LEU  58          3HD1      LEU  58  12.229  -6.941  15.474
  849   1HD2  LEU  58          1HD2      LEU  58  15.454  -8.943  17.151
  850   2HD2  LEU  58          2HD2      LEU  58  14.853  -7.352  17.616
  851   3HD2  LEU  58          3HD2      LEU  58  13.845  -8.779  17.856
  852    H    PHE  59           H        PHE  59  15.625 -10.087  12.023
  853    HA   PHE  59           HA       PHE  59  15.499 -12.886  12.107
  854   1HB   PHE  59          1HB       PHE  59  15.303 -11.376  10.122
  855   2HB   PHE  59          2HB       PHE  59  17.051 -11.144  10.165
  856    HD1  PHE  59           HD1      PHE  59  18.596 -13.077   9.766
  857    HD2  PHE  59           HD2      PHE  59  14.320 -13.411   9.271
  858    HE1  PHE  59           HE1      PHE  59  18.910 -15.183   8.469
  859    HE2  PHE  59           HE2      PHE  59  14.634 -15.516   7.974
  860    HZ   PHE  59           HZ       PHE  59  16.929 -16.403   7.573
  861    H    ILE  60           H        ILE  60  18.433 -10.834  12.108
  862    HA   ILE  60           HA       ILE  60  20.245 -13.112  12.296
  863    HB   ILE  60           HB       ILE  60  20.612 -10.141  12.805
  864   1HG1  ILE  60          1HG1      ILE  60  21.228 -11.736  10.303
  865   2HG1  ILE  60          2HG1      ILE  60  19.724 -10.842  10.527
  866   1HG2  ILE  60          1HG2      ILE  60  22.396 -12.434  12.995
  867   2HG2  ILE  60          2HG2      ILE  60  22.967 -11.270  11.800
  868   3HG2  ILE  60          3HG2      ILE  60  22.681 -10.758  13.463
  869   1HD1  ILE  60          1HD1      ILE  60  21.097  -8.778  10.957
  870   2HD1  ILE  60          2HD1      ILE  60  22.532  -9.704  10.518
  871   3HD1  ILE  60          3HD1      ILE  60  21.268  -9.417   9.322
  872    H    ALA  61           H        ALA  61  19.189 -10.565  14.589
  873    HA   ALA  61           HA       ALA  61  20.608 -11.406  16.872
  874   1HB   ALA  61          1HB       ALA  61  19.090  -9.367  16.416
  875   2HB   ALA  61          3HB       ALA  61  19.035 -10.053  18.040
  876   3HB   ALA  61          2HB       ALA  61  17.751 -10.415  16.886
  877    H    ALA  62           H        ALA  62  17.831 -12.860  15.317
  878    HA   ALA  62           HA       ALA  62  17.130 -14.541  17.628
  879   1HB   ALA  62          1HB       ALA  62  16.201 -14.068  14.818
  880   2HB   ALA  62          3HB       ALA  62  15.716 -15.564  15.616
  881   3HB   ALA  62          2HB       ALA  62  15.282 -14.007  16.322
  882    H    SER  63           H        SER  63  17.769 -15.569  14.271
  883    HA   SER  63           HA       SER  63  20.052 -17.233  14.990
  884   1HB   SER  63          1HB       SER  63  17.247 -18.274  14.964
  885   2HB   SER  63          2HB       SER  63  18.520 -19.323  14.348
  886    HG   SER  63           HG       SER  63  19.240 -19.569  16.311

  No H/Q in entry =         886
  Start of MODEL    2
    1    H    LEU   8           H        LEU   8 -15.487  22.789 -29.132
    2    HA   LEU   8           HA       LEU   8 -16.064  24.677 -31.303
    3   1HB   LEU   8          1HB       LEU   8 -13.551  23.044 -31.114
    4   2HB   LEU   8          2HB       LEU   8 -14.254  23.351 -32.703
    5    HG   LEU   8           HG       LEU   8 -14.346  25.831 -31.948
    6   1HD1  LEU   8          1HD1      LEU   8 -12.606  24.548 -29.856
    7   2HD1  LEU   8          2HD1      LEU   8 -12.293  26.208 -30.360
    8   3HD1  LEU   8          3HD1      LEU   8 -13.854  25.779 -29.660
    9   1HD2  LEU   8          1HD2      LEU   8 -11.996  24.203 -32.806
   10   2HD2  LEU   8          2HD2      LEU   8 -12.823  25.511 -33.650
   11   3HD2  LEU   8          3HD2      LEU   8 -11.691  25.879 -32.350
   12    H    GLU   9           H        GLU   9 -18.112  23.573 -31.328
   13    HA   GLU   9           HA       GLU   9 -19.624  21.871 -31.968
   14   1HB   GLU   9          1HB       GLU   9 -17.794  22.320 -33.925
   15   2HB   GLU   9          2HB       GLU   9 -17.513  20.604 -33.633
   16   1HG   GLU   9          2HG       GLU   9 -19.248  20.342 -35.095
   17   2HG   GLU   9          1HG       GLU   9 -20.229  20.649 -33.662
   18    HA   PRO  10           HA       PRO  10 -17.407  18.837 -29.200
   19   1HB   PRO  10          1HB       PRO  10 -19.227  18.894 -27.157
   20   2HB   PRO  10          2HB       PRO  10 -17.853  20.013 -27.257
   21   1HG   PRO  10          2HG       PRO  10 -20.712  20.459 -27.945
   22   2HG   PRO  10          1HG       PRO  10 -19.549  21.554 -27.182
   23   1HD   PRO  10          1HD       PRO  10 -20.268  21.700 -29.814
   24   2HD   PRO  10          2HD       PRO  10 -18.705  22.261 -29.184
   25    H    ASP  11           H        ASP  11 -20.945  19.222 -29.590
   26    HA   ASP  11           HA       ASP  11 -22.606  17.667 -30.207
   27   1HB   ASP  11          1HB       ASP  11 -20.136  17.036 -31.617
   28   2HB   ASP  11          2HB       ASP  11 -21.110  15.589 -31.358
   29    H    ASN  12           H        ASN  12 -20.069  15.238 -29.755
   30    HA   ASN  12           HA       ASN  12 -21.138  14.490 -27.094
   31   1HB   ASN  12          1HB       ASN  12 -21.656  12.197 -27.925
   32   2HB   ASN  12          2HB       ASN  12 -22.636  13.427 -28.726
   33   2HD2  ASN  12          2HD2      ASN  12 -19.641  11.489 -29.176
   34   1HD2  ASN  12          1HD2      ASN  12 -19.708  11.502 -30.872
   35    H    VAL  13           H        VAL  13 -18.500  15.226 -28.636
   36    HA   VAL  13           HA       VAL  13 -16.869  12.819 -28.199
   37    HB   VAL  13           HB       VAL  13 -16.556  15.567 -29.356
   38   1HG1  VAL  13          1HG1      VAL  13 -14.401  14.045 -28.020
   39   2HG1  VAL  13          2HG1      VAL  13 -14.038  14.524 -29.678
   40   3HG1  VAL  13          3HG1      VAL  13 -14.453  15.747 -28.477
   41   1HG2  VAL  13          1HG2      VAL  13 -16.003  12.730 -30.238
   42   2HG2  VAL  13          2HG2      VAL  13 -17.251  13.822 -30.839
   43   3HG2  VAL  13          3HG2      VAL  13 -15.553  14.140 -31.196
   44    HA   PRO  14           HA       PRO  14 -14.938  15.461 -24.753
   45   1HB   PRO  14          1HB       PRO  14 -15.903  17.970 -24.258
   46   2HB   PRO  14          2HB       PRO  14 -14.612  17.651 -25.434
   47   1HG   PRO  14          2HG       PRO  14 -17.503  18.162 -25.891
   48   2HG   PRO  14          1HG       PRO  14 -16.099  18.671 -26.842
   49   1HD   PRO  14          1HD       PRO  14 -17.731  16.584 -27.523
   50   2HD   PRO  14          2HD       PRO  14 -16.037  16.738 -28.023
   51    H    MET  15           H        MET  15 -18.357  16.447 -25.101
   52    HA   MET  15           HA       MET  15 -20.181  16.203 -23.625
   53   1HB   MET  15          1HB       MET  15 -18.639  13.810 -23.787
   54   2HB   MET  15          2HB       MET  15 -19.169  13.980 -22.114
   55   1HG   MET  15          1HG       MET  15 -21.331  13.572 -22.645
   56   2HG   MET  15          2HG       MET  15 -21.270  14.636 -24.050
   57   1HE   MET  15          1HE       MET  15 -22.991  12.961 -24.534
   58   2HE   MET  15          2HE       MET  15 -22.683  11.679 -25.702
   59   3HE   MET  15          3HE       MET  15 -22.707  11.305 -23.981
   60    H    ASP  16           H        ASP  16 -20.290  15.368 -20.960
   61    HA   ASP  16           HA       ASP  16 -18.355  17.170 -19.547
   62   1HB   ASP  16          1HB       ASP  16 -21.369  16.972 -19.241
   63   2HB   ASP  16          2HB       ASP  16 -20.320  17.960 -18.223
   64    H    MET  17           H        MET  17 -18.176  14.309 -19.715
   65    HA   MET  17           HA       MET  17 -19.415  12.892 -17.581
   66   1HB   MET  17          1HB       MET  17 -17.513  11.335 -17.938
   67   2HB   MET  17          2HB       MET  17 -18.185  11.891 -19.471
   68   1HG   MET  17          1HG       MET  17 -16.364  13.806 -19.175
   69   2HG   MET  17          2HG       MET  17 -15.574  12.580 -18.184
   70   1HE   MET  17          1HE       MET  17 -14.930  10.430 -18.761
   71   2HE   MET  17          2HE       MET  17 -16.322   9.764 -19.611
   72   3HE   MET  17          3HE       MET  17 -14.733   9.719 -20.369
   73    H    SER  18           H        SER  18 -16.571  14.995 -17.644
   74    HA   SER  18           HA       SER  18 -16.620  15.160 -14.698
   75   1HB   SER  18          1HB       SER  18 -14.096  14.267 -16.099
   76   2HB   SER  18          2HB       SER  18 -14.466  14.203 -14.378
   77    HG   SER  18           HG       SER  18 -14.994  12.217 -14.899
   78    HA   PRO  19           HA       PRO  19 -14.893  19.078 -15.711
   79   1HB   PRO  19          1HB       PRO  19 -13.702  19.768 -13.355
   80   2HB   PRO  19          2HB       PRO  19 -15.460  19.716 -13.577
   81   1HG   PRO  19          1HG       PRO  19 -13.708  17.883 -12.114
   82   2HG   PRO  19          2HG       PRO  19 -15.440  18.171 -11.935
   83   1HD   PRO  19          1HD       PRO  19 -14.164  15.996 -13.259
   84   2HD   PRO  19          2HD       PRO  19 -15.904  16.338 -13.156
   85    H    LYS  20           H        LYS  20 -13.013  16.551 -15.911
   86    HA   LYS  20           HA       LYS  20 -10.813  16.198 -16.675
   87   1HB   LYS  20          1HB       LYS  20 -11.566  18.330 -17.921
   88   2HB   LYS  20          2HB       LYS  20 -10.578  19.207 -16.753
   89   1HG   LYS  20          1HG       LYS  20  -9.383  16.857 -18.178
   90   2HG   LYS  20          2HG       LYS  20  -9.523  18.392 -19.035
   91   1HD   LYS  20          1HD       LYS  20  -8.535  19.131 -16.544
   92   2HD   LYS  20          2HD       LYS  20  -7.684  17.626 -16.896
   93   1HE   LYS  20          1HE       LYS  20  -7.663  19.035 -19.329
   94   2HE   LYS  20          2HE       LYS  20  -7.296  20.248 -18.086
   95   1HZ   LYS  20          1HZ       LYS  20  -6.037  17.560 -18.190
   96   2HZ   LYS  20          2HZ       LYS  20  -5.324  18.953 -18.851
   97   3HZ   LYS  20          3HZ       LYS  20  -5.608  18.857 -17.181
   98    H    ALA  21           H        ALA  21 -10.472  19.253 -14.817
   99    HA   ALA  21           HA       ALA  21  -8.003  18.813 -13.638
  100   1HB   ALA  21          1HB       ALA  21  -9.093  20.884 -13.315
  101   2HB   ALA  21          3HB       ALA  21 -10.551  20.116 -12.685
  102   3HB   ALA  21          2HB       ALA  21  -9.088  20.170 -11.703
  103    H    LEU  22           H        LEU  22 -11.142  17.683 -12.353
  104    HA   LEU  22           HA       LEU  22  -9.884  16.267 -10.112
  105   1HB   LEU  22          1HB       LEU  22 -12.653  16.531 -11.296
  106   2HB   LEU  22          2HB       LEU  22 -12.333  15.421  -9.962
  107    HG   LEU  22           HG       LEU  22 -11.324  17.369  -8.703
  108   1HD1  LEU  22          1HD1      LEU  22 -12.248  18.719 -11.207
  109   2HD1  LEU  22          2HD1      LEU  22 -12.369  19.605  -9.688
  110   3HD1  LEU  22          3HD1      LEU  22 -10.802  19.017 -10.245
  111   1HD2  LEU  22          1HD2      LEU  22 -14.220  17.265  -9.535
  112   2HD2  LEU  22          2HD2      LEU  22 -13.495  16.782  -8.002
  113   3HD2  LEU  22          3HD2      LEU  22 -13.661  18.493  -8.400
  114    H    GLN  23           H        GLN  23 -11.568  15.365 -13.115
  115    HA   GLN  23           HA       GLN  23 -11.420  12.560 -12.948
  116   1HB   GLN  23          1HB       GLN  23 -12.546  14.037 -14.672
  117   2HB   GLN  23          2HB       GLN  23 -10.964  14.257 -15.420
  118   1HG   GLN  23          1HG       GLN  23 -10.763  11.829 -15.751
  119   2HG   GLN  23          2HG       GLN  23 -12.327  11.585 -14.973
  120   2HE2  GLN  23          2HE2      GLN  23 -11.410  14.152 -17.314
  121   1HE2  GLN  23          1HE2      GLN  23 -12.553  13.703 -18.487
  122    H    GLN  24           H        GLN  24  -9.031  14.708 -14.553
  123    HA   GLN  24           HA       GLN  24  -7.103  12.669 -15.088
  124   1HB   GLN  24          1HB       GLN  24  -7.258  14.962 -16.089
  125   2HB   GLN  24          2HB       GLN  24  -6.698  15.630 -14.555
  126   1HG   GLN  24          2HG       GLN  24  -4.678  15.444 -15.680
  127   2HG   GLN  24          1HG       GLN  24  -4.741  13.869 -14.888
  128   2HE2  GLN  24          2HE2      GLN  24  -3.872  12.439 -16.421
  129   1HE2  GLN  24          1HE2      GLN  24  -4.399  12.323 -18.031
  130    H    LYS  25           H        LYS  25  -7.341  14.995 -12.375
  131    HA   LYS  25           HA       LYS  25  -5.001  14.217 -10.971
  132   1HB   LYS  25          1HB       LYS  25  -7.678  15.397 -10.252
  133   2HB   LYS  25          2HB       LYS  25  -6.494  15.057  -8.989
  134   1HG   LYS  25          1HG       LYS  25  -4.849  16.479 -10.068
  135   2HG   LYS  25          2HG       LYS  25  -5.912  16.718 -11.456
  136   1HD   LYS  25          2HD       LYS  25  -6.359  18.648 -10.246
  137   2HD   LYS  25          1HD       LYS  25  -7.605  17.572  -9.609
  138   1HE   LYS  25          2HE       LYS  25  -6.615  18.486  -7.655
  139   2HE   LYS  25          1HE       LYS  25  -5.790  16.923  -7.832
  140   1HZ   LYS  25          1HZ       LYS  25  -4.081  18.067  -9.163
  141   2HZ   LYS  25          2HZ       LYS  25  -4.829  19.555  -8.826
  142   3HZ   LYS  25          3HZ       LYS  25  -4.148  18.645  -7.566
  143    H    ILE  26           H        ILE  26  -8.370  13.075 -10.491
  144    HA   ILE  26           HA       ILE  26  -7.886  11.168  -8.472
  145    HB   ILE  26           HB       ILE  26  -9.814  11.164 -10.818
  146   1HG1  ILE  26          1HG1      ILE  26 -10.389  11.938  -7.959
  147   2HG1  ILE  26          2HG1      ILE  26  -9.731  13.112  -9.098
  148   1HG2  ILE  26          1HG2      ILE  26  -9.822   9.589  -8.226
  149   2HG2  ILE  26          2HG2      ILE  26 -11.199   9.704  -9.322
  150   3HG2  ILE  26          3HG2      ILE  26  -9.707   8.932  -9.859
  151   1HD1  ILE  26          1HD1      ILE  26 -11.868  11.724 -10.394
  152   2HD1  ILE  26          2HD1      ILE  26 -12.443  12.266  -8.818
  153   3HD1  ILE  26          3HD1      ILE  26 -11.782  13.432  -9.962
  154    H    HIS  27           H        HIS  27  -8.120  10.488 -11.992
  155    HA   HIS  27           HA       HIS  27  -7.210   7.792 -11.850
  156   1HB   HIS  27          1HB       HIS  27  -7.270   9.953 -13.956
  157   2HB   HIS  27          2HB       HIS  27  -6.625   8.352 -14.323
  158    HD1  HIS  27           HD1      HIS  27  -8.357   6.868 -15.304
  159    HD2  HIS  27           HD2      HIS  27 -10.017   9.524 -12.553
  160    HE1  HIS  27           HE1      HIS  27 -10.838   6.366 -15.231
  161    H    GLU  28           H        GLU  28  -5.450  10.840 -11.898
  162    HA   GLU  28           HA       GLU  28  -2.859   9.625 -12.514
  163   1HB   GLU  28          1HB       GLU  28  -3.945  12.313 -11.716
  164   2HB   GLU  28          2HB       GLU  28  -2.204  12.034 -11.667
  165   1HG   GLU  28          1HG       GLU  28  -3.962  11.539 -14.088
  166   2HG   GLU  28          2HG       GLU  28  -2.949  12.965 -13.855
  167    H    LEU  29           H        LEU  29  -4.508  10.820  -9.582
  168    HA   LEU  29           HA       LEU  29  -2.266  10.317  -7.813
  169   1HB   LEU  29          1HB       LEU  29  -5.229  10.832  -7.505
  170   2HB   LEU  29          2HB       LEU  29  -4.186  10.573  -6.107
  171    HG   LEU  29           HG       LEU  29  -3.498  12.610  -8.224
  172   1HD1  LEU  29          1HD1      LEU  29  -5.814  12.972  -7.178
  173   2HD1  LEU  29          2HD1      LEU  29  -4.964  13.226  -5.654
  174   3HD1  LEU  29          3HD1      LEU  29  -4.665  14.300  -7.020
  175   1HD2  LEU  29          1HD2      LEU  29  -2.432  11.703  -5.648
  176   2HD2  LEU  29          2HD2      LEU  29  -1.646  12.643  -6.916
  177   3HD2  LEU  29          3HD2      LEU  29  -2.654  13.452  -5.716
  178    H    GLU  30           H        GLU  30  -5.146   8.468  -8.776
  179    HA   GLU  30           HA       GLU  30  -4.834   6.338  -6.859
  180   1HB   GLU  30          1HB       GLU  30  -6.769   7.129  -8.512
  181   2HB   GLU  30          2HB       GLU  30  -6.029   5.932  -9.577
  182   1HG   GLU  30          1HG       GLU  30  -6.415   5.029  -6.793
  183   2HG   GLU  30          2HG       GLU  30  -7.908   5.339  -7.681
  184    H    GLY  31           H        GLY  31  -3.851   6.656 -10.289
  185   1HA   GLY  31          2HA       GLY  31  -2.180   5.531 -11.493
  186   2HA   GLY  31          1HA       GLY  31  -2.680   4.099 -10.591
  187    H    LEU  32           H        LEU  32  -1.394   7.056  -9.141
  188    HA   LEU  32           HA       LEU  32   1.335   6.164  -8.883
  189   1HB   LEU  32          1HB       LEU  32   0.338   8.511  -8.715
  190   2HB   LEU  32          2HB       LEU  32  -0.195   8.070  -7.091
  191    HG   LEU  32           HG       LEU  32   2.159   7.530  -6.493
  192   1HD1  LEU  32          1HD1      LEU  32   2.467   7.864  -9.366
  193   2HD1  LEU  32          2HD1      LEU  32   3.602   8.882  -8.479
  194   3HD1  LEU  32          3HD1      LEU  32   3.577   7.140  -8.204
  195   1HD2  LEU  32          1HD2      LEU  32   0.965  10.000  -6.664
  196   2HD2  LEU  32          2HD2      LEU  32   2.524   9.698  -5.897
  197   3HD2  LEU  32          3HD2      LEU  32   2.457  10.264  -7.566
  198    H    MET  33           H        MET  33  -1.530   5.895  -6.800
  199    HA   MET  33           HA       MET  33  -0.195   4.812  -4.491
  200   1HB   MET  33          1HB       MET  33  -2.758   5.610  -5.315
  201   2HB   MET  33          2HB       MET  33  -2.927   3.901  -4.920
  202   1HG   MET  33          1HG       MET  33  -1.961   4.281  -2.705
  203   2HG   MET  33          2HG       MET  33  -1.659   5.970  -3.100
  204   1HE   MET  33          1HE       MET  33  -3.995   3.266  -3.462
  205   2HE   MET  33          2HE       MET  33  -5.226   3.553  -2.237
  206   3HE   MET  33          3HE       MET  33  -5.499   4.094  -3.893
  207    H    MET  34           H        MET  34  -1.230   3.419  -7.528
  208    HA   MET  34           HA       MET  34  -1.234   0.647  -6.589
  209   1HB   MET  34          1HB       MET  34  -2.514   1.791  -8.537
  210   2HB   MET  34          2HB       MET  34  -1.008   1.618  -9.438
  211   1HG   MET  34          1HG       MET  34  -1.846  -0.432  -9.976
  212   2HG   MET  34          2HG       MET  34  -1.258  -0.884  -8.376
  213   1HE   MET  34          1HE       MET  34  -2.247  -1.719  -6.801
  214   2HE   MET  34          2HE       MET  34  -3.267  -0.510  -6.025
  215   3HE   MET  34          3HE       MET  34  -3.954  -2.060  -6.529
  216    H    GLN  35           H        GLN  35   0.860   2.419  -8.914
  217    HA   GLN  35           HA       GLN  35   2.854   0.495  -9.282
  218   1HB   GLN  35          1HB       GLN  35   4.298   2.482  -9.753
  219   2HB   GLN  35          2HB       GLN  35   2.700   2.621 -10.485
  220   1HG   GLN  35          1HG       GLN  35   1.946   4.002  -8.584
  221   2HG   GLN  35          2HG       GLN  35   3.546   3.869  -7.854
  222   2HE2  GLN  35          2HE2      GLN  35   1.864   5.113 -10.769
  223   1HE2  GLN  35          1HE2      GLN  35   3.034   6.289 -11.132
  224    H    HIS  36           H        HIS  36   2.404   2.685  -6.536
  225    HA   HIS  36           HA       HIS  36   4.953   1.980  -5.279
  226   1HB   HIS  36          1HB       HIS  36   2.459   3.495  -4.479
  227   2HB   HIS  36          2HB       HIS  36   3.823   3.285  -3.381
  228    HD1  HIS  36           HD1      HIS  36   6.159   3.622  -5.354
  229    HD2  HIS  36           HD2      HIS  36   2.833   6.134  -5.285
  230    HE1  HIS  36           HE1      HIS  36   6.883   5.800  -6.425
  231    H    ALA  37           H        ALA  37   1.523   1.437  -4.357
  232    HA   ALA  37           HA       ALA  37   1.868  -0.310  -2.205
  233   1HB   ALA  37          1HB       ALA  37  -0.351  -1.306  -3.274
  234   2HB   ALA  37          2HB       ALA  37  -0.326   0.348  -2.659
  235   3HB   ALA  37          3HB       ALA  37  -0.161   0.046  -4.390
  236    H    GLN  38           H        GLN  38   2.328  -0.938  -5.630
  237    HA   GLN  38           HA       GLN  38   2.418  -3.850  -5.377
  238   1HB   GLN  38          1HB       GLN  38   2.678  -1.740  -7.423
  239   2HB   GLN  38          2HB       GLN  38   3.689  -3.154  -7.723
  240   1HG   GLN  38          1HG       GLN  38   1.583  -4.551  -7.247
  241   2HG   GLN  38          2HG       GLN  38   0.688  -3.040  -7.410
  242   2HE2  GLN  38          2HE2      GLN  38   1.408  -5.673  -9.196
  243   1HE2  GLN  38          1HE2      GLN  38   1.551  -4.977 -10.737
  244    H    ASN  39           H        ASN  39   4.774  -1.191  -5.554
  245    HA   ASN  39           HA       ASN  39   7.031  -3.097  -5.204
  246   1HB   ASN  39          1HB       ASN  39   6.758  -0.130  -5.767
  247   2HB   ASN  39          2HB       ASN  39   8.319  -0.911  -5.510
  248   2HD2  ASN  39          2HD2      ASN  39   7.423   0.320  -8.037
  249   1HD2  ASN  39          1HD2      ASN  39   7.391  -0.921  -9.194
  250    H    LEU  40           H        LEU  40   5.002  -2.500  -3.065
  251    HA   LEU  40           HA       LEU  40   4.974  -2.064  -0.754
  252   1HB   LEU  40          1HB       LEU  40   7.860  -2.672  -1.404
  253   2HB   LEU  40          2HB       LEU  40   7.347  -2.351   0.252
  254    HG   LEU  40           HG       LEU  40   5.441  -4.133  -0.517
  255   1HD1  LEU  40          1HD1      LEU  40   7.858  -4.533  -2.224
  256   2HD1  LEU  40          2HD1      LEU  40   7.086  -5.971  -1.557
  257   3HD1  LEU  40          3HD1      LEU  40   6.164  -4.870  -2.580
  258   1HD2  LEU  40          1HD2      LEU  40   6.863  -4.197   1.525
  259   2HD2  LEU  40          2HD2      LEU  40   6.726  -5.785   0.770
  260   3HD2  LEU  40          3HD2      LEU  40   8.194  -4.830   0.557
  261    H    GLU  41           H        GLU  41   5.380   0.216  -2.705
  262    HA   GLU  41           HA       GLU  41   6.928   2.121  -1.003
  263   1HB   GLU  41          1HB       GLU  41   6.777   1.644  -3.734
  264   2HB   GLU  41          2HB       GLU  41   5.769   3.075  -3.525
  265   1HG   GLU  41          2HG       GLU  41   7.782   4.154  -3.671
  266   2HG   GLU  41          1HG       GLU  41   7.852   3.767  -1.952
  267    H    PHE  42           H        PHE  42   3.964   0.992  -0.783
  268    HA   PHE  42           HA       PHE  42   2.128   3.099  -1.153
  269   1HB   PHE  42          1HB       PHE  42   0.839   1.830   0.618
  270   2HB   PHE  42          2HB       PHE  42   1.407   0.850  -0.730
  271    HD1  PHE  42           HD1      PHE  42   2.582   2.032   2.656
  272    HD2  PHE  42           HD2      PHE  42   2.511  -1.162  -0.251
  273    HE1  PHE  42           HE1      PHE  42   3.802   0.551   4.243
  274    HE2  PHE  42           HE2      PHE  42   3.716  -2.627   1.325
  275    HZ   PHE  42           HZ       PHE  42   4.364  -1.780   3.581
  276    H    GLU  43           H        GLU  43   4.714   2.910   1.144
  277    HA   GLU  43           HA       GLU  43   3.695   4.219   3.404
  278   1HB   GLU  43          1HB       GLU  43   6.079   5.296   3.421
  279   2HB   GLU  43          2HB       GLU  43   5.944   3.547   3.520
  280   1HG   GLU  43          1HG       GLU  43   6.037   4.235   0.746
  281   2HG   GLU  43          2HG       GLU  43   7.324   5.117   1.560
  282    H    GLU  44           H        GLU  44   5.256   5.951   0.665
  283    HA   GLU  44           HA       GLU  44   3.930   8.460   1.434
  284   1HB   GLU  44          1HB       GLU  44   5.222   9.301  -0.525
  285   2HB   GLU  44          2HB       GLU  44   6.244   8.389   0.587
  286   1HG   GLU  44          1HG       GLU  44   6.416   6.566  -0.847
  287   2HG   GLU  44          2HG       GLU  44   4.900   6.939  -1.670
  288    H    ALA  45           H        ALA  45   3.352   5.765  -0.677
  289    HA   ALA  45           HA       ALA  45   1.632   7.142  -2.584
  290   1HB   ALA  45          1HB       ALA  45   1.165   4.345  -2.538
  291   2HB   ALA  45          3HB       ALA  45   2.869   4.571  -2.139
  292   3HB   ALA  45          2HB       ALA  45   2.217   5.237  -3.638
  293    H    ALA  46           H        ALA  46   0.916   4.620  -0.130
  294    HA   ALA  46           HA       ALA  46  -1.828   4.491  -0.203
  295   1HB   ALA  46          1HB       ALA  46   0.090   4.551   2.134
  296   2HB   ALA  46          3HB       ALA  46  -0.555   3.136   1.300
  297   3HB   ALA  46          2HB       ALA  46  -1.607   4.119   2.318
  298    H    GLN  47           H        GLN  47   0.061   7.201   1.036
  299    HA   GLN  47           HA       GLN  47  -1.976   8.535   2.520
  300   1HB   GLN  47          1HB       GLN  47   0.288   9.653   0.837
  301   2HB   GLN  47          2HB       GLN  47  -0.541  10.503   2.140
  302   1HG   GLN  47          1HG       GLN  47   0.474   7.856   2.920
  303   2HG   GLN  47          2HG       GLN  47   1.741   8.992   2.455
  304   2HE2  GLN  47          2HE2      GLN  47   1.048   8.010   5.213
  305   1HE2  GLN  47          1HE2      GLN  47   0.704   9.406   6.115
  306    H    ILE  48           H        ILE  48  -1.321   8.352  -0.951
  307    HA   ILE  48           HA       ILE  48  -2.861  10.511  -1.917
  308    HB   ILE  48           HB       ILE  48  -2.495   7.690  -2.974
  309   1HG1  ILE  48          1HG1      ILE  48  -1.020  10.254  -3.647
  310   2HG1  ILE  48          2HG1      ILE  48  -0.415   9.036  -2.523
  311   1HG2  ILE  48          1HG2      ILE  48  -4.188   9.750  -3.917
  312   2HG2  ILE  48          2HG2      ILE  48  -2.792   9.726  -4.994
  313   3HG2  ILE  48          3HG2      ILE  48  -3.746   8.262  -4.754
  314   1HD1  ILE  48          1HD1      ILE  48  -1.258   8.211  -5.286
  315   2HD1  ILE  48          2HD1      ILE  48   0.327   8.948  -5.042
  316   3HD1  ILE  48          3HD1      ILE  48  -0.089   7.451  -4.206
  317    H    ARG  49           H        ARG  49  -3.864   7.366  -0.661
  318    HA   ARG  49           HA       ARG  49  -6.525   7.137  -1.467
  319   1HB   ARG  49          1HB       ARG  49  -5.479   5.476  -0.105
  320   2HB   ARG  49          2HB       ARG  49  -5.097   6.641   1.156
  321   1HG   ARG  49          1HG       ARG  49  -7.930   6.677   0.761
  322   2HG   ARG  49          2HG       ARG  49  -7.421   4.996   0.915
  323   1HD   ARG  49          1HD       ARG  49  -7.921   6.019   3.137
  324   2HD   ARG  49          2HD       ARG  49  -6.216   5.547   3.008
  325    HE   ARG  49           HE       ARG  49  -5.715   7.941   2.438
  326   1HH1  ARG  49          1HH1      ARG  49  -8.954   8.072   2.346
  327   2HH1  ARG  49          2HH1      ARG  49  -9.177   9.226   3.619
  328   1HH2  ARG  49          1HH2      ARG  49  -5.902   9.022   4.738
  329   2HH2  ARG  49          2HH2      ARG  49  -7.449   9.764   4.972
  330    H    ASP  50           H        ASP  50  -5.152   9.360   0.930
  331    HA   ASP  50           HA       ASP  50  -7.648  10.350   1.982
  332   1HB   ASP  50          1HB       ASP  50  -5.400  10.589   3.030
  333   2HB   ASP  50          2HB       ASP  50  -4.917  11.657   1.712
  334    H    GLN  51           H        GLN  51  -5.538  11.334  -0.709
  335    HA   GLN  51           HA       GLN  51  -7.216  13.627  -1.436
  336   1HB   GLN  51          2HB       GLN  51  -5.016  12.169  -2.942
  337   2HB   GLN  51          1HB       GLN  51  -5.596  13.804  -3.265
  338   1HG   GLN  51          1HG       GLN  51  -4.771  14.600  -1.148
  339   2HG   GLN  51          2HG       GLN  51  -4.406  12.959  -0.611
  340   2HE2  GLN  51          2HE2      GLN  51  -3.740  14.145  -3.902
  341   1HE2  GLN  51          1HE2      GLN  51  -2.049  14.070  -3.767
  342    H    LEU  52           H        LEU  52  -6.803  10.264  -2.449
  343    HA   LEU  52           HA       LEU  52  -8.386  10.389  -4.853
  344   1HB   LEU  52          1HB       LEU  52  -6.975   8.483  -3.206
  345   2HB   LEU  52          2HB       LEU  52  -8.548   7.821  -3.648
  346    HG   LEU  52           HG       LEU  52  -6.829   7.265  -5.340
  347   1HD1  LEU  52          1HD1      LEU  52  -9.368   8.172  -5.783
  348   2HD1  LEU  52          2HD1      LEU  52  -8.438   9.261  -6.813
  349   3HD1  LEU  52          3HD1      LEU  52  -8.322   7.516  -7.043
  350   1HD2  LEU  52          1HD2      LEU  52  -5.976   9.893  -4.844
  351   2HD2  LEU  52          2HD2      LEU  52  -5.336   8.796  -6.066
  352   3HD2  LEU  52          3HD2      LEU  52  -6.620   9.931  -6.484
  353    H    HIS  53           H        HIS  53  -9.164   9.748  -1.444
  354    HA   HIS  53           HA       HIS  53 -11.959   9.091  -1.974
  355   1HB   HIS  53          1HB       HIS  53 -10.196   9.608   0.413
  356   2HB   HIS  53          2HB       HIS  53 -11.942   9.470   0.623
  357    HD1  HIS  53           HD1      HIS  53 -11.575   7.196   1.913
  358    HD2  HIS  53           HD2      HIS  53 -10.338   7.147  -2.069
  359    HE1  HIS  53           HE1      HIS  53 -11.236   4.762   1.297
  360    H    GLN  54           H        GLN  54 -10.266  11.905  -0.536
  361    HA   GLN  54           HA       GLN  54 -12.539  13.546  -0.097
  362   1HB   GLN  54          1HB       GLN  54 -10.278  13.969   0.770
  363   2HB   GLN  54          2HB       GLN  54  -9.683  14.235  -0.869
  364   1HG   GLN  54          1HG       GLN  54 -10.444  16.361  -0.899
  365   2HG   GLN  54          2HG       GLN  54 -12.022  15.878  -0.275
  366   2HE2  GLN  54          2HE2      GLN  54 -12.473  16.600   1.809
  367   1HE2  GLN  54          1HE2      GLN  54 -11.307  17.059   2.955
  368    H    LEU  55           H        LEU  55 -10.586  13.029  -3.018
  369    HA   LEU  55           HA       LEU  55 -11.799  15.133  -4.586
  370   1HB   LEU  55          1HB       LEU  55 -10.107  12.696  -5.020
  371   2HB   LEU  55          2HB       LEU  55 -10.841  13.466  -6.428
  372    HG   LEU  55           HG       LEU  55  -9.464  15.221  -4.439
  373   1HD1  LEU  55          1HD1      LEU  55  -8.153  12.983  -5.517
  374   2HD1  LEU  55          2HD1      LEU  55  -7.648  14.339  -6.524
  375   3HD1  LEU  55          3HD1      LEU  55  -7.396  14.395  -4.779
  376   1HD2  LEU  55          1HD2      LEU  55 -10.217  15.201  -7.320
  377   2HD2  LEU  55          2HD2      LEU  55 -10.263  16.526  -6.156
  378   3HD2  LEU  55          3HD2      LEU  55  -8.733  16.056  -6.899
  379    H    ARG  56           H        ARG  56 -12.683  11.813  -3.845
  380    HA   ARG  56           HA       ARG  56 -14.515  11.332  -5.991
  381   1HB   ARG  56          1HB       ARG  56 -13.638   9.601  -4.501
  382   2HB   ARG  56          2HB       ARG  56 -14.416  10.366  -3.114
  383   1HG   ARG  56          1HG       ARG  56 -16.425   9.994  -5.089
  384   2HG   ARG  56          2HG       ARG  56 -15.532   8.477  -4.966
  385   1HD   ARG  56          1HD       ARG  56 -15.793   9.149  -2.319
  386   2HD   ARG  56          2HD       ARG  56 -17.317   9.757  -2.994
  387    HE   ARG  56           HE       ARG  56 -17.131   7.318  -4.196
  388   1HH1  ARG  56          1HH1      ARG  56 -18.553   8.243  -1.472
  389   2HH1  ARG  56          2HH1      ARG  56 -18.264   6.813  -0.541
  390   1HH2  ARG  56          1HH2      ARG  56 -15.953   5.506  -2.771
  391   2HH2  ARG  56          2HH2      ARG  56 -16.793   5.262  -1.276
  392    H    GLU  57           H        GLU  57 -15.166  12.427  -2.633
  393    HA   GLU  57           HA       GLU  57 -17.955  12.994  -3.116
  394   1HB   GLU  57          1HB       GLU  57 -16.990  12.514  -0.908
  395   2HB   GLU  57          2HB       GLU  57 -15.981  13.957  -1.019
  396   1HG   GLU  57          1HG       GLU  57 -17.680  15.013   0.045
  397   2HG   GLU  57          2HG       GLU  57 -18.503  14.962  -1.515
  398    H    LEU  58           H        LEU  58 -14.983  14.873  -3.416
  399    HA   LEU  58           HA       LEU  58 -16.215  17.478  -3.604
  400   1HB   LEU  58          1HB       LEU  58 -13.584  16.217  -4.371
  401   2HB   LEU  58          2HB       LEU  58 -13.922  17.900  -4.777
  402    HG   LEU  58           HG       LEU  58 -14.061  16.708  -1.992
  403   1HD1  LEU  58          1HD1      LEU  58 -11.754  16.978  -2.982
  404   2HD1  LEU  58          2HD1      LEU  58 -12.087  18.703  -3.138
  405   3HD1  LEU  58          3HD1      LEU  58 -12.040  17.954  -1.541
  406   1HD2  LEU  58          1HD2      LEU  58 -15.091  19.155  -3.181
  407   2HD2  LEU  58          2HD2      LEU  58 -15.346  18.515  -1.558
  408   3HD2  LEU  58          3HD2      LEU  58 -13.931  19.510  -1.901
  409    H    PHE  59           H        PHE  59 -15.896  14.824  -5.830
  410    HA   PHE  59           HA       PHE  59 -15.863  16.059  -8.351
  411   1HB   PHE  59          1HB       PHE  59 -15.774  13.638  -7.926
  412   2HB   PHE  59          2HB       PHE  59 -17.444  13.663  -7.360
  413    HD1  PHE  59           HD1      PHE  59 -15.231  13.946 -10.311
  414    HD2  PHE  59           HD2      PHE  59 -19.317  13.927  -8.914
  415    HE1  PHE  59           HE1      PHE  59 -16.032  13.676 -12.657
  416    HE2  PHE  59           HE2      PHE  59 -20.117  13.657 -11.259
  417    HZ   PHE  59           HZ       PHE  59 -18.475  13.531 -13.131
  418    H    ILE  60           H        ILE  60 -18.493  15.859  -6.012
  419    HA   ILE  60           HA       ILE  60 -20.585  16.706  -7.851
  420    HB   ILE  60           HB       ILE  60 -20.366  16.722  -4.822
  421   1HG1  ILE  60          2HG1      ILE  60 -20.016  14.490  -5.801
  422   2HG1  ILE  60          1HG1      ILE  60 -21.581  14.567  -4.992
  423   1HG2  ILE  60          1HG2      ILE  60 -22.589  17.264  -6.749
  424   2HG2  ILE  60          2HG2      ILE  60 -22.971  16.405  -5.258
  425   3HG2  ILE  60          3HG2      ILE  60 -22.253  18.013  -5.189
  426   1HD1  ILE  60          1HD1      ILE  60 -22.355  15.351  -7.441
  427   2HD1  ILE  60          2HD1      ILE  60 -20.958  14.379  -7.901
  428   3HD1  ILE  60          3HD1      ILE  60 -22.277  13.650  -6.985
  429    H    ALA  61           H        ALA  61 -18.516  18.335  -5.449
  430    HA   ALA  61           HA       ALA  61 -19.724  20.907  -5.514
  431   1HB   ALA  61          1HB       ALA  61 -17.522  19.620  -4.365
  432   2HB   ALA  61          3HB       ALA  61 -18.010  21.290  -4.080
  433   3HB   ALA  61          2HB       ALA  61 -16.811  20.921  -5.319
  434    H    ALA  62           H        ALA  62 -17.639  19.286  -7.819
  435    HA   ALA  62           HA       ALA  62 -17.207  21.810  -9.340
  436   1HB   ALA  62          1HB       ALA  62 -16.068  19.025  -9.303
  437   2HB   ALA  62          3HB       ALA  62 -15.819  20.051 -10.714
  438   3HB   ALA  62          2HB       ALA  62 -15.227  20.566  -9.135
  439    H    SER  63           H        SER  63 -17.957  18.446 -10.320
  440    HA   SER  63           HA       SER  63 -19.411  17.647 -12.004
  441   1HB   SER  63          1HB       SER  63 -20.953  18.571 -10.254
  442   2HB   SER  63          2HB       SER  63 -20.955  20.107 -11.116
  443    HG   SER  63           HG       SER  63 -22.641  19.105 -11.995
  444    H    LEU   8           H        LEU   8  15.085 -34.749  13.205
  445    HA   LEU   8           HA       LEU   8  15.643 -37.380  14.382
  446   1HB   LEU   8          1HB       LEU   8  13.110 -36.686  12.923
  447   2HB   LEU   8          2HB       LEU   8  13.778 -38.309  12.750
  448    HG   LEU   8           HG       LEU   8  13.927 -38.295  15.340
  449   1HD1  LEU   8          1HD1      LEU   8  12.220 -35.892  14.743
  450   2HD1  LEU   8          2HD1      LEU   8  11.916 -36.844  16.197
  451   3HD1  LEU   8          3HD1      LEU   8  13.487 -36.080  15.955
  452   1HD2  LEU   8          1HD2      LEU   8  11.532 -38.609  13.586
  453   2HD2  LEU   8          2HD2      LEU   8  12.361 -39.808  14.579
  454   3HD2  LEU   8          3HD2      LEU   8  11.265 -38.647  15.329
  455    H    GLU   9           H        GLU   9  17.671 -37.126  13.272
  456    HA   GLU   9           HA       GLU   9  19.141 -37.280  11.425
  457   1HB   GLU   9          1HB       GLU   9  17.273 -39.249  11.336
  458   2HB   GLU   9          2HB       GLU   9  16.972 -38.473   9.782
  459   1HG   GLU   9          1HG       GLU   9  18.667 -39.831   9.076
  460   2HG   GLU   9          2HG       GLU   9  19.687 -38.563   9.757
  461    HA   PRO  10           HA       PRO  10  16.944 -33.718   9.358
  462   1HB   PRO  10          1HB       PRO  10  18.812 -31.811   9.957
  463   2HB   PRO  10          2HB       PRO  10  17.454 -32.202  11.030
  464   1HG   PRO  10          2HG       PRO  10  20.303 -33.041  11.199
  465   2HG   PRO  10          1HG       PRO  10  19.176 -32.602  12.491
  466   1HD   PRO  10          1HD       PRO  10  19.834 -35.179  11.863
  467   2HD   PRO  10          2HD       PRO  10  18.295 -34.707  12.615
  468    H    ASP  11           H        ASP  11  20.477 -34.267   9.538
  469    HA   ASP  11           HA       ASP  11  22.099 -34.444   7.837
  470   1HB   ASP  11          1HB       ASP  11  19.586 -35.568   6.883
  471   2HB   ASP  11          2HB       ASP  11  20.543 -34.923   5.549
  472    H    ASN  12           H        ASN  12  19.535 -33.269   5.694
  473    HA   ASN  12           HA       ASN  12  20.656 -30.525   5.714
  474   1HB   ASN  12          1HB       ASN  12  21.118 -30.675   3.270
  475   2HB   ASN  12          2HB       ASN  12  22.099 -31.811   4.196
  476   2HD2  ASN  12          2HD2      ASN  12  19.064 -31.634   2.276
  477   1HD2  ASN  12          1HD2      ASN  12  19.090 -33.264   1.804
  478    H    VAL  13           H        VAL  13  17.993 -32.164   6.037
  479    HA   VAL  13           HA       VAL  13  16.336 -31.027   3.890
  480    HB   VAL  13           HB       VAL  13  16.038 -32.917   6.200
  481   1HG1  VAL  13          1HG1      VAL  13  13.892 -31.162   5.169
  482   2HG1  VAL  13          2HG1      VAL  13  13.498 -32.881   5.163
  483   3HG1  VAL  13          3HG1      VAL  13  13.960 -32.087   6.669
  484   1HG2  VAL  13          1HG2      VAL  13  15.421 -32.941   3.241
  485   2HG2  VAL  13          2HG2      VAL  13  16.670 -33.851   4.088
  486   3HG2  VAL  13          3HG2      VAL  13  14.970 -34.254   4.329
  487    HA   PRO  14           HA       PRO  14  14.528 -28.447   7.447
  488   1HB   PRO  14          1HB       PRO  14  15.543 -28.708   9.972
  489   2HB   PRO  14          2HB       PRO  14  14.220 -29.720   9.358
  490   1HG   PRO  14          2HG       PRO  14  17.107 -30.357   9.655
  491   2HG   PRO  14          1HG       PRO  14  15.690 -31.387   9.901
  492   1HD   PRO  14          1HD       PRO  14  17.273 -31.473   7.672
  493   2HD   PRO  14          2HD       PRO  14  15.570 -31.966   7.713
  494    H    MET  15           H        MET  15  17.953 -29.125   8.218
  495    HA   MET  15           HA       MET  15  19.807 -27.674   8.366
  496   1HB   MET  15          1HB       MET  15  18.224 -27.116   6.061
  497   2HB   MET  15          2HB       MET  15  18.798 -25.571   6.692
  498   1HG   MET  15          1HG       MET  15  20.940 -26.003   6.101
  499   2HG   MET  15          2HG       MET  15  20.862 -27.653   6.722
  500   1HE   MET  15          1HE       MET  15  22.545 -27.669   4.940
  501   2HE   MET  15          2HE       MET  15  22.188 -28.417   3.386
  502   3HE   MET  15          3HE       MET  15  22.247 -26.661   3.517
  503    H    ASP  16           H        ASP  16  19.967 -24.885   8.327
  504    HA   ASP  16           HA       ASP  16  18.094 -24.011  10.499
  505   1HB   ASP  16          1HB       ASP  16  21.111 -23.716  10.331
  506   2HB   ASP  16          2HB       ASP  16  20.102 -23.006  11.591
  507    H    MET  17           H        MET  17  17.868 -23.350   7.712
  508    HA   MET  17           HA       MET  17  19.135 -20.922   6.939
  509   1HB   MET  17          1HB       MET  17  17.201 -20.783   5.387
  510   2HB   MET  17          2HB       MET  17  17.844 -22.424   5.466
  511   1HG   MET  17          1HG       MET  17  16.061 -22.655   7.425
  512   2HG   MET  17          2HG       MET  17  15.276 -21.341   6.552
  513   1HE   MET  17          1HE       MET  17  14.581 -21.269   4.339
  514   2HE   MET  17          2HE       MET  17  15.945 -21.914   3.430
  515   3HE   MET  17          3HE       MET  17  14.340 -22.602   3.203
  516    H    SER  18           H        SER  18  16.322 -21.532   8.997
  517    HA   SER  18           HA       SER  18  16.444 -18.758   9.995
  518   1HB   SER  18          1HB       SER  18  13.874 -19.799   8.794
  519   2HB   SER  18          2HB       SER  18  14.283 -18.138   9.217
  520    HG   SER  18           HG       SER  18  14.770 -18.079   7.155
  521    HA   PRO  19           HA       PRO  19  14.754 -20.820  13.497
  522   1HB   PRO  19          1HB       PRO  19  13.631 -18.737  14.858
  523   2HB   PRO  19          2HB       PRO  19  15.382 -18.968  14.705
  524   1HG   PRO  19          1HG       PRO  19  13.637 -17.009  13.406
  525   2HG   PRO  19          2HG       PRO  19  15.376 -16.951  13.697
  526   1HD   PRO  19          1HD       PRO  19  14.036 -17.573  11.262
  527   2HD   PRO  19          2HD       PRO  19  15.784 -17.605  11.580
  528    H    LYS  20           H        LYS  20  12.831 -20.252  11.061
  529    HA   LYS  20           HA       LYS  20  10.608 -20.844  10.550
  530   1HB   LYS  20          1HB       LYS  20  11.365 -22.660  12.221
  531   2HB   LYS  20          2HB       LYS  20  10.418 -21.775  13.418
  532   1HG   LYS  20          1HG       LYS  20   9.153 -22.445  10.783
  533   2HG   LYS  20          2HG       LYS  20   9.297 -23.709  12.006
  534   1HD   LYS  20          1HD       LYS  20   8.380 -21.517  13.448
  535   2HD   LYS  20          2HD       LYS  20   7.498 -21.406  11.924
  536   1HE   LYS  20          1HE       LYS  20   7.441 -24.140  12.578
  537   2HE   LYS  20          2HE       LYS  20   7.121 -23.290  14.104
  538   1HZ   LYS  20          1HZ       LYS  20   5.820 -22.597  11.526
  539   2HZ   LYS  20          2HZ       LYS  20   5.113 -23.616  12.687
  540   3HZ   LYS  20          3HZ       LYS  20   5.435 -21.996  13.067
  541    H    ALA  21           H        ALA  21  10.358 -19.932  14.016
  542    HA   ALA  21           HA       ALA  21   7.911 -18.630  13.985
  543   1HB   ALA  21          1HB       ALA  21  10.501 -18.138  15.451
  544   2HB   ALA  21          3HB       ALA  21   9.062 -17.185  15.814
  545   3HB   ALA  21          2HB       ALA  21   9.041 -18.934  16.038
  546    H    LEU  22           H        LEU  22  11.063 -17.133  13.201
  547    HA   LEU  22           HA       LEU  22   9.837 -14.559  12.513
  548   1HB   LEU  22          1HB       LEU  22  12.581 -15.819  12.368
  549   2HB   LEU  22          2HB       LEU  22  12.276 -14.219  11.692
  550    HG   LEU  22           HG       LEU  22  11.327 -13.551  13.939
  551   1HD1  LEU  22          1HD1      LEU  22  12.212 -16.353  14.498
  552   2HD1  LEU  22          2HD1      LEU  22  12.383 -15.153  15.778
  553   3HD1  LEU  22          3HD1      LEU  22  10.795 -15.490  15.090
  554   1HD2  LEU  22          1HD2      LEU  22  14.201 -14.371  13.540
  555   2HD2  LEU  22          2HD2      LEU  22  13.504 -12.751  13.530
  556   3HD2  LEU  22          3HD2      LEU  22  13.687 -13.624  15.053
  557    H    GLN  23           H        GLN  23  11.434 -17.209  10.755
  558    HA   GLN  23           HA       GLN  23  11.248 -16.244   8.118
  559   1HB   GLN  23          1HB       GLN  23  12.354 -18.337   9.015
  560   2HB   GLN  23          2HB       GLN  23  10.759 -19.089   9.047
  561   1HG   GLN  23          1HG       GLN  23  10.513 -18.707   6.630
  562   2HG   GLN  23          2HG       GLN  23  12.092 -17.921   6.586
  563   2HE2  GLN  23          2HE2      GLN  23  11.158 -20.881   8.395
  564   1HE2  GLN  23          1HE2      GLN  23  12.266 -21.897   7.607
  565    H    GLN  24           H        GLN  24   8.854 -18.351   9.769
  566    HA   GLN  24           HA       GLN  24   6.883 -18.245   7.703
  567   1HB   GLN  24          1HB       GLN  24   7.050 -19.863   9.611
  568   2HB   GLN  24          2HB       GLN  24   6.536 -18.575  10.701
  569   1HG   GLN  24          1HG       GLN  24   4.489 -19.561  10.245
  570   2HG   GLN  24          2HG       GLN  24   4.545 -18.353   8.962
  571   2HE2  GLN  24          2HE2      GLN  24   3.617 -19.397   7.172
  572   1HE2  GLN  24          1HE2      GLN  24   4.104 -20.916   6.590
  573    H    LYS  25           H        LYS  25   7.221 -16.316  10.703
  574    HA   LYS  25           HA       LYS  25   4.903 -14.707  10.409
  575   1HB   LYS  25          1HB       LYS  25   7.614 -14.402  11.687
  576   2HB   LYS  25          2HB       LYS  25   6.455 -13.075  11.749
  577   1HG   LYS  25          1HG       LYS  25   4.809 -14.487  12.838
  578   2HG   LYS  25          2HG       LYS  25   5.843 -15.904  12.646
  579   1HD   LYS  25          2HD       LYS  25   6.347 -15.304  14.833
  580   2HD   LYS  25          1HD       LYS  25   7.590 -14.410  13.957
  581   1HE   LYS  25          2HE       LYS  25   6.661 -12.780  15.411
  582   2HE   LYS  25          1HE       LYS  25   5.808 -12.489  13.882
  583   1HZ   LYS  25          1HZ       LYS  25   4.086 -14.059  14.634
  584   2HZ   LYS  25          2HZ       LYS  25   4.865 -14.176  16.139
  585   3HZ   LYS  25          3HZ       LYS  25   4.200 -12.697  15.642
  586    H    ILE  26           H        ILE  26   8.264 -13.980   9.379
  587    HA   ILE  26           HA       ILE  26   7.799 -11.492   8.139
  588    HB   ILE  26           HB       ILE  26   9.670 -13.774   7.424
  589   1HG1  ILE  26          1HG1      ILE  26  10.325 -11.266   8.970
  590   2HG1  ILE  26          2HG1      ILE  26   9.658 -12.682   9.783
  591   1HG2  ILE  26          1HG2      ILE  26   9.715 -10.841   6.655
  592   2HG2  ILE  26          2HG2      ILE  26  11.068 -11.948   6.423
  593   3HG2  ILE  26          3HG2      ILE  26   9.553 -12.215   5.562
  594   1HD1  ILE  26          1HD1      ILE  26  11.744 -13.564   8.037
  595   2HD1  ILE  26          2HD1      ILE  26  12.364 -12.220   8.997
  596   3HD1  ILE  26          3HD1      ILE  26  11.692 -13.641   9.798
  597    H    HIS  27           H        HIS  27   7.940 -14.673   6.477
  598    HA   HIS  27           HA       HIS  27   6.991 -13.750   3.955
  599   1HB   HIS  27          1HB       HIS  27   7.035 -16.386   5.421
  600   2HB   HIS  27          2HB       HIS  27   6.357 -16.268   3.797
  601    HD1  HIS  27           HD1      HIS  27   8.042 -16.816   2.058
  602    HD2  HIS  27           HD2      HIS  27   9.808 -14.969   5.351
  603    HE1  HIS  27           HE1      HIS  27  10.516 -16.647   1.544
  604    H    GLU  28           H        GLU  28   5.278 -14.634   6.899
  605    HA   GLU  28           HA       GLU  28   2.655 -14.830   5.615
  606   1HB   GLU  28          1HB       GLU  28   3.801 -14.856   8.395
  607   2HB   GLU  28          2HB       GLU  28   2.058 -14.696   8.179
  608   1HG   GLU  28          1HG       GLU  28   3.750 -16.907   6.975
  609   2HG   GLU  28          2HG       GLU  28   2.765 -17.072   8.429
  610    H    LEU  29           H        LEU  29   4.391 -12.393   7.561
  611    HA   LEU  29           HA       LEU  29   2.184 -10.513   7.633
  612   1HB   LEU  29          1HB       LEU  29   5.161 -10.420   8.151
  613   2HB   LEU  29          2HB       LEU  29   4.147  -8.987   8.325
  614    HG   LEU  29           HG       LEU  29   3.440 -11.586   9.685
  615   1HD1  LEU  29          1HD1      LEU  29   5.788 -10.732  10.280
  616   2HD1  LEU  29          2HD1      LEU  29   4.979  -9.328  10.979
  617   3HD1  LEU  29          3HD1      LEU  29   4.664 -10.940  11.624
  618   1HD2  LEU  29          1HD2      LEU  29   2.422  -8.841   9.578
  619   2HD2  LEU  29          2HD2      LEU  29   1.622 -10.311  10.134
  620   3HD2  LEU  29          3HD2      LEU  29   2.671  -9.410  11.228
  621    H    GLU  30           H        GLU  30   5.012 -10.960   5.526
  622    HA   GLU  30           HA       GLU  30   4.712  -8.508   4.039
  623   1HB   GLU  30          1HB       GLU  30   6.618 -10.354   4.283
  624   2HB   GLU  30          2HB       GLU  30   5.836 -11.018   2.848
  625   1HG   GLU  30          1HG       GLU  30   6.275  -8.099   2.769
  626   2HG   GLU  30          2HG       GLU  30   7.750  -9.065   2.780
  627    H    GLY  31           H        GLY  31   3.653 -11.867   3.385
  628   1HA   GLY  31          2HA       GLY  31   1.937 -12.668   1.999
  629   2HA   GLY  31          1HA       GLY  31   2.436 -11.403   0.874
  630    H    LEU  32           H        LEU  32   1.232 -10.835   4.149
  631    HA   LEU  32           HA       LEU  32  -1.505 -10.284   3.427
  632   1HB   LEU  32          1HB       LEU  32  -0.467 -10.813   5.702
  633   2HB   LEU  32          2HB       LEU  32   0.096  -9.142   5.731
  634    HG   LEU  32           HG       LEU  32  -2.250  -8.372   5.437
  635   1HD1  LEU  32          1HD1      LEU  32  -2.622 -11.214   4.943
  636   2HD1  LEU  32          2HD1      LEU  32  -3.720 -10.634   6.196
  637   3HD1  LEU  32          3HD1      LEU  32  -3.715  -9.872   4.605
  638   1HD2  LEU  32          1HD2      LEU  32  -1.023  -9.263   7.727
  639   2HD2  LEU  32          2HD2      LEU  32  -2.568  -8.412   7.692
  640   3HD2  LEU  32          3HD2      LEU  32  -2.533 -10.174   7.756
  641    H    MET  33           H        MET  33   1.404  -8.264   3.703
  642    HA   MET  33           HA       MET  33   0.107  -5.718   3.353
  643   1HB   MET  33          1HB       MET  33   2.663  -6.782   3.828
  644   2HB   MET  33          2HB       MET  33   2.814  -5.918   2.299
  645   1HG   MET  33          1HG       MET  33   1.904  -3.887   3.317
  646   2HG   MET  33          2HG       MET  33   1.621  -4.744   4.829
  647   1HE   MET  33          1HE       MET  33   3.904  -4.354   2.082
  648   2HE   MET  33          2HE       MET  33   5.171  -3.291   2.683
  649   3HE   MET  33          3HE       MET  33   5.408  -5.037   2.719
  650    H    MET  34           H        MET  34   1.049  -8.248   1.128
  651    HA   MET  34           HA       MET  34   1.032  -6.556  -1.259
  652   1HB   MET  34          1HB       MET  34   2.283  -8.774  -0.747
  653   2HB   MET  34          2HB       MET  34   0.752  -9.559  -1.138
  654   1HG   MET  34          2HG       MET  34   1.547  -9.503  -3.273
  655   2HG   MET  34          1HG       MET  34   0.991  -7.831  -3.236
  656   1HE   MET  34          1HE       MET  34   2.004  -6.102  -3.609
  657   2HE   MET  34          2HE       MET  34   3.059  -5.720  -2.251
  658   3HE   MET  34          3HE       MET  34   3.711  -5.774  -3.895
  659    H    GLN  35           H        GLN  35  -1.089  -9.252  -0.181
  660    HA   GLN  35           HA       GLN  35  -3.121  -9.017  -2.086
  661   1HB   GLN  35          1HB       GLN  35  -4.545 -10.010  -0.285
  662   2HB   GLN  35          2HB       GLN  35  -2.963 -10.781  -0.395
  663   1HG   GLN  35          1HG       GLN  35  -2.142  -9.369   1.455
  664   2HG   GLN  35          2HG       GLN  35  -3.726  -8.602   1.570
  665   2HE2  GLN  35          2HE2      GLN  35  -2.095 -11.782   1.893
  666   1HE2  GLN  35          1HE2      GLN  35  -3.255 -12.444   2.940
  667    H    HIS  36           H        HIS  36  -2.573  -7.023   0.789
  668    HA   HIS  36           HA       HIS  36  -5.102  -5.569   0.526
  669   1HB   HIS  36          1HB       HIS  36  -2.565  -5.282   2.153
  670   2HB   HIS  36          2HB       HIS  36  -3.906  -4.144   2.295
  671    HD1  HIS  36           HD1      HIS  36  -6.283  -6.090   2.105
  672    HD2  HIS  36           HD2      HIS  36  -2.918  -6.803   4.459
  673    HE1  HIS  36           HE1      HIS  36  -6.999  -7.725   3.900
  674    H    ALA  37           H        ALA  37  -1.659  -4.594   0.196
  675    HA   ALA  37           HA       ALA  37  -1.980  -2.025  -0.855
  676   1HB   ALA  37          1HB       ALA  37   0.214  -2.690  -0.402
  677   2HB   ALA  37          3HB       ALA  37   0.002  -4.258  -1.182
  678   3HB   ALA  37          2HB       ALA  37   0.198  -2.806  -2.162
  679    H    GLN  38           H        GLN  38  -2.531  -5.118  -2.425
  680    HA   GLN  38           HA       GLN  38  -2.660  -4.041  -5.142
  681   1HB   GLN  38          1HB       GLN  38  -2.935  -6.600  -3.699
  682   2HB   GLN  38          2HB       GLN  38  -3.975  -6.464  -5.119
  683   1HG   GLN  38          1HG       GLN  38  -1.879  -5.646  -6.366
  684   2HG   GLN  38          2HG       GLN  38  -0.966  -6.251  -4.983
  685   2HE2  GLN  38          2HE2      GLN  38  -1.768  -7.195  -8.002
  686   1HE2  GLN  38          1HE2      GLN  38  -1.936  -8.869  -7.772
  687    H    ASN  39           H        ASN  39  -4.978  -4.929  -2.595
  688    HA   ASN  39           HA       ASN  39  -7.254  -4.007  -4.271
  689   1HB   ASN  39          1HB       ASN  39  -6.948  -5.400  -1.596
  690   2HB   ASN  39          2HB       ASN  39  -8.516  -4.902  -2.235
  691   2HD2  ASN  39          2HD2      ASN  39  -7.662  -7.690  -1.799
  692   1HD2  ASN  39          1HD2      ASN  39  -7.676  -8.446  -3.319
  693    H    LEU  40           H        LEU  40  -5.167  -2.166  -3.131
  694    HA   LEU  40           HA       LEU  40  -5.077  -0.077  -2.053
  695   1HB   LEU  40          1HB       LEU  40  -7.987  -0.472  -2.760
  696   2HB   LEU  40          2HB       LEU  40  -7.430   1.014  -1.991
  697    HG   LEU  40           HG       LEU  40  -5.570   0.752  -3.960
  698   1HD1  LEU  40          1HD1      LEU  40  -8.032  -0.728  -4.776
  699   2HD1  LEU  40          2HD1      LEU  40  -7.269   0.309  -5.981
  700   3HD1  LEU  40          3HD1      LEU  40  -6.353  -1.002  -5.239
  701   1HD2  LEU  40          1HD2      LEU  40  -6.943   2.752  -3.407
  702   2HD2  LEU  40          2HD2      LEU  40  -6.851   2.479  -5.146
  703   3HD2  LEU  40          3HD2      LEU  40  -8.308   2.030  -4.259
  704    H    GLU  41           H        GLU  41  -5.494  -2.590  -0.418
  705    HA   GLU  41           HA       GLU  41  -6.971  -1.477   1.926
  706   1HB   GLU  41          1HB       GLU  41  -6.893  -3.960   0.685
  707   2HB   GLU  41          2HB       GLU  41  -5.858  -4.187   2.094
  708   1HG   GLU  41          2HG       GLU  41  -7.858  -4.600   3.130
  709   2HG   GLU  41          1HG       GLU  41  -7.893  -2.839   3.252
  710    H    PHE  42           H        PHE  42  -4.021  -0.998   0.844
  711    HA   PHE  42           HA       PHE  42  -2.162  -1.989   2.716
  712   1HB   PHE  42          1HB       PHE  42  -0.851   0.048   1.980
  713   2HB   PHE  42          2HB       PHE  42  -1.466  -0.954   0.668
  714    HD1  PHE  42           HD1      PHE  42  -2.542   1.975   2.792
  715    HD2  PHE  42           HD2      PHE  42  -2.588   0.100  -1.098
  716    HE1  PHE  42           HE1      PHE  42  -3.750   3.939   1.852
  717    HE2  PHE  42           HE2      PHE  42  -3.780   2.049  -2.027
  718    HZ   PHE  42           HZ       PHE  42  -4.363   3.980  -0.559
  719    H    GLU  43           H        GLU  43  -4.696   0.313   3.248
  720    HA   GLU  43           HA       GLU  43  -3.603   2.086   5.125
  721   1HB   GLU  43          1HB       GLU  43  -5.969   1.837   6.214
  722   2HB   GLU  43          2HB       GLU  43  -5.859   2.430   4.564
  723   1HG   GLU  43          1HG       GLU  43  -6.006  -0.423   4.432
  724   2HG   GLU  43          2HG       GLU  43  -7.260   0.129   5.537
  725    H    GLU  44           H        GLU  44  -5.201  -1.005   6.036
  726    HA   GLU  44           HA       GLU  44  -3.819  -1.011   8.631
  727   1HB   GLU  44          1HB       GLU  44  -5.143  -3.104   8.905
  728   2HB   GLU  44          2HB       GLU  44  -6.153  -1.760   8.372
  729   1HG   GLU  44          1HG       GLU  44  -6.387  -2.609   6.218
  730   2HG   GLU  44          2HG       GLU  44  -4.886  -3.532   6.308
  731    H    ALA  45           H        ALA  45  -3.333  -2.273   5.433
  732    HA   ALA  45           HA       ALA  45  -1.637  -4.526   6.170
  733   1HB   ALA  45          1HB       ALA  45  -2.904  -3.340   3.861
  734   2HB   ALA  45          3HB       ALA  45  -1.214  -3.691   3.494
  735   3HB   ALA  45          2HB       ALA  45  -2.278  -4.979   4.056
  736    H    ALA  46           H        ALA  46  -0.903  -1.466   4.439
  737    HA   ALA  46           HA       ALA  46   1.837  -1.551   4.235
  738   1HB   ALA  46          1HB       ALA  46   1.673   0.975   4.601
  739   2HB   ALA  46          3HB       ALA  46   0.580   0.300   3.393
  740   3HB   ALA  46          2HB       ALA  46  -0.021   0.708   5.001
  741    H    GLN  47           H        GLN  47   0.020  -1.102   7.226
  742    HA   GLN  47           HA       GLN  47   2.111  -0.100   8.885
  743   1HB   GLN  47          1HB       GLN  47  -0.174  -1.992   9.525
  744   2HB   GLN  47          2HB       GLN  47   0.700  -1.001  10.693
  745   1HG   GLN  47          1HG       GLN  47  -0.338   0.523   8.401
  746   2HG   GLN  47          2HG       GLN  47  -1.598  -0.226   9.384
  747   2HE2  GLN  47          2HE2      GLN  47  -0.855   2.686   9.218
  748   1HE2  GLN  47          1HE2      GLN  47  -0.470   3.144  10.805
  749    H    ILE  48           H        ILE  48   1.372  -3.360   7.732
  750    HA   ILE  48           HA       ILE  48   2.922  -4.932   9.492
  751    HB   ILE  48           HB       ILE  48   2.487  -5.132   6.494
  752   1HG1  ILE  48          1HG1      ILE  48   1.036  -6.482   8.791
  753   2HG1  ILE  48          2HG1      ILE  48   0.440  -5.046   7.958
  754   1HG2  ILE  48          1HG2      ILE  48   4.188  -6.654   8.162
  755   2HG2  ILE  48          2HG2      ILE  48   2.767  -7.655   7.861
  756   3HG2  ILE  48          3HG2      ILE  48   3.704  -7.023   6.506
  757   1HD1  ILE  48          1HD1      ILE  48   1.203  -7.473   6.360
  758   2HD1  ILE  48          2HD1      ILE  48  -0.363  -7.420   7.170
  759   3HD1  ILE  48          3HD1      ILE  48   0.049  -6.199   5.966
  760    H    ARG  49           H        ARG  49   3.905  -2.847   6.816
  761    HA   ARG  49           HA       ARG  49   6.542  -3.604   6.309
  762   1HB   ARG  49          1HB       ARG  49   5.503  -1.804   5.129
  763   2HB   ARG  49          2HB       ARG  49   5.169  -0.922   6.614
  764   1HG   ARG  49          1HG       ARG  49   7.992  -1.363   6.474
  765   2HG   ARG  49          2HG       ARG  49   7.462  -0.725   4.919
  766   1HD   ARG  49          1HD       ARG  49   8.030   1.103   6.523
  767   2HD   ARG  49          2HD       ARG  49   6.315   1.145   6.070
  768    HE   ARG  49           HE       ARG  49   5.838  -0.076   8.213
  769   1HH1  ARG  49          1HH1      ARG  49   9.076  -0.261   8.241
  770   2HH1  ARG  49          2HH1      ARG  49   9.347   0.623   9.706
  771   1HH2  ARG  49          1HH2      ARG  49   6.096   1.814   9.900
  772   2HH2  ARG  49          2HH2      ARG  49   7.660   1.798  10.645
  773    H    ASP  50           H        ASP  50   5.261  -1.917   9.153
  774    HA   ASP  50           HA       ASP  50   7.797  -1.239  10.348
  775   1HB   ASP  50          1HB       ASP  50   5.579  -0.262  10.925
  776   2HB   ASP  50          2HB       ASP  50   5.081  -1.821  11.582
  777    H    GLN  51           H        GLN  51   5.640  -4.060  10.567
  778    HA   GLN  51           HA       GLN  51   7.335  -5.442  12.519
  779   1HB   GLN  51          2HB       GLN  51   5.078  -6.428  10.740
  780   2HB   GLN  51          1HB       GLN  51   5.675  -7.216  12.201
  781   1HG   GLN  51          1HG       GLN  51   4.912  -5.401  13.587
  782   2HG   GLN  51          2HG       GLN  51   4.536  -4.411  12.176
  783   2HE2  GLN  51          2HE2      GLN  51   3.810  -7.891  12.387
  784   1HE2  GLN  51          1HE2      GLN  51   2.123  -7.709  12.389
  785    H    LEU  52           H        LEU  52   6.845  -5.444   9.016
  786    HA   LEU  52           HA       LEU  52   8.373  -7.811   8.415
  787   1HB   LEU  52          1HB       LEU  52   6.972  -5.662   7.092
  788   2HB   LEU  52          2HB       LEU  52   8.524  -5.924   6.297
  789    HG   LEU  52           HG       LEU  52   6.756  -7.354   5.317
  790   1HD1  LEU  52          1HD1      LEU  52   9.298  -8.086   6.005
  791   2HD1  LEU  52          2HD1      LEU  52   8.360  -9.366   6.774
  792   3HD1  LEU  52          3HD1      LEU  52   8.212  -9.085   5.039
  793   1HD2  LEU  52          1HD2      LEU  52   5.956  -7.614   7.995
  794   2HD2  LEU  52          2HD2      LEU  52   5.271  -8.462   6.608
  795   3HD2  LEU  52          3HD2      LEU  52   6.562  -9.210   7.549
  796    H    HIS  53           H        HIS  53   9.221  -4.377   8.760
  797    HA   HIS  53           HA       HIS  53  11.994  -4.747   7.917
  798   1HB   HIS  53          1HB       HIS  53  10.295  -2.577   9.133
  799   2HB   HIS  53          2HB       HIS  53  12.043  -2.367   9.025
  800    HD1  HIS  53           HD1      HIS  53  11.670  -0.473   7.222
  801    HD2  HIS  53           HD2      HIS  53  10.345  -4.252   6.064
  802    HE1  HIS  53           HE1      HIS  53  11.279  -0.360   4.722
  803    H    GLN  54           H        GLN  54  10.378  -4.144  11.061
  804    HA   GLN  54           HA       GLN  54  12.685  -4.234  12.710
  805   1HB   GLN  54          1HB       GLN  54  10.453  -3.482  13.414
  806   2HB   GLN  54          2HB       GLN  54   9.824  -5.118  13.212
  807   1HG   GLN  54          1HG       GLN  54  10.615  -5.771  15.223
  808   2HG   GLN  54          2HG       GLN  54  12.200  -5.064  14.905
  809   2HE2  GLN  54          2HE2      GLN  54  12.712  -3.282  16.182
  810   1HE2  GLN  54          1HE2      GLN  54  11.582  -2.294  16.975
  811    H    LEU  55           H        LEU  55  10.657  -6.849  11.422
  812    HA   LEU  55           HA       LEU  55  11.864  -8.975  12.963
  813   1HB   LEU  55          1HB       LEU  55  10.125  -8.663  10.542
  814   2HB   LEU  55          2HB       LEU  55  10.837 -10.245  10.860
  815    HG   LEU  55           HG       LEU  55   9.536  -8.817  13.141
  816   1HD1  LEU  55          1HD1      LEU  55   8.165  -9.184  10.717
  817   2HD1  LEU  55          2HD1      LEU  55   7.657 -10.528  11.740
  818   3HD1  LEU  55          3HD1      LEU  55   7.447  -8.868  12.297
  819   1HD2  LEU  55          1HD2      LEU  55  10.221 -11.586  12.282
  820   2HD2  LEU  55          2HD2      LEU  55  10.312 -10.850  13.883
  821   3HD2  LEU  55          3HD2      LEU  55   8.759 -11.399  13.252
  822    H    ARG  56           H        ARG  56  12.714  -7.331   9.975
  823    HA   ARG  56           HA       ARG  56  14.487  -9.283   8.863
  824   1HB   ARG  56          1HB       ARG  56  13.619  -7.343   7.649
  825   2HB   ARG  56          2HB       ARG  56  14.442  -6.249   8.761
  826   1HG   ARG  56          1HG       ARG  56  16.397  -8.072   7.796
  827   2HG   ARG  56          2HG       ARG  56  15.484  -7.503   6.397
  828   1HD   ARG  56          1HD       ARG  56  15.818  -5.163   7.792
  829   2HD   ARG  56          2HD       ARG  56  17.334  -6.013   8.149
  830    HE   ARG  56           HE       ARG  56  17.084  -6.463   5.473
  831   1HH1  ARG  56          1HH1      ARG  56  18.582  -4.143   7.109
  832   2HH1  ARG  56          2HH1      ARG  56  18.295  -2.837   6.009
  833   1HH2  ARG  56          1HH2      ARG  56  15.913  -4.559   4.168
  834   2HH2  ARG  56          2HH2      ARG  56  16.784  -3.072   4.344
  835    H    GLU  57           H        GLU  57  15.234  -6.392  10.856
  836    HA   GLU  57           HA       GLU  57  18.019  -7.068  11.202
  837   1HB   GLU  57          1HB       GLU  57  17.100  -4.798  11.395
  838   2HB   GLU  57          2HB       GLU  57  16.111  -5.298  12.766
  839   1HG   GLU  57          2HG       GLU  57  17.851  -4.612  14.045
  840   2HG   GLU  57          1HG       GLU  57  18.635  -6.107  13.532
  841    H    LEU  58           H        LEU  58  15.070  -7.838  12.981
  842    HA   LEU  58           HA       LEU  58  16.338  -8.786  15.395
  843   1HB   LEU  58          1HB       LEU  58  13.671  -9.112  14.025
  844   2HB   LEU  58          2HB       LEU  58  14.025  -9.989  15.515
  845    HG   LEU  58           HG       LEU  58  14.212  -6.982  15.167
  846   1HD1  LEU  58          1HD1      LEU  58  11.886  -7.966  15.191
  847   2HD1  LEU  58          2HD1      LEU  58  12.243  -8.613  16.792
  848   3HD1  LEU  58          3HD1      LEU  58  12.221  -6.869  16.531
  849   1HD2  LEU  58          1HD2      LEU  58  15.251  -8.841  17.148
  850   2HD2  LEU  58          2HD2      LEU  58  15.535  -7.107  16.993
  851   3HD2  LEU  58          3HD2      LEU  58  14.128  -7.694  17.879
  852    H    PHE  59           H        PHE  59  15.925 -10.153  12.223
  853    HA   PHE  59           HA       PHE  59  15.851 -12.921  12.688
  854   1HB   PHE  59          1HB       PHE  59  15.735 -11.820  10.493
  855   2HB   PHE  59          2HB       PHE  59  17.418 -11.315  10.641
  856    HD1  PHE  59           HD1      PHE  59  15.141 -14.184  10.117
  857    HD2  PHE  59           HD2      PHE  59  19.257 -12.915  10.409
  858    HE1  PHE  59           HE1      PHE  59  15.881 -16.368   9.171
  859    HE2  PHE  59           HE2      PHE  59  19.998 -15.099   9.464
  860    HZ   PHE  59           HZ       PHE  59  18.310 -16.826   8.844
  861    H    ILE  60           H        ILE  60  18.531 -10.670  13.109
  862    HA   ILE  60           HA       ILE  60  20.593 -12.713  13.349
  863    HB   ILE  60           HB       ILE  60  20.446  -9.812  14.235
  864   1HG1  ILE  60          2HG1      ILE  60  20.039 -10.106  11.823
  865   2HG1  ILE  60          1HG1      ILE  60  21.624  -9.382  12.093
  866   1HG2  ILE  60          1HG2      ILE  60  22.632 -11.854  14.153
  867   2HG2  ILE  60          2HG2      ILE  60  23.036 -10.185  13.750
  868   3HG2  ILE  60          3HG2      ILE  60  22.343 -10.569  15.326
  869   1HD1  ILE  60          1HD1      ILE  60  22.352 -11.966  12.129
  870   2HD1  ILE  60          2HD1      ILE  60  20.928 -12.103  11.097
  871   3HD1  ILE  60          3HD1      ILE  60  22.257 -11.041  10.631
  872    H    ALA  61           H        ALA  61  18.606 -10.841  15.641
  873    HA   ALA  61           HA       ALA  61  19.853 -11.661  18.059
  874   1HB   ALA  61          1HB       ALA  61  17.662 -10.151  17.203
  875   2HB   ALA  61          3HB       ALA  61  18.179 -10.368  18.875
  876   3HB   ALA  61          2HB       ALA  61  16.946 -11.426  18.190
  877    H    ALA  62           H        ALA  62  17.690 -13.368  15.893
  878    HA   ALA  62           HA       ALA  62  17.261 -15.540  17.886
  879   1HB   ALA  62          1HB       ALA  62  16.081 -14.686  15.252
  880   2HB   ALA  62          3HB       ALA  62  15.813 -16.328  15.839
  881   3HB   ALA  62          2HB       ALA  62  15.268 -14.950  16.795
  882    H    SER  63           H        SER  63  17.935 -15.529  14.367
  883    HA   SER  63           HA       SER  63  19.337 -16.941  13.088
  884   1HB   SER  63          1HB       SER  63  20.933 -15.557  14.441
  885   2HB   SER  63          2HB       SER  63  20.939 -16.823  15.665
  886    HG   SER  63           HG       SER  63  22.587 -17.409  14.417

  No H/Q in entry =         886
  Start of MODEL    3
    1    H    LEU   8           H        LEU   8 -19.898   6.189 -27.656
    2    HA   LEU   8           HA       LEU   8 -19.975   8.929 -28.649
    3   1HB   LEU   8          1HB       LEU   8 -20.878   6.447 -29.437
    4   2HB   LEU   8          2HB       LEU   8 -22.368   7.227 -28.907
    5    HG   LEU   8           HG       LEU   8 -20.534   8.861 -30.586
    6   1HD1  LEU   8          1HD1      LEU   8 -21.547   6.253 -31.410
    7   2HD1  LEU   8          2HD1      LEU   8 -22.160   7.547 -32.438
    8   3HD1  LEU   8          3HD1      LEU   8 -20.422   7.328 -32.240
    9   1HD2  LEU   8          1HD2      LEU   8 -23.526   8.426 -30.361
   10   2HD2  LEU   8          2HD2      LEU   8 -22.607   9.838 -29.838
   11   3HD2  LEU   8          3HD2      LEU   8 -22.791   9.493 -31.559
   12    H    GLU   9           H        GLU   9 -20.422  10.419 -26.998
   13    HA   GLU   9           HA       GLU   9 -21.693  11.547 -25.354
   14   1HB   GLU   9          1HB       GLU   9 -23.263  10.784 -27.504
   15   2HB   GLU   9          2HB       GLU   9 -24.182  10.185 -26.122
   16   1HG   GLU   9          1HG       GLU   9 -23.528  12.621 -25.175
   17   2HG   GLU   9          2HG       GLU   9 -23.542  12.984 -26.902
   18    HA   PRO  10           HA       PRO  10 -21.784   7.842 -22.627
   19   1HB   PRO  10          1HB       PRO  10 -20.414   9.006 -20.564
   20   2HB   PRO  10          2HB       PRO  10 -19.609   8.224 -21.939
   21   1HG   PRO  10          2HG       PRO  10 -20.062  11.113 -21.406
   22   2HG   PRO  10          1HG       PRO  10 -18.666  10.302 -22.132
   23   1HD   PRO  10          1HD       PRO  10 -20.572  11.635 -23.572
   24   2HD   PRO  10          2HD       PRO  10 -19.586  10.307 -24.222
   25    H    ASP  11           H        ASP  11 -22.006  11.200 -21.378
   26    HA   ASP  11           HA       ASP  11 -23.649  12.239 -20.044
   27   1HB   ASP  11          1HB       ASP  11 -24.935  10.374 -21.852
   28   2HB   ASP  11          2HB       ASP  11 -25.841  10.483 -20.342
   29    H    ASN  12           H        ASN  12 -24.889   8.941 -19.638
   30    HA   ASN  12           HA       ASN  12 -23.763   8.841 -16.878
   31   1HB   ASN  12          1HB       ASN  12 -26.068   8.316 -16.050
   32   2HB   ASN  12          2HB       ASN  12 -25.946   9.940 -16.729
   33   2HD2  ASN  12          2HD2      ASN  12 -27.408   6.778 -17.156
   34   1HD2  ASN  12          1HD2      ASN  12 -28.348   7.183 -18.510
   35    H    VAL  13           H        VAL  13 -23.383   7.326 -19.475
   36    HA   VAL  13           HA       VAL  13 -24.578   4.690 -18.943
   37    HB   VAL  13           HB       VAL  13 -23.015   6.070 -21.086
   38   1HG1  VAL  13          1HG1      VAL  13 -22.893   3.110 -20.554
   39   2HG1  VAL  13          2HG1      VAL  13 -22.912   3.700 -22.216
   40   3HG1  VAL  13          3HG1      VAL  13 -21.618   4.190 -21.121
   41   1HG2  VAL  13          1HG2      VAL  13 -25.519   4.436 -20.811
   42   2HG2  VAL  13          2HG2      VAL  13 -25.319   6.064 -21.457
   43   3HG2  VAL  13          3HG2      VAL  13 -24.789   4.671 -22.399
   44    HA   PRO  14           HA       PRO  14 -20.060   3.670 -17.949
   45   1HB   PRO  14          1HB       PRO  14 -18.198   5.672 -17.870
   46   2HB   PRO  14          2HB       PRO  14 -18.605   4.785 -19.350
   47   1HG   PRO  14          1HG       PRO  14 -19.316   7.524 -18.553
   48   2HG   PRO  14          2HG       PRO  14 -19.172   6.813 -20.162
   49   1HD   PRO  14          1HD       PRO  14 -21.560   7.334 -18.750
   50   2HD   PRO  14          2HD       PRO  14 -21.380   6.430 -20.262
   51    H    MET  15           H        MET  15 -19.697   7.015 -16.759
   52    HA   MET  15           HA       MET  15 -20.880   6.564 -14.181
   53   1HB   MET  15          1HB       MET  15 -18.357   5.353 -14.659
   54   2HB   MET  15          2HB       MET  15 -18.063   6.716 -13.579
   55   1HG   MET  15          1HG       MET  15 -19.280   5.798 -11.866
   56   2HG   MET  15          2HG       MET  15 -20.427   5.024 -12.958
   57   1HE   MET  15          1HE       MET  15 -19.584   3.787 -10.490
   58   2HE   MET  15          2HE       MET  15 -20.380   2.641 -11.567
   59   3HE   MET  15          3HE       MET  15 -18.876   2.190 -10.767
   60    H    ASP  16           H        ASP  16 -21.383   8.630 -13.582
   61    HA   ASP  16           HA       ASP  16 -19.727  10.882 -14.602
   62   1HB   ASP  16          1HB       ASP  16 -22.193  10.804 -14.932
   63   2HB   ASP  16          2HB       ASP  16 -22.409  10.788 -13.181
   64    H    MET  17           H        MET  17 -18.750   9.185 -12.380
   65    HA   MET  17           HA       MET  17 -19.163  10.338  -9.813
   66   1HB   MET  17          1HB       MET  17 -16.987   9.237  -9.325
   67   2HB   MET  17          2HB       MET  17 -18.046   8.190 -10.270
   68   1HG   MET  17          1HG       MET  17 -16.812   9.383 -12.308
   69   2HG   MET  17          2HG       MET  17 -15.547   9.605 -11.099
   70   1HE   MET  17          1HE       MET  17 -15.832   7.300  -9.196
   71   2HE   MET  17          2HE       MET  17 -14.779   6.056  -9.867
   72   3HE   MET  17          3HE       MET  17 -14.277   7.752  -9.890
   73    H    SER  18           H        SER  18 -17.064  11.311 -12.491
   74    HA   SER  18           HA       SER  18 -16.477  13.843 -11.022
   75   1HB   SER  18          1HB       SER  18 -14.089  13.526 -11.924
   76   2HB   SER  18          2HB       SER  18 -14.570  12.480 -10.592
   77    HG   SER  18           HG       SER  18 -14.237  10.864 -11.877
   78    HA   PRO  19           HA       PRO  19 -17.500  15.398 -15.043
   79   1HB   PRO  19          1HB       PRO  19 -16.714  17.993 -14.693
   80   2HB   PRO  19          2HB       PRO  19 -18.198  17.326 -13.985
   81   1HG   PRO  19          2HG       PRO  19 -15.573  17.863 -12.715
   82   2HG   PRO  19          1HG       PRO  19 -17.202  18.020 -12.046
   83   1HD   PRO  19          1HD       PRO  19 -15.503  15.924 -11.520
   84   2HD   PRO  19          2HD       PRO  19 -17.271  15.845 -11.379
   85    H    LYS  20           H        LYS  20 -15.354  13.927 -15.447
   86    HA   LYS  20           HA       LYS  20 -13.423  13.687 -16.772
   87   1HB   LYS  20          1HB       LYS  20 -13.705  16.561 -17.615
   88   2HB   LYS  20          2HB       LYS  20 -13.246  15.164 -18.576
   89   1HG   LYS  20          2HG       LYS  20 -15.371  15.159 -19.332
   90   2HG   LYS  20          1HG       LYS  20 -15.829  14.548 -17.742
   91   1HD   LYS  20          1HD       LYS  20 -16.874  16.475 -17.241
   92   2HD   LYS  20          2HD       LYS  20 -15.426  17.407 -17.625
   93   1HE   LYS  20          1HE       LYS  20 -16.071  17.738 -19.859
   94   2HE   LYS  20          2HE       LYS  20 -17.153  16.330 -19.855
   95   1HZ   LYS  20          1HZ       LYS  20 -18.478  17.498 -18.126
   96   2HZ   LYS  20          2HZ       LYS  20 -17.530  18.884 -18.387
   97   3HZ   LYS  20          3HZ       LYS  20 -18.499  18.272 -19.638
   98    H    ALA  21           H        ALA  21 -13.212  17.157 -15.885
   99    HA   ALA  21           HA       ALA  21 -10.478  17.390 -15.493
  100   1HB   ALA  21          1HB       ALA  21 -12.188  19.182 -15.328
  101   2HB   ALA  21          3HB       ALA  21 -12.692  18.539 -13.764
  102   3HB   ALA  21          2HB       ALA  21 -11.078  19.222 -13.959
  103    H    LEU  22           H        LEU  22 -12.821  16.335 -13.005
  104    HA   LEU  22           HA       LEU  22 -10.696  15.692 -11.086
  105   1HB   LEU  22          1HB       LEU  22 -13.697  15.294 -11.234
  106   2HB   LEU  22          2HB       LEU  22 -12.740  14.751  -9.858
  107    HG   LEU  22           HG       LEU  22 -11.851  17.143  -9.709
  108   1HD1  LEU  22          1HD1      LEU  22 -13.929  17.382 -11.848
  109   2HD1  LEU  22          2HD1      LEU  22 -13.737  18.720 -10.715
  110   3HD1  LEU  22          3HD1      LEU  22 -12.374  18.201 -11.707
  111   1HD2  LEU  22          1HD2      LEU  22 -13.856  15.987  -8.418
  112   2HD2  LEU  22          2HD2      LEU  22 -13.567  17.718  -8.243
  113   3HD2  LEU  22          3HD2      LEU  22 -14.829  17.140  -9.332
  114    H    GLN  23           H        GLN  23 -12.684  14.049 -13.471
  115    HA   GLN  23           HA       GLN  23 -12.337  11.341 -12.698
  116   1HB   GLN  23          1HB       GLN  23 -13.736  12.469 -14.561
  117   2HB   GLN  23          2HB       GLN  23 -12.276  12.353 -15.545
  118   1HG   GLN  23          1HG       GLN  23 -12.219   9.879 -14.976
  119   2HG   GLN  23          2HG       GLN  23 -13.828  10.082 -14.280
  120   2HE2  GLN  23          2HE2      GLN  23 -15.619  10.432 -15.738
  121   1HE2  GLN  23          1HE2      GLN  23 -15.457  10.281 -17.420
  122    H    GLN  24           H        GLN  24 -10.271  13.367 -14.809
  123    HA   GLN  24           HA       GLN  24  -8.280  11.287 -15.208
  124   1HB   GLN  24          1HB       GLN  24  -8.959  13.509 -16.512
  125   2HB   GLN  24          2HB       GLN  24  -7.711  14.217 -15.485
  126   1HG   GLN  24          1HG       GLN  24  -6.693  11.751 -16.486
  127   2HG   GLN  24          2HG       GLN  24  -7.374  12.636 -17.851
  128   2HE2  GLN  24          2HE2      GLN  24  -4.504  12.239 -16.288
  129   1HE2  GLN  24          1HE2      GLN  24  -3.818  13.772 -16.531
  130    H    LYS  25           H        LYS  25  -8.579  14.100 -13.043
  131    HA   LYS  25           HA       LYS  25  -5.958  13.953 -11.891
  132   1HB   LYS  25          1HB       LYS  25  -8.536  15.282 -11.474
  133   2HB   LYS  25          2HB       LYS  25  -7.683  14.974  -9.961
  134   1HG   LYS  25          1HG       LYS  25  -6.693  16.978 -10.520
  135   2HG   LYS  25          2HG       LYS  25  -5.613  15.889 -11.392
  136   1HD   LYS  25          1HD       LYS  25  -7.565  16.205 -13.250
  137   2HD   LYS  25          2HD       LYS  25  -7.651  17.771 -12.441
  138   1HE   LYS  25          1HE       LYS  25  -4.883  17.142 -12.801
  139   2HE   LYS  25          2HE       LYS  25  -5.709  16.904 -14.353
  140   1HZ   LYS  25          1HZ       LYS  25  -6.056  19.278 -12.599
  141   2HZ   LYS  25          2HZ       LYS  25  -5.068  19.239 -13.980
  142   3HZ   LYS  25          3HZ       LYS  25  -6.750  19.046 -14.130
  143    H    ILE  26           H        ILE  26  -9.097  12.646 -10.758
  144    HA   ILE  26           HA       ILE  26  -8.087  11.355  -8.413
  145    HB   ILE  26           HB       ILE  26 -10.437  10.721 -10.230
  146   1HG1  ILE  26          1HG1      ILE  26 -10.435  12.292  -7.646
  147   2HG1  ILE  26          2HG1      ILE  26 -10.205  13.071  -9.212
  148   1HG2  ILE  26          1HG2      ILE  26  -9.471   9.130  -8.229
  149   2HG2  ILE  26          2HG2      ILE  26 -10.581  10.165  -7.330
  150   3HG2  ILE  26          3HG2      ILE  26 -11.171   9.210  -8.691
  151   1HD1  ILE  26          1HD1      ILE  26 -12.557  11.269  -8.587
  152   2HD1  ILE  26          2HD1      ILE  26 -12.604  13.022  -8.397
  153   3HD1  ILE  26          3HD1      ILE  26 -12.351  12.315  -9.992
  154    H    HIS  27           H        HIS  27  -8.656  10.107 -11.720
  155    HA   HIS  27           HA       HIS  27  -7.759   7.426 -11.178
  156   1HB   HIS  27          1HB       HIS  27  -9.172   8.343 -13.099
  157   2HB   HIS  27          2HB       HIS  27  -7.668   8.942 -13.800
  158    HD1  HIS  27           HD1      HIS  27  -5.726   6.948 -13.994
  159    HD2  HIS  27           HD2      HIS  27  -9.716   5.749 -13.865
  160    HE1  HIS  27           HE1      HIS  27  -5.793   4.583 -14.899
  161    H    GLU  28           H        GLU  28  -6.074  10.417 -11.783
  162    HA   GLU  28           HA       GLU  28  -3.586   9.268 -12.736
  163   1HB   GLU  28          1HB       GLU  28  -4.725  11.864 -11.927
  164   2HB   GLU  28          2HB       GLU  28  -2.995  11.714 -11.613
  165   1HG   GLU  28          1HG       GLU  28  -3.746  10.645 -14.229
  166   2HG   GLU  28          2HG       GLU  28  -4.149  12.355 -14.060
  167    H    LEU  29           H        LEU  29  -4.666  10.492  -9.545
  168    HA   LEU  29           HA       LEU  29  -2.213   9.774  -8.184
  169   1HB   LEU  29          1HB       LEU  29  -5.029  10.529  -7.396
  170   2HB   LEU  29          2HB       LEU  29  -3.822  10.119  -6.177
  171    HG   LEU  29           HG       LEU  29  -3.342  12.201  -8.319
  172   1HD1  LEU  29          1HD1      LEU  29  -5.304  12.587  -6.603
  173   2HD1  LEU  29          2HD1      LEU  29  -3.987  12.882  -5.467
  174   3HD1  LEU  29          3HD1      LEU  29  -4.143  13.880  -6.913
  175   1HD2  LEU  29          1HD2      LEU  29  -1.564  10.916  -6.720
  176   2HD2  LEU  29          2HD2      LEU  29  -1.347  12.583  -7.255
  177   3HD2  LEU  29          3HD2      LEU  29  -2.020  12.249  -5.660
  178    H    GLU  30           H        GLU  30  -5.405   8.215  -8.526
  179    HA   GLU  30           HA       GLU  30  -5.071   6.051  -6.746
  180   1HB   GLU  30          1HB       GLU  30  -7.022   6.899  -8.315
  181   2HB   GLU  30          2HB       GLU  30  -6.359   5.710  -9.437
  182   1HG   GLU  30          1HG       GLU  30  -6.471   4.036  -7.507
  183   2HG   GLU  30          2HG       GLU  30  -7.454   5.231  -6.661
  184    H    GLY  31           H        GLY  31  -4.188   6.234 -10.214
  185   1HA   GLY  31          2HA       GLY  31  -2.639   4.977 -11.450
  186   2HA   GLY  31          1HA       GLY  31  -3.128   3.611 -10.445
  187    H    LEU  32           H        LEU  32  -1.836   6.471  -8.935
  188    HA   LEU  32           HA       LEU  32   0.947   5.681  -8.921
  189   1HB   LEU  32          1HB       LEU  32  -0.353   7.952  -8.471
  190   2HB   LEU  32          2HB       LEU  32  -0.320   7.383  -6.802
  191    HG   LEU  32           HG       LEU  32   2.162   7.060  -7.028
  192   1HD1  LEU  32          1HD1      LEU  32   1.479   7.906  -9.774
  193   2HD1  LEU  32          2HD1      LEU  32   2.884   8.718  -9.085
  194   3HD1  LEU  32          3HD1      LEU  32   2.850   6.959  -9.196
  195   1HD2  LEU  32          1HD2      LEU  32   0.733   9.666  -7.160
  196   2HD2  LEU  32          2HD2      LEU  32   1.814   9.038  -5.916
  197   3HD2  LEU  32          3HD2      LEU  32   2.479   9.721  -7.400
  198    H    MET  33           H        MET  33  -1.791   5.157  -6.719
  199    HA   MET  33           HA       MET  33  -0.330   4.078  -4.507
  200   1HB   MET  33          1HB       MET  33  -3.097   4.202  -5.541
  201   2HB   MET  33          2HB       MET  33  -2.776   2.838  -4.470
  202   1HG   MET  33          1HG       MET  33  -2.301   4.200  -2.650
  203   2HG   MET  33          2HG       MET  33  -1.796   5.551  -3.664
  204   1HE   MET  33          1HE       MET  33  -4.552   3.121  -3.751
  205   2HE   MET  33          2HE       MET  33  -5.194   3.670  -2.207
  206   3HE   MET  33          3HE       MET  33  -6.068   4.018  -3.705
  207    H    MET  34           H        MET  34  -2.035   2.399  -7.181
  208    HA   MET  34           HA       MET  34  -1.469  -0.260  -6.538
  209   1HB   MET  34          2HB       MET  34  -1.417   1.078  -9.262
  210   2HB   MET  34          1HB       MET  34  -1.728  -0.632  -8.958
  211   1HG   MET  34          1HG       MET  34  -3.532   0.628  -7.280
  212   2HG   MET  34          2HG       MET  34  -3.535   1.664  -8.707
  213   1HE   MET  34          1HE       MET  34  -3.866  -1.451  -7.046
  214   2HE   MET  34          2HE       MET  34  -5.183  -2.309  -7.843
  215   3HE   MET  34          3HE       MET  34  -3.519  -2.618  -8.329
  216    H    GLN  35           H        GLN  35   0.582   1.898  -8.544
  217    HA   GLN  35           HA       GLN  35   2.705   0.181  -9.123
  218   1HB   GLN  35          1HB       GLN  35   2.508   2.440  -9.986
  219   2HB   GLN  35          2HB       GLN  35   2.659   3.118  -8.365
  220   1HG   GLN  35          2HG       GLN  35   4.893   3.179  -8.619
  221   2HG   GLN  35          1HG       GLN  35   4.907   1.422  -8.778
  222   2HE2  GLN  35          2HE2      GLN  35   4.026   4.268 -10.832
  223   1HE2  GLN  35          1HE2      GLN  35   4.741   3.649 -12.242
  224    H    HIS  36           H        HIS  36   3.212   2.608  -6.579
  225    HA   HIS  36           HA       HIS  36   5.271   1.313  -5.202
  226   1HB   HIS  36          1HB       HIS  36   3.018   3.076  -4.200
  227   2HB   HIS  36          2HB       HIS  36   4.508   2.770  -3.312
  228    HD1  HIS  36           HD1      HIS  36   6.651   3.035  -5.379
  229    HD2  HIS  36           HD2      HIS  36   3.353   5.584  -5.310
  230    HE1  HIS  36           HE1      HIS  36   7.336   5.126  -6.632
  231    H    ALA  37           H        ALA  37   1.793   1.213  -4.311
  232    HA   ALA  37           HA       ALA  37   1.826  -0.538  -2.151
  233   1HB   ALA  37          1HB       ALA  37  -0.465  -1.066  -2.858
  234   2HB   ALA  37          3HB       ALA  37  -0.130   0.635  -3.177
  235   3HB   ALA  37          2HB       ALA  37  -0.104  -0.532  -4.499
  236    H    GLN  38           H        GLN  38   2.187  -1.334  -5.590
  237    HA   GLN  38           HA       GLN  38   2.104  -4.232  -5.151
  238   1HB   GLN  38          1HB       GLN  38   2.452  -2.283  -7.375
  239   2HB   GLN  38          2HB       GLN  38   3.170  -3.875  -7.619
  240   1HG   GLN  38          1HG       GLN  38   1.096  -4.979  -7.412
  241   2HG   GLN  38          2HG       GLN  38   0.336  -3.592  -6.632
  242   2HE2  GLN  38          2HE2      GLN  38   2.249  -3.891  -9.683
  243   1HE2  GLN  38          1HE2      GLN  38   1.069  -3.165 -10.663
  244    H    ASN  39           H        ASN  39   4.558  -1.708  -5.486
  245    HA   ASN  39           HA       ASN  39   6.756  -3.703  -5.343
  246   1HB   ASN  39          1HB       ASN  39   6.506  -0.729  -5.830
  247   2HB   ASN  39          2HB       ASN  39   8.078  -1.485  -5.568
  248   2HD2  ASN  39          2HD2      ASN  39   8.084  -0.504  -8.000
  249   1HD2  ASN  39          1HD2      ASN  39   7.695  -1.637  -9.203
  250    H    LEU  40           H        LEU  40   4.835  -2.998  -3.070
  251    HA   LEU  40           HA       LEU  40   4.958  -2.654  -0.750
  252   1HB   LEU  40          1HB       LEU  40   7.703  -3.574  -1.591
  253   2HB   LEU  40          2HB       LEU  40   7.373  -3.196   0.100
  254    HG   LEU  40           HG       LEU  40   5.205  -4.732  -0.506
  255   1HD1  LEU  40          1HD1      LEU  40   6.937  -5.103  -2.686
  256   2HD1  LEU  40          2HD1      LEU  40   7.157  -6.534  -1.678
  257   3HD1  LEU  40          3HD1      LEU  40   5.549  -6.105  -2.261
  258   1HD2  LEU  40          1HD2      LEU  40   7.274  -4.844   1.235
  259   2HD2  LEU  40          2HD2      LEU  40   6.110  -6.155   1.050
  260   3HD2  LEU  40          3HD2      LEU  40   7.666  -6.235   0.224
  261    H    GLU  41           H        GLU  41   5.166  -0.287  -2.364
  262    HA   GLU  41           HA       GLU  41   7.040   1.370  -0.701
  263   1HB   GLU  41          1HB       GLU  41   6.402   1.205  -3.593
  264   2HB   GLU  41          2HB       GLU  41   6.546   2.841  -2.949
  265   1HG   GLU  41          1HG       GLU  41   8.624   0.729  -2.370
  266   2HG   GLU  41          2HG       GLU  41   8.705   1.732  -3.818
  267    H    PHE  42           H        PHE  42   4.003   0.551  -0.579
  268    HA   PHE  42           HA       PHE  42   2.371   2.807  -1.032
  269   1HB   PHE  42          1HB       PHE  42   0.899   1.650   0.657
  270   2HB   PHE  42          2HB       PHE  42   1.472   0.611  -0.643
  271    HD1  PHE  42           HD1      PHE  42   2.529   1.752   2.798
  272    HD2  PHE  42           HD2      PHE  42   2.392  -1.471  -0.077
  273    HE1  PHE  42           HE1      PHE  42   3.533   0.210   4.471
  274    HE2  PHE  42           HE2      PHE  42   3.384  -3.004   1.597
  275    HZ   PHE  42           HZ       PHE  42   3.955  -2.167   3.873
  276    H    GLU  43           H        GLU  43   4.877   2.508   1.318
  277    HA   GLU  43           HA       GLU  43   3.884   3.832   3.587
  278   1HB   GLU  43          1HB       GLU  43   6.154   2.939   3.379
  279   2HB   GLU  43          2HB       GLU  43   6.531   4.119   2.122
  280   1HG   GLU  43          1HG       GLU  43   5.954   5.920   3.853
  281   2HG   GLU  43          2HG       GLU  43   6.008   4.630   5.054
  282    H    GLU  44           H        GLU  44   5.631   5.489   0.953
  283    HA   GLU  44           HA       GLU  44   4.380   8.066   1.615
  284   1HB   GLU  44          2HB       GLU  44   5.854   8.842  -0.216
  285   2HB   GLU  44          1HB       GLU  44   6.745   7.814   0.908
  286   1HG   GLU  44          1HG       GLU  44   7.345   6.582  -0.886
  287   2HG   GLU  44          2HG       GLU  44   5.675   6.016  -0.933
  288    H    ALA  45           H        ALA  45   3.755   5.393  -0.501
  289    HA   ALA  45           HA       ALA  45   2.255   6.873  -2.523
  290   1HB   ALA  45          1HB       ALA  45   1.623   4.136  -2.590
  291   2HB   ALA  45          3HB       ALA  45   3.273   4.207  -1.971
  292   3HB   ALA  45          2HB       ALA  45   2.879   4.947  -3.524
  293    H    ALA  46           H        ALA  46   1.340   4.679   0.153
  294    HA   ALA  46           HA       ALA  46  -1.423   4.573  -0.282
  295   1HB   ALA  46          1HB       ALA  46   0.296   4.516   2.195
  296   2HB   ALA  46          3HB       ALA  46  -0.424   3.156   1.328
  297   3HB   ALA  46          2HB       ALA  46  -1.444   4.244   2.269
  298    H    GLN  47           H        GLN  47   0.403   7.146   1.429
  299    HA   GLN  47           HA       GLN  47  -1.744   8.559   2.570
  300   1HB   GLN  47          1HB       GLN  47  -0.267  10.560   2.220
  301   2HB   GLN  47          2HB       GLN  47   0.590   9.172   2.895
  302   1HG   GLN  47          2HG       GLN  47   2.023   9.256   1.171
  303   2HG   GLN  47          1HG       GLN  47   0.689   8.910   0.070
  304   2HE2  GLN  47          2HE2      GLN  47  -0.595  10.885  -0.683
  305   1HE2  GLN  47          1HE2      GLN  47   0.227  12.361  -0.840
  306    H    ILE  48           H        ILE  48  -0.898   8.186  -0.799
  307    HA   ILE  48           HA       ILE  48  -2.204  10.405  -1.976
  308    HB   ILE  48           HB       ILE  48  -1.931   7.503  -2.835
  309   1HG1  ILE  48          1HG1      ILE  48   0.197   8.681  -2.397
  310   2HG1  ILE  48          2HG1      ILE  48  -0.005   8.370  -4.122
  311   1HG2  ILE  48          1HG2      ILE  48  -2.910   9.957  -4.276
  312   2HG2  ILE  48          2HG2      ILE  48  -2.092   8.675  -5.168
  313   3HG2  ILE  48          3HG2      ILE  48  -3.579   8.325  -4.286
  314   1HD1  ILE  48          1HD1      ILE  48  -1.248  10.830  -3.758
  315   2HD1  ILE  48          2HD1      ILE  48   0.165  10.921  -2.706
  316   3HD1  ILE  48          3HD1      ILE  48   0.365  10.579  -4.424
  317    H    ARG  49           H        ARG  49  -3.490   7.434  -0.570
  318    HA   ARG  49           HA       ARG  49  -6.119   7.403  -1.585
  319   1HB   ARG  49          2HB       ARG  49  -6.647   6.248   0.527
  320   2HB   ARG  49          1HB       ARG  49  -5.071   5.730  -0.066
  321   1HG   ARG  49          2HG       ARG  49  -4.459   6.184   2.098
  322   2HG   ARG  49          1HG       ARG  49  -4.286   7.813   1.448
  323   1HD   ARG  49          1HD       ARG  49  -6.895   7.932   2.049
  324   2HD   ARG  49          2HD       ARG  49  -6.407   6.711   3.240
  325    HE   ARG  49           HE       ARG  49  -4.721   9.142   3.020
  326   1HH1  ARG  49          1HH1      ARG  49  -7.639   8.182   4.405
  327   2HH1  ARG  49          2HH1      ARG  49  -7.204   8.600   6.028
  328   1HH2  ARG  49          1HH2      ARG  49  -3.898   9.295   5.243
  329   2HH2  ARG  49          2HH2      ARG  49  -5.086   9.231   6.502
  330    H    ASP  50           H        ASP  50  -4.621   9.574   0.734
  331    HA   ASP  50           HA       ASP  50  -7.036  10.758   1.785
  332   1HB   ASP  50          1HB       ASP  50  -4.271  10.883   2.183
  333   2HB   ASP  50          2HB       ASP  50  -4.686  12.493   1.595
  334    H    GLN  51           H        GLN  51  -4.804  11.626  -0.868
  335    HA   GLN  51           HA       GLN  51  -6.248  13.986  -1.703
  336   1HB   GLN  51          1HB       GLN  51  -4.338  12.077  -3.091
  337   2HB   GLN  51          2HB       GLN  51  -4.853  13.619  -3.776
  338   1HG   GLN  51          1HG       GLN  51  -3.973  14.767  -1.736
  339   2HG   GLN  51          2HG       GLN  51  -3.355  13.215  -1.171
  340   2HE2  GLN  51          2HE2      GLN  51  -3.353  14.640  -4.482
  341   1HE2  GLN  51          1HE2      GLN  51  -1.670  14.548  -4.680
  342    H    LEU  52           H        LEU  52  -6.507  10.547  -2.434
  343    HA   LEU  52           HA       LEU  52  -8.228  10.759  -4.738
  344   1HB   LEU  52          1HB       LEU  52  -7.150   8.752  -2.889
  345   2HB   LEU  52          2HB       LEU  52  -8.774   8.352  -3.448
  346    HG   LEU  52           HG       LEU  52  -7.044   7.430  -4.961
  347   1HD1  LEU  52          1HD1      LEU  52  -9.331   8.375  -5.736
  348   2HD1  LEU  52          2HD1      LEU  52  -8.397   9.724  -6.382
  349   3HD1  LEU  52          3HD1      LEU  52  -8.105   8.087  -6.969
  350   1HD2  LEU  52          1HD2      LEU  52  -5.601   9.631  -4.423
  351   2HD2  LEU  52          2HD2      LEU  52  -5.375   8.707  -5.908
  352   3HD2  LEU  52          3HD2      LEU  52  -6.357  10.172  -5.922
  353    H    HIS  53           H        HIS  53  -8.862  10.335  -1.250
  354    HA   HIS  53           HA       HIS  53 -11.764  10.311  -1.586
  355   1HB   HIS  53          1HB       HIS  53 -10.261   9.237   0.227
  356   2HB   HIS  53          2HB       HIS  53 -10.190  10.849   0.938
  357    HD1  HIS  53           HD1      HIS  53 -12.974  11.885   0.711
  358    HD2  HIS  53           HD2      HIS  53 -12.211   7.896   1.647
  359    HE1  HIS  53           HE1      HIS  53 -15.052  11.010   1.863
  360    H    GLN  54           H        GLN  54  -9.296  12.708  -0.721
  361    HA   GLN  54           HA       GLN  54 -11.064  14.790   0.155
  362   1HB   GLN  54          1HB       GLN  54  -8.645  14.733   0.571
  363   2HB   GLN  54          2HB       GLN  54  -8.328  14.844  -1.161
  364   1HG   GLN  54          1HG       GLN  54  -9.618  17.032  -1.143
  365   2HG   GLN  54          2HG       GLN  54  -9.590  16.941   0.618
  366   2HE2  GLN  54          2HE2      GLN  54  -7.797  17.964  -2.118
  367   1HE2  GLN  54          1HE2      GLN  54  -6.317  18.241  -1.333
  368    H    LEU  55           H        LEU  55  -9.735  13.976  -3.055
  369    HA   LEU  55           HA       LEU  55 -10.801  16.234  -4.461
  370   1HB   LEU  55          1HB       LEU  55  -9.590  13.604  -4.998
  371   2HB   LEU  55          2HB       LEU  55 -10.684  14.151  -6.269
  372    HG   LEU  55           HG       LEU  55  -9.432  16.414  -6.086
  373   1HD1  LEU  55          1HD1      LEU  55  -8.270  15.632  -3.940
  374   2HD1  LEU  55          2HD1      LEU  55  -7.266  14.618  -4.976
  375   3HD1  LEU  55          3HD1      LEU  55  -7.234  16.372  -5.161
  376   1HD2  LEU  55          1HD2      LEU  55  -9.242  14.468  -7.853
  377   2HD2  LEU  55          2HD2      LEU  55  -8.040  15.759  -7.846
  378   3HD2  LEU  55          3HD2      LEU  55  -7.668  14.203  -7.103
  379    H    ARG  56           H        ARG  56 -12.295  13.353  -3.218
  380    HA   ARG  56           HA       ARG  56 -14.486  12.991  -4.968
  381   1HB   ARG  56          1HB       ARG  56 -13.734  11.584  -3.011
  382   2HB   ARG  56          2HB       ARG  56 -14.466  12.782  -1.942
  383   1HG   ARG  56          1HG       ARG  56 -16.560  12.383  -3.557
  384   2HG   ARG  56          2HG       ARG  56 -15.776  10.816  -3.766
  385   1HD   ARG  56          1HD       ARG  56 -15.626  11.187  -1.027
  386   2HD   ARG  56          2HD       ARG  56 -17.214  11.870  -1.431
  387    HE   ARG  56           HE       ARG  56 -17.232   9.581  -2.902
  388   1HH1  ARG  56          1HH1      ARG  56 -15.089   8.654  -0.905
  389   2HH1  ARG  56          2HH1      ARG  56 -16.065   7.791   0.237
  390   1HH2  ARG  56          1HH2      ARG  56 -19.050   9.152  -0.886
  391   2HH2  ARG  56          2HH2      ARG  56 -18.308   8.073   0.247
  392    H    GLU  57           H        GLU  57 -14.530  14.856  -1.894
  393    HA   GLU  57           HA       GLU  57 -17.082  16.049  -2.308
  394   1HB   GLU  57          1HB       GLU  57 -16.338  17.561  -0.520
  395   2HB   GLU  57          2HB       GLU  57 -15.797  15.918  -0.176
  396   1HG   GLU  57          1HG       GLU  57 -13.731  16.969  -1.710
  397   2HG   GLU  57          2HG       GLU  57 -14.213  18.321  -0.687
  398    H    LEU  58           H        LEU  58 -13.947  16.820  -3.637
  399    HA   LEU  58           HA       LEU  58 -14.297  19.559  -4.314
  400   1HB   LEU  58          1HB       LEU  58 -12.351  17.712  -4.547
  401   2HB   LEU  58          2HB       LEU  58 -12.937  17.701  -6.211
  402    HG   LEU  58           HG       LEU  58 -12.609  20.394  -5.054
  403   1HD1  LEU  58          1HD1      LEU  58 -10.623  18.684  -4.336
  404   2HD1  LEU  58          2HD1      LEU  58 -10.045  19.186  -5.926
  405   3HD1  LEU  58          3HD1      LEU  58 -10.354  20.394  -4.678
  406   1HD2  LEU  58          1HD2      LEU  58 -12.172  18.931  -7.624
  407   2HD2  LEU  58          2HD2      LEU  58 -13.001  20.460  -7.331
  408   3HD2  LEU  58          3HD2      LEU  58 -11.239  20.403  -7.353
  409    H    PHE  59           H        PHE  59 -15.810  16.704  -5.599
  410    HA   PHE  59           HA       PHE  59 -16.427  17.377  -8.247
  411   1HB   PHE  59          1HB       PHE  59 -16.992  15.266  -7.115
  412   2HB   PHE  59          2HB       PHE  59 -18.165  16.110  -6.104
  413    HD1  PHE  59           HD1      PHE  59 -20.178  17.214  -7.175
  414    HD2  PHE  59           HD2      PHE  59 -17.529  14.590  -9.351
  415    HE1  PHE  59           HE1      PHE  59 -21.911  16.934  -8.945
  416    HE2  PHE  59           HE2      PHE  59 -19.262  14.309 -11.122
  417    HZ   PHE  59           HZ       PHE  59 -21.452  15.481 -10.918
  418    H    ILE  60           H        ILE  60 -18.200  18.358  -5.293
  419    HA   ILE  60           HA       ILE  60 -20.249  19.865  -6.579
  420    HB   ILE  60           HB       ILE  60 -18.883  20.170  -3.884
  421   1HG1  ILE  60          1HG1      ILE  60 -21.564  18.964  -4.081
  422   2HG1  ILE  60          2HG1      ILE  60 -20.299  18.026  -4.877
  423   1HG2  ILE  60          1HG2      ILE  60 -21.075  21.629  -5.184
  424   2HG2  ILE  60          2HG2      ILE  60 -21.519  20.956  -3.616
  425   3HG2  ILE  60          3HG2      ILE  60 -20.142  22.050  -3.747
  426   1HD1  ILE  60          1HD1      ILE  60 -19.870  19.121  -2.105
  427   2HD1  ILE  60          2HD1      ILE  60 -20.740  17.605  -2.344
  428   3HD1  ILE  60          3HD1      ILE  60 -19.070  17.760  -2.892
  429    H    ALA  61           H        ALA  61 -16.999  20.810  -5.455
  430    HA   ALA  61           HA       ALA  61 -17.245  23.618  -5.994
  431   1HB   ALA  61          1HB       ALA  61 -15.448  21.950  -4.811
  432   2HB   ALA  61          3HB       ALA  61 -14.621  22.274  -6.334
  433   3HB   ALA  61          2HB       ALA  61 -15.068  23.609  -5.272
  434    H    ALA  62           H        ALA  62 -16.754  20.863  -8.069
  435    HA   ALA  62           HA       ALA  62 -15.808  22.562 -10.321
  436   1HB   ALA  62          1HB       ALA  62 -15.410  19.912  -9.412
  437   2HB   ALA  62          3HB       ALA  62 -14.755  20.642 -10.877
  438   3HB   ALA  62          2HB       ALA  62 -16.292  19.777 -10.934
  439    H    SER  63           H        SER  63 -18.247  19.948 -10.006
  440    HA   SER  63           HA       SER  63 -19.775  20.654 -12.287
  441   1HB   SER  63          1HB       SER  63 -19.754  18.654 -10.486
  442   2HB   SER  63          2HB       SER  63 -21.125  19.564  -9.858
  443    HG   SER  63           HG       SER  63 -22.217  19.201 -11.678
  444    H    LEU   8           H        LEU   8  19.310 -28.631  -2.394
  445    HA   LEU   8           HA       LEU   8  19.413 -30.369  -0.055
  446   1HB   LEU   8          1HB       LEU   8  20.254 -30.428  -2.679
  447   2HB   LEU   8          2HB       LEU   8  21.770 -30.166  -1.815
  448    HG   LEU   8           HG       LEU   8  19.928 -32.213  -0.686
  449   1HD1  LEU   8          1HD1      LEU   8  20.876 -32.272  -3.444
  450   2HD1  LEU   8          2HD1      LEU   8  21.491 -33.638  -2.511
  451   3HD1  LEU   8          3HD1      LEU   8  19.753 -33.359  -2.625
  452   1HD2  LEU   8          1HD2      LEU   8  22.917 -31.921  -1.108
  453   2HD2  LEU   8          2HD2      LEU   8  22.035 -31.810   0.415
  454   3HD2  LEU   8          3HD2      LEU   8  22.174 -33.361  -0.411
  455    H    GLU   9           H        GLU   9  19.923 -29.222   1.835
  456    HA   GLU   9           HA       GLU   9  21.249 -27.988   3.355
  457   1HB   GLU   9          1HB       GLU   9  22.757 -29.855   1.974
  458   2HB   GLU   9          2HB       GLU   9  23.696 -28.375   1.772
  459   1HG   GLU   9          1HG       GLU   9  23.105 -28.152   4.392
  460   2HG   GLU   9          2HG       GLU   9  23.088 -29.910   4.248
  461    HA   PRO  10           HA       PRO  10  21.333 -24.317   0.582
  462   1HB   PRO  10          1HB       PRO  10  20.029 -22.652   2.319
  463   2HB   PRO  10          2HB       PRO  10  19.181 -23.732   1.195
  464   1HG   PRO  10          2HG       PRO  10  19.698 -24.057   4.105
  465   2HG   PRO  10          1HG       PRO  10  18.271 -24.498   3.154
  466   1HD   PRO  10          1HD       PRO  10  20.168 -26.290   3.973
  467   2HD   PRO  10          2HD       PRO  10  19.144 -26.515   2.538
  468    H    ASP  11           H        ASP  11  21.643 -24.084   4.151
  469    HA   ASP  11           HA       ASP  11  23.333 -23.128   5.489
  470   1HB   ASP  11          1HB       ASP  11  24.545 -24.347   3.157
  471   2HB   ASP  11          2HB       ASP  11  25.486 -22.947   3.670
  472    H    ASN  12           H        ASN  12  24.525 -21.817   2.417
  473    HA   ASN  12           HA       ASN  12  23.456 -19.126   3.135
  474   1HB   ASN  12          1HB       ASN  12  25.768 -18.217   2.816
  475   2HB   ASN  12          2HB       ASN  12  25.660 -19.331   4.180
  476   2HD2  ASN  12          2HD2      ASN  12  27.058 -18.860   0.995
  477   1HD2  ASN  12          1HD2      ASN  12  27.975 -20.288   0.976
  478    H    VAL  13           H        VAL  13  22.993 -21.173   0.952
  479    HA   VAL  13           HA       VAL  13  24.152 -19.930  -1.451
  480    HB   VAL  13           HB       VAL  13  22.568 -22.351  -0.703
  481   1HG1  VAL  13          1HG1      VAL  13  22.405 -20.995  -3.384
  482   2HG1  VAL  13          2HG1      VAL  13  22.398 -22.757  -3.294
  483   3HG1  VAL  13          3HG1      VAL  13  21.137 -21.827  -2.482
  484   1HG2  VAL  13          1HG2      VAL  13  25.048 -21.662  -2.247
  485   2HG2  VAL  13          2HG2      VAL  13  24.862 -22.744  -0.867
  486   3HG2  VAL  13          3HG2      VAL  13  24.287 -23.239  -2.459
  487    HA   PRO  14           HA       PRO  14  19.640 -18.613  -2.039
  488   1HB   PRO  14          1HB       PRO  14  17.816 -19.080  -0.054
  489   2HB   PRO  14          2HB       PRO  14  18.174 -20.251  -1.336
  490   1HG   PRO  14          1HG       PRO  14  18.953 -20.282   1.500
  491   2HG   PRO  14          2HG       PRO  14  18.759 -21.618   0.362
  492   1HD   PRO  14          1HD       PRO  14  21.187 -20.453   1.207
  493   2HD   PRO  14          2HD       PRO  14  20.957 -21.641  -0.086
  494    H    MET  15           H        MET  15  19.362 -18.424   1.515
  495    HA   MET  15           HA       MET  15  20.593 -15.844   1.791
  496   1HB   MET  15          1HB       MET  15  18.039 -15.916   0.554
  497   2HB   MET  15          2HB       MET  15  17.793 -15.266   2.175
  498   1HG   MET  15          1HG       MET  15  19.030 -13.381   1.757
  499   2HG   MET  15          2HG       MET  15  20.140 -14.224   0.677
  500   1HE   MET  15          1HE       MET  15  19.330 -11.493   0.215
  501   2HE   MET  15          2HE       MET  15  20.081 -12.210  -1.208
  502   3HE   MET  15          3HE       MET  15  18.587 -11.291  -1.378
  503    H    ASP  16           H        ASP  16  21.146 -15.869   3.932
  504    HA   ASP  16           HA       ASP  16  19.507 -17.465   5.835
  505   1HB   ASP  16          1HB       ASP  16  21.964 -17.797   5.610
  506   2HB   ASP  16          2HB       ASP  16  22.218 -16.119   6.089
  507    H    MET  17           H        MET  17  18.551 -14.834   4.866
  508    HA   MET  17           HA       MET  17  19.040 -12.712   6.695
  509   1HB   MET  17          1HB       MET  17  16.857 -11.894   5.829
  510   2HB   MET  17          2HB       MET  17  17.875 -12.519   4.532
  511   1HG   MET  17          1HG       MET  17  16.617 -14.792   5.124
  512   2HG   MET  17          2HG       MET  17  15.383 -13.676   5.709
  513   1HE   MET  17          1HE       MET  17  15.669 -11.198   4.037
  514   2HE   MET  17          2HE       MET  17  14.580 -11.468   2.679
  515   3HE   MET  17          3HE       MET  17  14.108 -11.968   4.309
  516    H    SER  18           H        SER  18  16.901 -15.523   6.911
  517    HA   SER  18           HA       SER  18  16.391 -14.831   9.770
  518   1HB   SER  18          1HB       SER  18  13.977 -15.565   9.264
  519   2HB   SER  18          2HB       SER  18  14.470 -13.997   8.630
  520    HG   SER  18           HG       SER  18  14.079 -14.760   6.723
  521    HA   PRO  19           HA       PRO  19  17.352 -19.144  10.087
  522   1HB   PRO  19          1HB       PRO  19  16.619 -19.537  12.691
  523   2HB   PRO  19          2HB       PRO  19  18.106 -18.692  12.221
  524   1HG   PRO  19          2HG       PRO  19  15.518 -17.587  13.159
  525   2HG   PRO  19          1HG       PRO  19  17.164 -17.017  13.462
  526   1HD   PRO  19          1HD       PRO  19  15.441 -15.887  11.643
  527   2HD   PRO  19          2HD       PRO  19  17.212 -15.759  11.567
  528    H    LYS  20           H        LYS  20  15.171 -19.075   8.611
  529    HA   LYS  20           HA       LYS  20  13.208 -20.244   8.048
  530   1HB   LYS  20          1HB       LYS  20  13.522 -21.881  10.552
  531   2HB   LYS  20          2HB       LYS  20  13.018 -22.394   8.951
  532   1HG   LYS  20          2HG       LYS  20  15.126 -23.151   8.680
  533   2HG   LYS  20          1HG       LYS  20  15.608 -21.460   8.539
  534   1HD   LYS  20          1HD       LYS  20  16.698 -21.548  10.505
  535   2HD   LYS  20          2HD       LYS  20  15.257 -22.159  11.322
  536   1HE   LYS  20          1HE       LYS  20  15.859 -24.404  10.986
  537   2HE   LYS  20          2HE       LYS  20  16.915 -24.015   9.614
  538   1HZ   LYS  20          1HZ       LYS  20  18.297 -22.713  11.196
  539   2HZ   LYS  20          2HZ       LYS  20  17.369 -23.344  12.471
  540   3HZ   LYS  20          3HZ       LYS  20  18.300 -24.384  11.506
  541    H    ALA  21           H        ALA  21  13.079 -20.385  11.630
  542    HA   ALA  21           HA       ALA  21  10.358 -20.034  12.031
  543   1HB   ALA  21          1HB       ALA  21  12.631 -18.741  13.573
  544   2HB   ALA  21          3HB       ALA  21  11.025 -19.097  14.210
  545   3HB   ALA  21          2HB       ALA  21  12.105 -20.415  13.753
  546    H    LEU  22           H        LEU  22  12.735 -17.386  11.676
  547    HA   LEU  22           HA       LEU  22  10.641 -15.330  11.657
  548   1HB   LEU  22          1HB       LEU  22  13.632 -15.404  11.165
  549   2HB   LEU  22          2HB       LEU  22  12.694 -13.916  11.059
  550    HG   LEU  22           HG       LEU  22  11.851 -14.443  13.414
  551   1HD1  LEU  22          1HD1      LEU  22  13.886 -16.594  12.984
  552   2HD1  LEU  22          2HD1      LEU  22  13.743 -15.887  14.594
  553   3HD1  LEU  22          3HD1      LEU  22  12.350 -16.668  13.845
  554   1HD2  LEU  22          1HD2      LEU  22  13.863 -12.906  12.628
  555   2HD2  LEU  22          2HD2      LEU  22  13.609 -13.230  14.343
  556   3HD2  LEU  22          3HD2      LEU  22  14.836 -14.129  13.448
  557    H    GLN  23           H        GLN  23  12.548 -17.176   9.356
  558    HA   GLN  23           HA       GLN  23  12.170 -15.654   6.991
  559   1HB   GLN  23          1HB       GLN  23  13.548 -17.784   7.506
  560   2HB   GLN  23          2HB       GLN  23  12.066 -18.671   7.147
  561   1HG   GLN  23          1HG       GLN  23  11.977 -17.416   4.942
  562   2HG   GLN  23          2HG       GLN  23  13.603 -16.833   5.298
  563   2HE2  GLN  23          2HE2      GLN  23  15.368 -18.358   5.174
  564   1HE2  GLN  23          1HE2      GLN  23  15.167 -19.925   4.552
  565    H    GLN  24           H        GLN  24  10.095 -18.224   8.376
  566    HA   GLN  24           HA       GLN  24   8.060 -17.980   6.315
  567   1HB   GLN  24          1HB       GLN  24   8.747 -19.875   8.056
  568   2HB   GLN  24          2HB       GLN  24   7.535 -19.074   9.056
  569   1HG   GLN  24          1HG       GLN  24   6.452 -19.309   6.432
  570   2HG   GLN  24          2HG       GLN  24   7.119 -20.882   6.873
  571   2HE2  GLN  24          2HE2      GLN  24   4.278 -19.225   7.005
  572   1HE2  GLN  24          1HE2      GLN  24   3.613 -19.886   8.421
  573    H    LYS  25           H        LYS  25   8.454 -16.714   9.622
  574    HA   LYS  25           HA       LYS  25   5.856 -15.526   9.870
  575   1HB   LYS  25          1HB       LYS  25   8.465 -15.547  11.203
  576   2HB   LYS  25          2HB       LYS  25   7.640 -13.996  11.359
  577   1HG   LYS  25          2HG       LYS  25   6.674 -15.088  13.143
  578   2HG   LYS  25          1HG       LYS  25   5.557 -15.596  11.875
  579   1HD   LYS  25          1HD       LYS  25   7.472 -17.497  11.603
  580   2HD   LYS  25          2HD       LYS  25   7.604 -17.171  13.332
  581   1HE   LYS  25          1HE       LYS  25   4.818 -17.291  12.693
  582   2HE   LYS  25          2HE       LYS  25   5.606 -18.724  12.000
  583   1HZ   LYS  25          1HZ       LYS  25   6.034 -17.729  14.768
  584   2HZ   LYS  25          2HZ       LYS  25   5.015 -19.026  14.359
  585   3HZ   LYS  25          3HZ       LYS  25   6.690 -19.140  14.092
  586    H    ILE  26           H        ILE  26   8.996 -14.117   8.869
  587    HA   ILE  26           HA       ILE  26   8.017 -11.486   8.324
  588    HB   ILE  26           HB       ILE  26  10.313 -13.085   7.145
  589   1HG1  ILE  26          1HG1      ILE  26  10.395 -11.057   9.387
  590   2HG1  ILE  26          2HG1      ILE  26  10.146 -12.776   9.693
  591   1HG2  ILE  26          1HG2      ILE  26   9.369 -10.700   6.207
  592   2HG2  ILE  26          2HG2      ILE  26  10.507 -10.148   7.435
  593   3HG2  ILE  26          3HG2      ILE  26  11.062 -11.189   6.124
  594   1HD1  ILE  26          1HD1      ILE  26  12.478 -11.699   8.091
  595   2HD1  ILE  26          2HD1      ILE  26  12.560 -12.018   9.823
  596   3HD1  ILE  26          3HD1      ILE  26  12.262 -13.341   8.695
  597    H    HIS  27           H        HIS  27   8.490 -14.306   6.172
  598    HA   HIS  27           HA       HIS  27   7.559 -13.006   3.779
  599   1HB   HIS  27          1HB       HIS  27   8.943 -15.132   4.076
  600   2HB   HIS  27          2HB       HIS  27   7.435 -15.950   4.485
  601    HD1  HIS  27           HD1      HIS  27   5.456 -15.533   2.563
  602    HD2  HIS  27           HD2      HIS  27   9.426 -15.132   1.360
  603    HE1  HIS  27           HE1      HIS  27   5.462 -15.725   0.038
  604    H    GLU  28           H        GLU  28   5.914 -14.414   6.510
  605    HA   GLU  28           HA       GLU  28   3.386 -14.959   5.196
  606   1HB   GLU  28          1HB       GLU  28   4.587 -14.944   7.888
  607   2HB   GLU  28          2HB       GLU  28   2.863 -14.572   7.874
  608   1HG   GLU  28          1HG       GLU  28   3.537 -16.784   6.085
  609   2HG   GLU  28          2HG       GLU  28   3.973 -17.119   7.761
  610    H    LEU  29           H        LEU  29   4.557 -12.268   7.255
  611    HA   LEU  29           HA       LEU  29   2.121 -10.720   7.013
  612   1HB   LEU  29          1HB       LEU  29   4.967 -10.226   7.896
  613   2HB   LEU  29          2HB       LEU  29   3.781  -8.922   7.879
  614    HG   LEU  29           HG       LEU  29   3.288 -11.562   9.273
  615   1HD1  LEU  29          1HD1      LEU  29   5.295 -10.059  10.088
  616   2HD1  LEU  29          2HD1      LEU  29   4.009  -9.034  10.726
  617   3HD1  LEU  29          3HD1      LEU  29   4.151 -10.708  11.264
  618   1HD2  LEU  29          1HD2      LEU  29   1.525  -9.633   8.540
  619   2HD2  LEU  29          2HD2      LEU  29   1.326 -10.619   9.989
  620   3HD2  LEU  29          3HD2      LEU  29   2.028  -9.006  10.110
  621    H    GLU  30           H        GLU  30   5.278 -10.652   5.348
  622    HA   GLU  30           HA       GLU  30   4.944  -8.322   3.789
  623   1HB   GLU  30          1HB       GLU  30   6.875 -10.101   4.108
  624   2HB   GLU  30          2HB       GLU  30   6.167 -10.825   2.665
  625   1HG   GLU  30          1HG       GLU  30   6.291  -8.498   1.609
  626   2HG   GLU  30          2HG       GLU  30   7.314  -8.044   2.974
  627    H    GLY  31           H        GLY  31   3.989 -11.684   2.995
  628   1HA   GLY  31          2HA       GLY  31   2.391 -12.483   1.474
  629   2HA   GLY  31          1HA       GLY  31   2.878 -11.139   0.441
  630    H    LEU  32           H        LEU  32   1.669 -10.489   3.643
  631    HA   LEU  32           HA       LEU  32  -1.127 -10.204   2.953
  632   1HB   LEU  32          1HB       LEU  32   0.223 -10.442   5.228
  633   2HB   LEU  32          2HB       LEU  32   0.217  -8.679   5.161
  634    HG   LEU  32           HG       LEU  32  -2.275  -8.766   4.845
  635   1HD1  LEU  32          1HD1      LEU  32  -1.637 -11.649   4.853
  636   2HD1  LEU  32          2HD1      LEU  32  -3.012 -11.200   5.862
  637   3HD1  LEU  32          3HD1      LEU  32  -3.012 -10.803   4.144
  638   1HD2  LEU  32          1HD2      LEU  32  -0.803  -9.661   7.270
  639   2HD2  LEU  32          2HD2      LEU  32  -1.868  -8.272   7.050
  640   3HD2  LEU  32          3HD2      LEU  32  -2.553  -9.878   7.294
  641    H    MET  33           H        MET  33   1.650  -7.989   3.017
  642    HA   MET  33           HA       MET  33   0.218  -5.538   2.648
  643   1HB   MET  33          1HB       MET  33   2.964  -6.606   2.410
  644   2HB   MET  33          2HB       MET  33   2.643  -5.186   1.415
  645   1HG   MET  33          1HG       MET  33   2.232  -3.823   3.248
  646   2HG   MET  33          2HG       MET  33   1.726  -5.171   4.266
  647   1HE   MET  33          1HE       MET  33   4.439  -4.609   1.852
  648   2HE   MET  33          2HE       MET  33   5.123  -3.295   2.803
  649   3HE   MET  33          3HE       MET  33   5.971  -4.844   2.693
  650    H    MET  34           H        MET  34   1.835  -7.647   0.237
  651    HA   MET  34           HA       MET  34   1.237  -6.261  -2.114
  652   1HB   MET  34          2HB       MET  34   1.149  -9.253  -1.612
  653   2HB   MET  34          1HB       MET  34   1.437  -8.477  -3.169
  654   1HG   MET  34          1HG       MET  34   3.299  -7.259  -1.522
  655   2HG   MET  34          2HG       MET  34   3.288  -8.922  -0.939
  656   1HE   MET  34          1HE       MET  34   3.602  -6.446  -3.455
  657   2HE   MET  34          2HE       MET  34   4.886  -6.984  -4.535
  658   3HE   MET  34          3HE       MET  34   3.206  -7.335  -4.933
  659    H    GLN  35           H        GLN  35  -0.819  -8.767  -0.571
  660    HA   GLN  35           HA       GLN  35  -2.983  -8.796  -2.333
  661   1HB   GLN  35          1HB       GLN  35  -2.767 -10.272  -0.421
  662   2HB   GLN  35          2HB       GLN  35  -2.870  -8.912   0.697
  663   1HG   GLN  35          2HG       GLN  35  -5.107  -9.135   0.734
  664   2HG   GLN  35          1HG       GLN  35  -5.155  -8.785  -0.994
  665   2HE2  GLN  35          2HE2      GLN  35  -4.271 -11.582   1.124
  666   1HE2  GLN  35          1HE2      GLN  35  -5.029 -12.744   0.146
  667    H    HIS  36           H        HIS  36  -3.392  -7.046   0.732
  668    HA   HIS  36           HA       HIS  36  -5.444  -5.324  -0.068
  669   1HB   HIS  36          1HB       HIS  36  -3.140  -4.904   1.855
  670   2HB   HIS  36          2HB       HIS  36  -4.615  -3.940   1.849
  671    HD1  HIS  36           HD1      HIS  36  -6.797  -5.964   1.561
  672    HD2  HIS  36           HD2      HIS  36  -3.455  -6.678   3.948
  673    HE1  HIS  36           HE1      HIS  36  -7.473  -7.751   3.225
  674    H    ALA  37           H        ALA  37  -1.950  -4.497   0.010
  675    HA   ALA  37           HA       ALA  37  -1.968  -1.926  -1.050
  676   1HB   ALA  37          1HB       ALA  37  -0.013  -3.275  -0.265
  677   2HB   ALA  37          3HB       ALA  37  -0.089  -4.207  -1.760
  678   3HB   ALA  37          2HB       ALA  37   0.299  -2.488  -1.811
  679    H    GLN  38           H        GLN  38  -2.417  -4.987  -2.787
  680    HA   GLN  38           HA       GLN  38  -2.374  -3.739  -5.440
  681   1HB   GLN  38          1HB       GLN  38  -2.737  -6.421  -4.201
  682   2HB   GLN  38          2HB       GLN  38  -3.489  -6.189  -5.779
  683   1HG   GLN  38          1HG       GLN  38  -1.430  -5.707  -6.826
  684   2HG   GLN  38          2HG       GLN  38  -0.629  -5.369  -5.291
  685   2HE2  GLN  38          2HE2      GLN  38  -2.613  -8.176  -6.404
  686   1HE2  GLN  38          1HE2      GLN  38  -1.442  -9.341  -6.016
  687    H    ASN  39           H        ASN  39  -4.791  -4.741  -3.060
  688    HA   ASN  39           HA       ASN  39  -7.021  -3.999  -4.880
  689   1HB   ASN  39          1HB       ASN  39  -6.728  -5.320  -2.176
  690   2HB   ASN  39          2HB       ASN  39  -8.307  -4.828  -2.788
  691   2HD2  ASN  39          2HD2      ASN  39  -8.349  -7.439  -2.544
  692   1HD2  ASN  39          1HD2      ASN  39  -8.006  -8.273  -3.981
  693    H    LEU  40           H        LEU  40  -5.038  -2.054  -3.600
  694    HA   LEU  40           HA       LEU  40  -5.102   0.073  -2.605
  695   1HB   LEU  40          1HB       LEU  40  -7.881  -0.426  -3.663
  696   2HB   LEU  40          2HB       LEU  40  -7.508   1.081  -2.826
  697    HG   LEU  40           HG       LEU  40  -5.380   0.905  -4.520
  698   1HD1  LEU  40          1HD1      LEU  40  -7.168  -1.048  -5.458
  699   2HD1  LEU  40          2HD1      LEU  40  -7.390   0.331  -6.535
  700   3HD1  LEU  40          3HD1      LEU  40  -5.788  -0.377  -6.329
  701   1HD2  LEU  40          1HD2      LEU  40  -7.408   2.641  -4.080
  702   2HD2  LEU  40          2HD2      LEU  40  -6.275   2.817  -5.420
  703   3HD2  LEU  40          3HD2      LEU  40  -7.852   2.075  -5.690
  704    H    GLU  41           H        GLU  41  -5.305  -2.148  -0.793
  705    HA   GLU  41           HA       GLU  41  -7.112  -0.999   1.312
  706   1HB   GLU  41          1HB       GLU  41  -6.540  -3.732   0.313
  707   2HB   GLU  41          2HB       GLU  41  -6.642  -3.580   2.068
  708   1HG   GLU  41          1HG       GLU  41  -8.744  -2.388   0.258
  709   2HG   GLU  41          2HG       GLU  41  -8.839  -4.062   0.807
  710    H    PHE  42           H        PHE  42  -4.089  -0.694   0.493
  711    HA   PHE  42           HA       PHE  42  -2.427  -1.800   2.487
  712   1HB   PHE  42          1HB       PHE  42  -0.939   0.124   1.827
  713   2HB   PHE  42          2HB       PHE  42  -1.559  -0.815   0.474
  714    HD1  PHE  42           HD1      PHE  42  -2.518   2.173   2.573
  715    HD2  PHE  42           HD2      PHE  42  -2.502   0.339  -1.338
  716    HE1  PHE  42           HE1      PHE  42  -3.512   4.235   1.596
  717    HE2  PHE  42           HE2      PHE  42  -3.481   2.396  -2.307
  718    HZ   PHE  42           HZ       PHE  42  -3.986   4.349  -0.842
  719    H    GLU  43           H        GLU  43  -4.886   0.576   2.931
  720    HA   GLU  43           HA       GLU  43  -3.821   2.356   4.824
  721   1HB   GLU  43          1HB       GLU  43  -6.109   2.448   3.962
  722   2HB   GLU  43          2HB       GLU  43  -6.494   0.913   4.742
  723   1HG   GLU  43          1HG       GLU  43  -5.848   2.046   6.948
  724   2HG   GLU  43          2HG       GLU  43  -5.898   3.566   6.057
  725    H    GLU  44           H        GLU  44  -5.596  -0.614   5.699
  726    HA   GLU  44           HA       GLU  44  -4.287  -0.738   8.329
  727   1HB   GLU  44          2HB       GLU  44  -5.786  -2.690   8.582
  728   2HB   GLU  44          1HB       GLU  44  -6.671  -1.306   7.939
  729   1HG   GLU  44          1HG       GLU  44  -7.330  -2.663   6.260
  730   2HG   GLU  44          2HG       GLU  44  -5.671  -2.572   5.666
  731    H    ALA  45           H        ALA  45  -3.754  -2.011   5.149
  732    HA   ALA  45           HA       ALA  45  -2.273  -4.395   5.956
  733   1HB   ALA  45          1HB       ALA  45  -3.324  -3.086   3.581
  734   2HB   ALA  45          3HB       ALA  45  -1.691  -3.689   3.299
  735   3HB   ALA  45          2HB       ALA  45  -2.955  -4.793   3.840
  736    H    ALA  46           H        ALA  46  -1.339  -1.218   4.595
  737    HA   ALA  46           HA       ALA  46   1.411  -1.648   4.305
  738   1HB   ALA  46          1HB       ALA  46   1.483   0.888   4.719
  739   2HB   ALA  46          3HB       ALA  46   0.423   0.314   3.432
  740   3HB   ALA  46          2HB       ALA  46  -0.253   0.768   4.999
  741    H    GLN  47           H        GLN  47  -0.329  -0.717   7.302
  742    HA   GLN  47           HA       GLN  47   1.867  -0.061   8.932
  743   1HB   GLN  47          1HB       GLN  47   0.418  -0.945  10.782
  744   2HB   GLN  47          2HB       GLN  47  -0.447   0.110   9.666
  745   1HG   GLN  47          2HG       GLN  47  -1.916  -1.541   9.287
  746   2HG   GLN  47          1HG       GLN  47  -0.613  -2.519   8.610
  747   2HE2  GLN  47          2HE2      GLN  47   0.689  -3.824  10.258
  748   1HE2  GLN  47          1HE2      GLN  47  -0.111  -4.385  11.645
  749    H    ILE  48           H        ILE  48   0.941  -3.169   7.631
  750    HA   ILE  48           HA       ILE  48   2.259  -4.954   9.390
  751    HB   ILE  48           HB       ILE  48   1.917  -4.941   6.371
  752   1HG1  ILE  48          2HG1      ILE  48  -0.180  -4.823   7.674
  753   2HG1  ILE  48          1HG1      ILE  48  -0.021  -6.391   6.878
  754   1HG2  ILE  48          1HG2      ILE  48   2.909  -7.038   8.289
  755   2HG2  ILE  48          2HG2      ILE  48   2.045  -7.514   6.826
  756   3HG2  ILE  48          3HG2      ILE  48   3.545  -6.595   6.705
  757   1HD1  ILE  48          1HD1      ILE  48   1.273  -6.764   9.311
  758   2HD1  ILE  48          2HD1      ILE  48  -0.115  -5.761   9.731
  759   3HD1  ILE  48          3HD1      ILE  48  -0.359  -7.306   8.917
  760    H    ARG  49           H        ARG  49   3.523  -2.775   6.917
  761    HA   ARG  49           HA       ARG  49   6.129  -3.781   6.537
  762   1HB   ARG  49          2HB       ARG  49   6.682  -1.436   6.020
  763   2HB   ARG  49          1HB       ARG  49   5.084  -1.830   5.391
  764   1HG   ARG  49          2HG       ARG  49   4.529   0.122   6.459
  765   2HG   ARG  49          1HG       ARG  49   4.370  -0.964   7.838
  766   1HD   ARG  49          1HD       ARG  49   6.993  -0.464   8.066
  767   2HD   ARG  49          2HD       ARG  49   6.511   1.034   7.246
  768    HE   ARG  49           HE       ARG  49   4.862   0.157   9.551
  769   1HH1  ARG  49          1HH1      ARG  49   7.793   1.711   8.959
  770   2HH1  ARG  49          2HH1      ARG  49   7.401   3.154   9.833
  771   1HH2  ARG  49          1HH2      ARG  49   4.092   2.256  10.351
  772   2HH2  ARG  49          2HH2      ARG  49   5.305   3.462  10.621
  773    H    ASP  50           H        ASP  50   4.720  -2.156   9.313
  774    HA   ASP  50           HA       ASP  50   7.178  -1.527  10.692
  775   1HB   ASP  50          1HB       ASP  50   4.425  -1.137  10.989
  776   2HB   ASP  50          2HB       ASP  50   4.856  -2.168  12.355
  777    H    GLN  51           H        GLN  51   4.904  -4.282  10.817
  778    HA   GLN  51           HA       GLN  51   6.370  -5.779  12.807
  779   1HB   GLN  51          1HB       GLN  51   4.397  -6.533  10.624
  780   2HB   GLN  51          2HB       GLN  51   4.924  -7.638  11.893
  781   1HG   GLN  51          1HG       GLN  51   4.110  -5.999  13.598
  782   2HG   GLN  51          2HG       GLN  51   3.477  -5.004  12.286
  783   2HE2  GLN  51          2HE2      GLN  51   3.428  -8.584  12.705
  784   1HE2  GLN  51          1HE2      GLN  51   1.739  -8.720  12.598
  785    H    LEU  52           H        LEU  52   6.552  -5.500   9.297
  786    HA   LEU  52           HA       LEU  52   8.226  -7.795   8.801
  787   1HB   LEU  52          1HB       LEU  52   7.153  -5.432   7.433
  788   2HB   LEU  52          2HB       LEU  52   8.757  -5.878   6.852
  789    HG   LEU  52           HG       LEU  52   6.979  -7.036   5.576
  790   1HD1  LEU  52          1HD1      LEU  52   9.265  -8.084   6.206
  791   2HD1  LEU  52          2HD1      LEU  52   8.342  -9.076   7.335
  792   3HD1  LEU  52          3HD1      LEU  52   8.007  -9.165   5.606
  793   1HD2  LEU  52          1HD2      LEU  52   5.586  -7.129   7.872
  794   2HD2  LEU  52          2HD2      LEU  52   5.312  -8.283   6.568
  795   3HD2  LEU  52          3HD2      LEU  52   6.320  -8.731   7.944
  796    H    HIS  53           H        HIS  53   8.930  -4.341   9.376
  797    HA   HIS  53           HA       HIS  53  11.823  -4.703   9.190
  798   1HB   HIS  53          1HB       HIS  53  10.341  -2.635   8.714
  799   2HB   HIS  53          2HB       HIS  53  10.314  -2.414  10.464
  800    HD1  HIS  53           HD1      HIS  53  13.110  -2.973  11.327
  801    HD2  HIS  53           HD2      HIS  53  12.298  -0.923   7.789
  802    HE1  HIS  53           HE1      HIS  53  15.197  -1.652  10.770
  803    H    GLN  54           H        GLN  54   9.417  -4.520  11.792
  804    HA   GLN  54           HA       GLN  54  11.240  -4.306  13.995
  805   1HB   GLN  54          1HB       GLN  54   8.830  -3.852  14.115
  806   2HB   GLN  54          2HB       GLN  54   8.476  -5.538  13.734
  807   1HG   GLN  54          1HG       GLN  54   9.806  -6.169  15.806
  808   2HG   GLN  54          2HG       GLN  54   9.816  -4.454  16.222
  809   2HE2  GLN  54          2HE2      GLN  54   7.980  -7.340  16.462
  810   1HE2  GLN  54          1HE2      GLN  54   6.524  -6.643  16.987
  811    H    LEU  55           H        LEU  55   9.827  -7.128  12.328
  812    HA   LEU  55           HA       LEU  55  10.901  -9.138  14.067
  813   1HB   LEU  55          1HB       LEU  55   9.633  -8.880  11.422
  814   2HB   LEU  55          2HB       LEU  55  10.708 -10.272  11.556
  815    HG   LEU  55           HG       LEU  55   9.500 -10.725  13.806
  816   1HD1  LEU  55          1HD1      LEU  55   8.372  -8.427  13.697
  817   2HD1  LEU  55          2HD1      LEU  55   7.328  -9.113  12.452
  818   3HD1  LEU  55          3HD1      LEU  55   7.322  -9.791  14.080
  819   1HD2  LEU  55          1HD2      LEU  55   9.238 -11.857  11.441
  820   2HD2  LEU  55          2HD2      LEU  55   8.059 -12.201  12.707
  821   3HD2  LEU  55          3HD2      LEU  55   7.676 -11.039  11.437
  822    H    ARG  56           H        ARG  56  12.371  -7.147  11.627
  823    HA   ARG  56           HA       ARG  56  14.517  -8.755  10.730
  824   1HB   ARG  56          1HB       ARG  56  13.781  -6.467   9.957
  825   2HB   ARG  56          2HB       ARG  56  14.557  -5.795  11.392
  826   1HG   ARG  56          1HG       ARG  56  16.609  -7.261  10.501
  827   2HG   ARG  56          2HG       ARG  56  15.793  -7.001   8.958
  828   1HD   ARG  56          1HD       ARG  56  15.709  -4.481  10.100
  829   2HD   ARG  56          2HD       ARG  56  17.299  -5.089  10.602
  830    HE   ARG  56           HE       ARG  56  17.246  -5.843   7.988
  831   1HH1  ARG  56          1HH1      ARG  56  15.132  -3.630   7.720
  832   2HH1  ARG  56          2HH1      ARG  56  16.118  -2.306   7.198
  833   1HH2  ARG  56          1HH2      ARG  56  19.101  -3.818   8.112
  834   2HH2  ARG  56          2HH2      ARG  56  18.364  -2.411   7.419
  835    H    GLU  57           H        GLU  57  14.658  -6.344  13.396
  836    HA   GLU  57           HA       GLU  57  17.224  -7.122  14.359
  837   1HB   GLU  57          2HB       GLU  57  16.545  -5.830  16.336
  838   2HB   GLU  57          1HB       GLU  57  15.984  -5.022  14.872
  839   1HG   GLU  57          1HG       GLU  57  13.903  -6.758  15.487
  840   2HG   GLU  57          2HG       GLU  57  14.430  -6.174  17.065
  841    H    LEU  58           H        LEU  58  14.074  -8.566  14.791
  842    HA   LEU  58           HA       LEU  58  14.458 -10.004  17.213
  843   1HB   LEU  58          1HB       LEU  58  12.475  -9.668  15.422
  844   2HB   LEU  58          2HB       LEU  58  13.024 -11.268  14.922
  845    HG   LEU  58           HG       LEU  58  12.768 -10.925  17.841
  846   1HD1  LEU  58          1HD1      LEU  58  10.769  -9.716  16.452
  847   2HD1  LEU  58          2HD1      LEU  58  10.165 -11.373  16.492
  848   3HD1  LEU  58          3HD1      LEU  58  10.523 -10.528  17.999
  849   1HD2  LEU  58          1HD2      LEU  58  12.249 -12.962  15.715
  850   2HD2  LEU  58          2HD2      LEU  58  13.112 -13.132  17.242
  851   3HD2  LEU  58          3HD2      LEU  58  11.349 -13.108  17.224
  852    H    PHE  59           H        PHE  59  15.892 -10.441  14.076
  853    HA   PHE  59           HA       PHE  59  16.462 -13.182  13.951
  854   1HB   PHE  59          1HB       PHE  59  17.012 -11.506  12.236
  855   2HB   PHE  59          2HB       PHE  59  18.222 -10.793  13.304
  856    HD1  PHE  59           HD1      PHE  59  20.230 -12.167  14.012
  857    HD2  PHE  59           HD2      PHE  59  17.490 -13.461  10.937
  858    HE1  PHE  59           HE1      PHE  59  21.920 -13.810  13.199
  859    HE2  PHE  59           HE2      PHE  59  19.179 -15.104  10.123
  860    HZ   PHE  59           HZ       PHE  59  21.394 -15.278  11.254
  861    H    ILE  60           H        ILE  60  18.314 -10.659  15.694
  862    HA   ILE  60           HA       ILE  60  20.362 -12.356  16.720
  863    HB   ILE  60           HB       ILE  60  19.063  -9.839  17.816
  864   1HG1  ILE  60          1HG1      ILE  60  21.718  -9.725  16.543
  865   2HG1  ILE  60          2HG1      ILE  60  20.421 -10.200  15.446
  866   1HG2  ILE  60          1HG2      ILE  60  21.251 -11.539  18.790
  867   2HG2  ILE  60          2HG2      ILE  60  21.719  -9.851  18.584
  868   3HG2  ILE  60          3HG2      ILE  60  20.358 -10.269  19.627
  869   1HD1  ILE  60          1HD1      ILE  60  20.069  -7.849  17.296
  870   2HD1  ILE  60          2HD1      ILE  60  20.907  -7.660  15.756
  871   3HD1  ILE  60          3HD1      ILE  60  19.229  -8.202  15.786
  872    H    ALA  61           H        ALA  61  17.156 -11.497  18.022
  873    HA   ALA  61           HA       ALA  61  17.439 -12.820  20.552
  874   1HB   ALA  61          1HB       ALA  61  15.640 -11.181  19.334
  875   2HB   ALA  61          3HB       ALA  61  14.785 -12.720  19.228
  876   3HB   ALA  61          2HB       ALA  61  15.278 -12.092  20.800
  877    H    ALA  62           H        ALA  62  16.855 -14.013  17.331
  878    HA   ALA  62           HA       ALA  62  15.890 -16.640  18.339
  879   1HB   ALA  62          1HB       ALA  62  14.791 -16.608  16.364
  880   2HB   ALA  62          2HB       ALA  62  16.311 -16.439  15.484
  881   3HB   ALA  62          3HB       ALA  62  15.466 -15.005  16.068
  882    H    SER  63           H        SER  63  18.288 -15.632  15.867
  883    HA   SER  63           HA       SER  63  19.778 -18.043  15.858
  884   1HB   SER  63          1HB       SER  63  19.762 -15.745  14.456
  885   2HB   SER  63          2HB       SER  63  21.162 -15.425  15.476
  886    HG   SER  63           HG       SER  63  22.207 -17.083  14.583

  No H/Q in entry =         886
  Start of MODEL    4
    1    H    LEU   8           H        LEU   8 -23.376   2.424 -26.528
    2    HA   LEU   8           HA       LEU   8 -22.352   1.805 -29.117
    3   1HB   LEU   8          1HB       LEU   8 -24.780   0.446 -28.295
    4   2HB   LEU   8          2HB       LEU   8 -25.082   1.450 -29.713
    5    HG   LEU   8           HG       LEU   8 -24.342  -0.814 -30.369
    6   1HD1  LEU   8          1HD1      LEU   8 -22.898   1.671 -31.017
    7   2HD1  LEU   8          2HD1      LEU   8 -22.004   0.200 -31.402
    8   3HD1  LEU   8          3HD1      LEU   8 -23.604   0.466 -32.095
    9   1HD2  LEU   8          1HD2      LEU   8 -22.478  -0.362 -28.223
   10   2HD2  LEU   8          2HD2      LEU   8 -22.770  -1.848 -29.129
   11   3HD2  LEU   8          3HD2      LEU   8 -21.580  -0.682 -29.708
   12    H    GLU   9           H        GLU   9 -22.337   3.755 -30.175
   13    HA   GLU   9           HA       GLU   9 -22.857   6.009 -30.667
   14   1HB   GLU   9          1HB       GLU   9 -24.911   4.494 -31.326
   15   2HB   GLU   9          2HB       GLU   9 -25.695   5.301 -29.968
   16   1HG   GLU   9          1HG       GLU   9 -25.210   7.493 -30.960
   17   2HG   GLU   9          2HG       GLU   9 -24.369   6.714 -32.301
   18    HA   PRO  10           HA       PRO  10 -23.170   7.033 -26.164
   19   1HB   PRO  10          1HB       PRO  10 -20.940   8.617 -26.091
   20   2HB   PRO  10          2HB       PRO  10 -20.882   6.857 -25.863
   21   1HG   PRO  10          2HG       PRO  10 -20.241   8.477 -28.274
   22   2HG   PRO  10          1HG       PRO  10 -19.449   7.024 -27.646
   23   1HD   PRO  10          1HD       PRO  10 -21.192   7.010 -29.748
   24   2HD   PRO  10          2HD       PRO  10 -20.921   5.615 -28.680
   25    H    ASP  11           H        ASP  11 -22.022   9.271 -28.720
   26    HA   ASP  11           HA       ASP  11 -22.787  11.413 -29.346
   27   1HB   ASP  11          1HB       ASP  11 -25.042   9.813 -28.512
   28   2HB   ASP  11          2HB       ASP  11 -25.318  11.498 -28.069
   29    H    ASN  12           H        ASN  12 -24.586  11.229 -26.287
   30    HA   ASN  12           HA       ASN  12 -22.684  13.204 -25.088
   31   1HB   ASN  12          1HB       ASN  12 -24.709  14.492 -24.365
   32   2HB   ASN  12          2HB       ASN  12 -24.538  14.421 -26.119
   33   2HD2  ASN  12          2HD2      ASN  12 -26.275  12.872 -23.386
   34   1HD2  ASN  12          1HD2      ASN  12 -27.595  12.351 -24.319
   35    H    VAL  13           H        VAL  13 -23.362  10.259 -24.663
   36    HA   VAL  13           HA       VAL  13 -24.844  10.006 -22.209
   37    HB   VAL  13           HB       VAL  13 -23.035   8.368 -23.940
   38   1HG1  VAL  13          1HG1      VAL  13 -23.702   7.698 -21.065
   39   2HG1  VAL  13          2HG1      VAL  13 -23.372   6.445 -22.260
   40   3HG1  VAL  13          3HG1      VAL  13 -22.129   7.630 -21.861
   41   1HG2  VAL  13          1HG2      VAL  13 -25.859   8.468 -23.065
   42   2HG2  VAL  13          2HG2      VAL  13 -25.175   8.008 -24.625
   43   3HG2  VAL  13          3HG2      VAL  13 -25.192   6.851 -23.294
   44    HA   PRO  14           HA       PRO  14 -20.626   9.968 -19.988
   45   1HB   PRO  14          1HB       PRO  14 -18.356  10.464 -21.429
   46   2HB   PRO  14          2HB       PRO  14 -19.026   8.833 -21.221
   47   1HG   PRO  14          2HG       PRO  14 -19.212  10.674 -23.548
   48   2HG   PRO  14          1HG       PRO  14 -19.039   8.912 -23.508
   49   1HD   PRO  14          1HD       PRO  14 -21.401  10.204 -24.001
   50   2HD   PRO  14          2HD       PRO  14 -21.275   8.567 -23.324
   51    H    MET  15           H        MET  15 -20.409  12.176 -22.792
   52    HA   MET  15           HA       MET  15 -20.135  14.518 -22.882
   53   1HB   MET  15          1HB       MET  15 -22.276  13.887 -21.389
   54   2HB   MET  15          2HB       MET  15 -21.320  14.697 -20.148
   55   1HG   MET  15          1HG       MET  15 -21.037  16.397 -22.298
   56   2HG   MET  15          2HG       MET  15 -22.698  15.831 -22.485
   57   1HE   MET  15          1HE       MET  15 -21.534  18.418 -22.212
   58   2HE   MET  15          2HE       MET  15 -22.860  19.219 -21.373
   59   3HE   MET  15          3HE       MET  15 -21.265  19.155 -20.625
   60    H    ASP  16           H        ASP  16 -19.818  16.233 -20.509
   61    HA   ASP  16           HA       ASP  16 -17.202  15.289 -19.408
   62   1HB   ASP  16          1HB       ASP  16 -17.774  17.437 -21.311
   63   2HB   ASP  16          2HB       ASP  16 -16.893  18.016 -19.896
   64    H    MET  17           H        MET  17 -19.557  15.240 -17.929
   65    HA   MET  17           HA       MET  17 -20.343  17.562 -16.539
   66   1HB   MET  17          1HB       MET  17 -21.029  15.932 -14.797
   67   2HB   MET  17          2HB       MET  17 -21.418  15.344 -16.413
   68   1HG   MET  17          1HG       MET  17 -19.240  14.077 -16.393
   69   2HG   MET  17          2HG       MET  17 -19.053  14.538 -14.701
   70   1HE   MET  17          1HE       MET  17 -20.520  12.829 -17.365
   71   2HE   MET  17          2HE       MET  17 -20.467  11.237 -16.611
   72   3HE   MET  17          3HE       MET  17 -22.018  12.036 -16.861
   73    H    SER  18           H        SER  18 -17.598  15.373 -15.894
   74    HA   SER  18           HA       SER  18 -16.753  16.607 -13.442
   75   1HB   SER  18          1HB       SER  18 -15.017  15.237 -15.507
   76   2HB   SER  18          2HB       SER  18 -14.808  15.249 -13.758
   77    HG   SER  18           HG       SER  18 -16.056  13.457 -15.154
   78    HA   PRO  19           HA       PRO  19 -14.699  20.149 -15.071
   79   1HB   PRO  19          1HB       PRO  19 -12.961  20.677 -13.033
   80   2HB   PRO  19          2HB       PRO  19 -14.711  20.938 -12.909
   81   1HG   PRO  19          1HG       PRO  19 -13.043  18.860 -11.694
   82   2HG   PRO  19          2HG       PRO  19 -14.628  19.463 -11.204
   83   1HD   PRO  19          1HD       PRO  19 -14.036  17.056 -12.610
   84   2HD   PRO  19          2HD       PRO  19 -15.635  17.709 -12.192
   85    H    LYS  20           H        LYS  20 -13.392  17.337 -15.532
   86    HA   LYS  20           HA       LYS  20 -11.483  16.575 -16.681
   87   1HB   LYS  20          1HB       LYS  20 -12.020  18.861 -17.788
   88   2HB   LYS  20          2HB       LYS  20 -10.648  19.469 -16.863
   89   1HG   LYS  20          1HG       LYS  20 -10.211  16.935 -18.354
   90   2HG   LYS  20          2HG       LYS  20 -10.381  18.397 -19.326
   91   1HD   LYS  20          1HD       LYS  20  -8.710  19.147 -17.206
   92   2HD   LYS  20          2HD       LYS  20  -8.146  17.544 -17.677
   93   1HE   LYS  20          1HE       LYS  20  -8.308  18.466 -20.122
   94   2HE   LYS  20          2HE       LYS  20  -8.268  20.056 -19.335
   95   1HZ   LYS  20          1HZ       LYS  20  -6.350  19.090 -17.991
   96   2HZ   LYS  20          2HZ       LYS  20  -6.273  17.877 -19.174
   97   3HZ   LYS  20          3HZ       LYS  20  -6.029  19.503 -19.608
   98    H    ALA  21           H        ALA  21 -10.225  19.472 -14.970
   99    HA   ALA  21           HA       ALA  21  -7.720  18.527 -14.239
  100   1HB   ALA  21          1HB       ALA  21  -7.940  20.670 -13.523
  101   2HB   ALA  21          2HB       ALA  21  -9.679  20.496 -13.293
  102   3HB   ALA  21          3HB       ALA  21  -8.566  19.969 -12.031
  103    H    LEU  22           H        LEU  22 -10.743  18.056 -12.386
  104    HA   LEU  22           HA       LEU  22  -9.420  16.372 -10.379
  105   1HB   LEU  22          1HB       LEU  22 -12.237  17.244 -11.038
  106   2HB   LEU  22          2HB       LEU  22 -11.930  16.050  -9.777
  107    HG   LEU  22           HG       LEU  22 -10.342  17.683  -8.711
  108   1HD1  LEU  22          1HD1      LEU  22 -11.292  19.284 -11.054
  109   2HD1  LEU  22          2HD1      LEU  22 -10.955  20.128  -9.544
  110   3HD1  LEU  22          3HD1      LEU  22  -9.684  19.198 -10.339
  111   1HD2  LEU  22          1HD2      LEU  22 -13.281  18.120  -9.039
  112   2HD2  LEU  22          2HD2      LEU  22 -12.362  17.722  -7.587
  113   3HD2  LEU  22          3HD2      LEU  22 -12.359  19.373  -8.208
  114    H    GLN  23           H        GLN  23 -11.661  15.929 -13.090
  115    HA   GLN  23           HA       GLN  23 -12.196  13.175 -12.906
  116   1HB   GLN  23          1HB       GLN  23 -13.018  14.994 -14.537
  117   2HB   GLN  23          2HB       GLN  23 -11.575  14.630 -15.484
  118   1HG   GLN  23          1HG       GLN  23 -12.276  12.224 -15.531
  119   2HG   GLN  23          2HG       GLN  23 -13.778  12.690 -14.729
  120   2HE2  GLN  23          2HE2      GLN  23 -11.840  13.869 -17.552
  121   1HE2  GLN  23          1HE2      GLN  23 -13.184  14.068 -18.569
  122    H    GLN  24           H        GLN  24  -9.502  14.695 -14.733
  123    HA   GLN  24           HA       GLN  24  -8.225  12.171 -15.354
  124   1HB   GLN  24          1HB       GLN  24  -8.040  14.376 -16.578
  125   2HB   GLN  24          2HB       GLN  24  -7.053  14.968 -15.241
  126   1HG   GLN  24          1HG       GLN  24  -6.158  12.363 -16.225
  127   2HG   GLN  24          2HG       GLN  24  -6.103  13.613 -17.469
  128   2HE2  GLN  24          2HE2      GLN  24  -4.058  12.232 -15.389
  129   1HE2  GLN  24          1HE2      GLN  24  -3.125  13.566 -14.907
  130    H    LYS  25           H        LYS  25  -7.897  14.539 -12.740
  131    HA   LYS  25           HA       LYS  25  -5.455  13.497 -11.617
  132   1HB   LYS  25          1HB       LYS  25  -7.723  15.273 -10.804
  133   2HB   LYS  25          2HB       LYS  25  -6.627  14.702  -9.544
  134   1HG   LYS  25          1HG       LYS  25  -4.717  15.641 -10.681
  135   2HG   LYS  25          2HG       LYS  25  -5.688  16.029 -12.101
  136   1HD   LYS  25          1HD       LYS  25  -6.345  17.983 -11.197
  137   2HD   LYS  25          2HD       LYS  25  -6.877  17.174  -9.722
  138   1HE   LYS  25          1HE       LYS  25  -3.984  17.225  -9.814
  139   2HE   LYS  25          2HE       LYS  25  -4.634  18.867  -9.992
  140   1HZ   LYS  25          1HZ       LYS  25  -5.717  16.966  -7.999
  141   2HZ   LYS  25          2HZ       LYS  25  -4.402  17.978  -7.634
  142   3HZ   LYS  25          3HZ       LYS  25  -5.904  18.651  -8.055
  143    H    ILE  26           H        ILE  26  -8.884  13.043 -10.661
  144    HA   ILE  26           HA       ILE  26  -8.427  11.164  -8.575
  145    HB   ILE  26           HB       ILE  26 -10.734  11.529 -10.515
  146   1HG1  ILE  26          1HG1      ILE  26 -10.417  12.558  -7.683
  147   2HG1  ILE  26          2HG1      ILE  26  -9.972  13.509  -9.100
  148   1HG2  ILE  26          1HG2      ILE  26 -10.666   9.332  -9.220
  149   2HG2  ILE  26          2HG2      ILE  26 -10.810  10.297  -7.751
  150   3HG2  ILE  26          3HG2      ILE  26 -12.098  10.328  -8.955
  151   1HD1  ILE  26          1HD1      ILE  26 -12.697  12.254  -8.956
  152   2HD1  ILE  26          2HD1      ILE  26 -12.384  13.758  -8.089
  153   3HD1  ILE  26          3HD1      ILE  26 -12.180  13.689  -9.839
  154    H    HIS  27           H        HIS  27  -9.278  10.565 -12.009
  155    HA   HIS  27           HA       HIS  27  -9.130   7.714 -11.888
  156   1HB   HIS  27          1HB       HIS  27  -9.985   9.479 -13.672
  157   2HB   HIS  27          2HB       HIS  27  -8.361   9.282 -14.328
  158    HD1  HIS  27           HD1      HIS  27  -8.889   7.855 -16.361
  159    HD2  HIS  27           HD2      HIS  27 -10.494   6.285 -12.848
  160    HE1  HIS  27           HE1      HIS  27  -9.770   5.553 -16.942
  161    H    GLU  28           H        GLU  28  -6.648  10.190 -12.404
  162    HA   GLU  28           HA       GLU  28  -4.568   8.263 -13.133
  163   1HB   GLU  28          1HB       GLU  28  -4.712  10.643 -13.900
  164   2HB   GLU  28          2HB       GLU  28  -4.411  11.161 -12.241
  165   1HG   GLU  28          1HG       GLU  28  -2.266  11.204 -13.212
  166   2HG   GLU  28          2HG       GLU  28  -2.302   9.648 -12.384
  167    H    LEU  29           H        LEU  29  -5.460  10.111 -10.215
  168    HA   LEU  29           HA       LEU  29  -3.212   9.219  -8.625
  169   1HB   LEU  29          1HB       LEU  29  -5.925  10.441  -8.084
  170   2HB   LEU  29          2HB       LEU  29  -4.803  10.062  -6.777
  171    HG   LEU  29           HG       LEU  29  -3.931  11.693  -9.160
  172   1HD1  LEU  29          1HD1      LEU  29  -5.953  12.723  -8.039
  173   2HD1  LEU  29          2HD1      LEU  29  -5.007  12.802  -6.553
  174   3HD1  LEU  29          3HD1      LEU  29  -4.497  13.716  -7.972
  175   1HD2  LEU  29          1HD2      LEU  29  -2.846  10.862  -6.540
  176   2HD2  LEU  29          2HD2      LEU  29  -1.996  11.316  -8.017
  177   3HD2  LEU  29          3HD2      LEU  29  -2.598  12.565  -6.928
  178    H    GLU  30           H        GLU  30  -6.506   8.009  -9.151
  179    HA   GLU  30           HA       GLU  30  -6.609   6.101  -7.034
  180   1HB   GLU  30          1HB       GLU  30  -8.438   6.955  -8.591
  181   2HB   GLU  30          2HB       GLU  30  -7.802   5.847  -9.807
  182   1HG   GLU  30          1HG       GLU  30  -8.002   4.231  -7.577
  183   2HG   GLU  30          2HG       GLU  30  -9.417   5.273  -7.424
  184    H    GLY  31           H        GLY  31  -5.389   5.819 -10.379
  185   1HA   GLY  31          2HA       GLY  31  -4.286   4.001 -11.421
  186   2HA   GLY  31          1HA       GLY  31  -4.662   3.009 -10.012
  187    H    LEU  32           H        LEU  32  -3.150   6.100  -9.514
  188    HA   LEU  32           HA       LEU  32  -0.395   5.331  -9.695
  189   1HB   LEU  32          1HB       LEU  32  -1.676   7.630  -9.436
  190   2HB   LEU  32          2HB       LEU  32  -1.429   7.338  -7.714
  191    HG   LEU  32           HG       LEU  32   1.044   6.866  -8.388
  192   1HD1  LEU  32          1HD1      LEU  32  -0.161   7.979 -10.872
  193   2HD1  LEU  32          2HD1      LEU  32   1.425   8.603 -10.416
  194   3HD1  LEU  32          3HD1      LEU  32   1.201   6.874 -10.679
  195   1HD2  LEU  32          1HD2      LEU  32  -0.433   9.332  -7.863
  196   2HD2  LEU  32          2HD2      LEU  32   1.105   8.788  -7.195
  197   3HD2  LEU  32          3HD2      LEU  32   1.065   9.633  -8.743
  198    H    MET  33           H        MET  33  -2.837   4.719  -7.281
  199    HA   MET  33           HA       MET  33  -1.152   4.299  -4.996
  200   1HB   MET  33          1HB       MET  33  -3.888   3.473  -5.920
  201   2HB   MET  33          2HB       MET  33  -3.229   2.763  -4.446
  202   1HG   MET  33          1HG       MET  33  -3.474   4.689  -3.276
  203   2HG   MET  33          2HG       MET  33  -2.855   5.671  -4.604
  204   1HE   MET  33          1HE       MET  33  -5.760   4.126  -2.782
  205   2HE   MET  33          2HE       MET  33  -7.151   4.267  -3.853
  206   3HE   MET  33          3HE       MET  33  -5.862   3.131  -4.241
  207    H    MET  34           H        MET  34  -2.633   1.880  -7.200
  208    HA   MET  34           HA       MET  34  -1.377  -0.430  -6.219
  209   1HB   MET  34          1HB       MET  34  -3.035   0.274  -8.289
  210   2HB   MET  34          2HB       MET  34  -1.574  -0.196  -9.158
  211   1HG   MET  34          1HG       MET  34  -2.309  -2.324  -8.922
  212   2HG   MET  34          2HG       MET  34  -1.808  -2.176  -7.238
  213   1HE   MET  34          1HE       MET  34  -2.935  -1.702  -5.442
  214   2HE   MET  34          2HE       MET  34  -4.068  -0.369  -5.660
  215   3HE   MET  34          3HE       MET  34  -4.660  -1.942  -5.129
  216    H    GLN  35           H        GLN  35  -0.089   2.046  -8.405
  217    HA   GLN  35           HA       GLN  35   2.267   0.698  -9.270
  218   1HB   GLN  35          1HB       GLN  35   1.410   2.755 -10.262
  219   2HB   GLN  35          2HB       GLN  35   1.642   3.622  -8.745
  220   1HG   GLN  35          2HG       GLN  35   3.680   4.190  -9.539
  221   2HG   GLN  35          1HG       GLN  35   4.144   2.514  -9.246
  222   2HE2  GLN  35          2HE2      GLN  35   2.421   4.430 -11.782
  223   1HE2  GLN  35          1HE2      GLN  35   3.102   3.582 -13.086
  224    H    HIS  36           H        HIS  36   2.370   3.413  -6.958
  225    HA   HIS  36           HA       HIS  36   4.852   2.814  -5.801
  226   1HB   HIS  36          1HB       HIS  36   2.339   4.112  -4.720
  227   2HB   HIS  36          2HB       HIS  36   3.880   4.156  -3.865
  228    HD1  HIS  36           HD1      HIS  36   5.941   4.860  -5.778
  229    HD2  HIS  36           HD2      HIS  36   2.095   6.410  -6.212
  230    HE1  HIS  36           HE1      HIS  36   6.159   6.922  -7.231
  231    H    ALA  37           H        ALA  37   1.618   1.729  -4.686
  232    HA   ALA  37           HA       ALA  37   2.372   0.294  -2.371
  233   1HB   ALA  37          1HB       ALA  37   0.274  -0.216  -4.515
  234   2HB   ALA  37          2HB       ALA  37   0.308  -1.058  -2.965
  235   3HB   ALA  37          3HB       ALA  37   0.061   0.687  -3.014
  236    H    GLN  38           H        GLN  38   2.439  -0.672  -5.804
  237    HA   GLN  38           HA       GLN  38   3.236  -3.411  -5.385
  238   1HB   GLN  38          1HB       GLN  38   2.971  -1.435  -7.561
  239   2HB   GLN  38          2HB       GLN  38   4.220  -2.648  -7.849
  240   1HG   GLN  38          1HG       GLN  38   2.704  -4.413  -7.827
  241   2HG   GLN  38          2HG       GLN  38   1.535  -3.532  -6.843
  242   2HE2  GLN  38          2HE2      GLN  38   0.349  -4.616  -8.990
  243   1HE2  GLN  38          1HE2      GLN  38   0.099  -3.490 -10.235
  244    H    ASN  39           H        ASN  39   4.988  -0.356  -5.686
  245    HA   ASN  39           HA       ASN  39   7.629  -1.666  -5.674
  246   1HB   ASN  39          1HB       ASN  39   6.709   1.225  -5.487
  247   2HB   ASN  39          2HB       ASN  39   8.382   0.712  -5.711
  248   2HD2  ASN  39          2HD2      ASN  39   8.061   2.057  -7.810
  249   1HD2  ASN  39          1HD2      ASN  39   7.433   1.239  -9.158
  250    H    LEU  40           H        LEU  40   5.374  -1.345  -3.346
  251    HA   LEU  40           HA       LEU  40   5.442  -1.422  -1.020
  252   1HB   LEU  40          1HB       LEU  40   7.931  -2.405  -2.016
  253   2HB   LEU  40          2HB       LEU  40   8.271  -1.444  -0.576
  254    HG   LEU  40           HG       LEU  40   5.991  -3.397  -0.542
  255   1HD1  LEU  40          1HD1      LEU  40   8.323  -4.377  -1.352
  256   2HD1  LEU  40          2HD1      LEU  40   8.713  -4.261   0.364
  257   3HD1  LEU  40          3HD1      LEU  40   7.347  -5.242  -0.165
  258   1HD2  LEU  40          1HD2      LEU  40   7.318  -1.643   1.291
  259   2HD2  LEU  40          2HD2      LEU  40   5.947  -2.707   1.603
  260   3HD2  LEU  40          3HD2      LEU  40   7.592  -3.301   1.827
  261    H    GLU  41           H        GLU  41   6.013   1.169  -2.673
  262    HA   GLU  41           HA       GLU  41   7.604   2.892  -0.990
  263   1HB   GLU  41          1HB       GLU  41   5.384   3.271  -3.017
  264   2HB   GLU  41          2HB       GLU  41   6.143   4.647  -2.215
  265   1HG   GLU  41          1HG       GLU  41   7.768   2.527  -3.630
  266   2HG   GLU  41          2HG       GLU  41   7.142   3.944  -4.475
  267    H    PHE  42           H        PHE  42   4.102   2.373  -1.296
  268    HA   PHE  42           HA       PHE  42   2.342   2.580   0.217
  269   1HB   PHE  42          1HB       PHE  42   4.765   1.914   1.792
  270   2HB   PHE  42          2HB       PHE  42   3.402   2.535   2.720
  271    HD1  PHE  42           HD1      PHE  42   1.065   1.532   1.270
  272    HD2  PHE  42           HD2      PHE  42   4.823  -0.419   2.115
  273    HE1  PHE  42           HE1      PHE  42  -0.055  -0.690   1.118
  274    HE2  PHE  42           HE2      PHE  42   3.702  -2.640   1.966
  275    HZ   PHE  42           HZ       PHE  42   1.261  -2.771   1.472
  276    H    GLU  43           H        GLU  43   5.020   4.558   1.604
  277    HA   GLU  43           HA       GLU  43   3.518   6.502   2.909
  278   1HB   GLU  43          1HB       GLU  43   5.951   6.413   2.925
  279   2HB   GLU  43          2HB       GLU  43   6.012   6.757   1.196
  280   1HG   GLU  43          1HG       GLU  43   4.767   8.933   1.749
  281   2HG   GLU  43          2HG       GLU  43   5.172   8.604   3.436
  282    H    GLU  44           H        GLU  44   4.677   6.836  -0.451
  283    HA   GLU  44           HA       GLU  44   2.743   8.965  -1.007
  284   1HB   GLU  44          2HB       GLU  44   3.870   8.984  -3.175
  285   2HB   GLU  44          1HB       GLU  44   5.080   8.845  -1.901
  286   1HG   GLU  44          1HG       GLU  44   5.201   6.415  -2.254
  287   2HG   GLU  44          2HG       GLU  44   3.951   6.523  -3.493
  288    H    ALA  45           H        ALA  45   2.819   5.490  -1.277
  289    HA   ALA  45           HA       ALA  45   0.853   5.317  -3.438
  290   1HB   ALA  45          1HB       ALA  45   1.315   3.049  -1.591
  291   2HB   ALA  45          3HB       ALA  45   2.760   3.698  -2.363
  292   3HB   ALA  45          2HB       ALA  45   1.424   3.104  -3.348
  293    H    ALA  46           H        ALA  46   0.756   4.592   0.072
  294    HA   ALA  46           HA       ALA  46  -2.133   4.174  -0.015
  295   1HB   ALA  46          1HB       ALA  46  -0.267   3.115   1.455
  296   2HB   ALA  46          3HB       ALA  46  -0.459   4.557   2.455
  297   3HB   ALA  46          2HB       ALA  46  -1.825   3.470   2.200
  298    H    GLN  47           H        GLN  47  -0.062   6.926   0.494
  299    HA   GLN  47           HA       GLN  47  -1.891   8.490   2.104
  300   1HB   GLN  47          1HB       GLN  47   0.544   8.937   0.418
  301   2HB   GLN  47          2HB       GLN  47  -0.400  10.345   0.902
  302   1HG   GLN  47          1HG       GLN  47   0.240   8.332   3.011
  303   2HG   GLN  47          2HG       GLN  47   1.550   9.372   2.454
  304   2HE2  GLN  47          2HE2      GLN  47  -1.861  10.400   2.544
  305   1HE2  GLN  47          1HE2      GLN  47  -1.649  11.565   3.759
  306    H    ILE  48           H        ILE  48  -1.751   7.671  -1.278
  307    HA   ILE  48           HA       ILE  48  -3.181   9.934  -2.344
  308    HB   ILE  48           HB       ILE  48  -2.888   7.047  -3.230
  309   1HG1  ILE  48          1HG1      ILE  48  -1.454   9.504  -4.257
  310   2HG1  ILE  48          2HG1      ILE  48  -0.821   8.541  -2.922
  311   1HG2  ILE  48          1HG2      ILE  48  -4.817   8.170  -4.313
  312   2HG2  ILE  48          2HG2      ILE  48  -3.756   9.487  -4.811
  313   3HG2  ILE  48          3HG2      ILE  48  -3.515   7.866  -5.462
  314   1HD1  ILE  48          1HD1      ILE  48  -1.615   7.253  -5.531
  315   2HD1  ILE  48          2HD1      ILE  48  -0.013   7.957  -5.313
  316   3HD1  ILE  48          3HD1      ILE  48  -0.540   6.628  -4.280
  317    H    ARG  49           H        ARG  49  -4.225   6.985  -0.714
  318    HA   ARG  49           HA       ARG  49  -6.908   6.795  -1.549
  319   1HB   ARG  49          2HB       ARG  49  -7.232   5.665   0.598
  320   2HB   ARG  49          1HB       ARG  49  -5.645   5.244  -0.045
  321   1HG   ARG  49          2HG       ARG  49  -4.952   5.827   2.054
  322   2HG   ARG  49          1HG       ARG  49  -4.996   7.455   1.380
  323   1HD   ARG  49          1HD       ARG  49  -7.480   7.490   2.141
  324   2HD   ARG  49          2HD       ARG  49  -7.029   6.109   3.160
  325    HE   ARG  49           HE       ARG  49  -5.170   8.373   3.316
  326   1HH1  ARG  49          1HH1      ARG  49  -8.357   7.736   4.252
  327   2HH1  ARG  49          2HH1      ARG  49  -8.107   8.078   5.932
  328   1HH2  ARG  49          1HH2      ARG  49  -4.671   8.428   5.619
  329   2HH2  ARG  49          2HH2      ARG  49  -6.019   8.469   6.705
  330    H    ASP  50           H        ASP  50  -5.388   9.167   0.544
  331    HA   ASP  50           HA       ASP  50  -7.900  10.223   1.613
  332   1HB   ASP  50          1HB       ASP  50  -5.222  10.290   2.273
  333   2HB   ASP  50          2HB       ASP  50  -5.485  11.912   1.630
  334    H    GLN  51           H        GLN  51  -5.642  11.055  -1.002
  335    HA   GLN  51           HA       GLN  51  -6.953  13.557  -1.692
  336   1HB   GLN  51          2HB       GLN  51  -5.123  11.720  -3.275
  337   2HB   GLN  51          1HB       GLN  51  -5.436  13.421  -3.626
  338   1HG   GLN  51          1HG       GLN  51  -4.401  14.115  -1.561
  339   2HG   GLN  51          2HG       GLN  51  -4.276  12.446  -1.003
  340   2HE2  GLN  51          2HE2      GLN  51  -3.440  14.005  -4.154
  341   1HE2  GLN  51          1HE2      GLN  51  -1.842  13.432  -4.176
  342    H    LEU  52           H        LEU  52  -7.259  10.184  -2.714
  343    HA   LEU  52           HA       LEU  52  -8.898  10.665  -5.039
  344   1HB   LEU  52          1HB       LEU  52  -7.736   8.503  -3.568
  345   2HB   LEU  52          2HB       LEU  52  -9.447   8.142  -3.799
  346    HG   LEU  52           HG       LEU  52  -8.088   7.302  -5.689
  347   1HD1  LEU  52          1HD1      LEU  52 -10.060   9.535  -6.118
  348   2HD1  LEU  52          2HD1      LEU  52  -9.308   8.740  -7.499
  349   3HD1  LEU  52          3HD1      LEU  52 -10.278   7.803  -6.363
  350   1HD2  LEU  52          1HD2      LEU  52  -6.943   9.973  -5.446
  351   2HD2  LEU  52          2HD2      LEU  52  -6.308   8.561  -6.289
  352   3HD2  LEU  52          3HD2      LEU  52  -7.449   9.632  -7.100
  353    H    HIS  53           H        HIS  53  -9.729   9.633  -1.705
  354    HA   HIS  53           HA       HIS  53 -12.581   9.750  -2.107
  355   1HB   HIS  53          1HB       HIS  53 -10.687   9.704   0.241
  356   2HB   HIS  53          2HB       HIS  53 -12.427   9.838   0.494
  357    HD1  HIS  53           HD1      HIS  53 -13.470   7.968  -1.693
  358    HD2  HIS  53           HD2      HIS  53 -10.248   7.011   0.774
  359    HE1  HIS  53           HE1      HIS  53 -13.286   5.442  -1.702
  360    H    GLN  54           H        GLN  54 -10.185  12.083  -0.898
  361    HA   GLN  54           HA       GLN  54 -12.103  14.085  -0.074
  362   1HB   GLN  54          1HB       GLN  54  -9.691  13.812   0.641
  363   2HB   GLN  54          2HB       GLN  54  -9.217  14.409  -0.951
  364   1HG   GLN  54          1HG       GLN  54 -10.299  16.528  -0.562
  365   2HG   GLN  54          2HG       GLN  54 -11.035  15.936   0.928
  366   2HE2  GLN  54          2HE2      GLN  54  -8.989  14.757   2.309
  367   1HE2  GLN  54          1HE2      GLN  54  -7.721  15.850   2.584
  368    H    LEU  55           H        LEU  55 -10.199  13.577  -3.053
  369    HA   LEU  55           HA       LEU  55 -10.892  15.946  -4.438
  370   1HB   LEU  55          1HB       LEU  55 -10.086  13.145  -5.112
  371   2HB   LEU  55          2HB       LEU  55 -10.657  14.171  -6.429
  372    HG   LEU  55           HG       LEU  55  -8.624  15.254  -4.503
  373   1HD1  LEU  55          1HD1      LEU  55  -8.244  12.934  -6.175
  374   2HD1  LEU  55          2HD1      LEU  55  -7.260  14.267  -6.780
  375   3HD1  LEU  55          3HD1      LEU  55  -7.084  13.728  -5.110
  376   1HD2  LEU  55          1HD2      LEU  55  -9.704  16.713  -6.197
  377   2HD2  LEU  55          2HD2      LEU  55  -7.973  16.545  -6.493
  378   3HD2  LEU  55          3HD2      LEU  55  -9.128  15.640  -7.472
  379    H    ARG  56           H        ARG  56 -12.728  12.971  -3.926
  380    HA   ARG  56           HA       ARG  56 -14.739  13.247  -5.895
  381   1HB   ARG  56          1HB       ARG  56 -14.433  11.282  -4.473
  382   2HB   ARG  56          2HB       ARG  56 -14.840  12.225  -3.039
  383   1HG   ARG  56          1HG       ARG  56 -16.972  12.660  -4.804
  384   2HG   ARG  56          2HG       ARG  56 -16.613  10.939  -4.949
  385   1HD   ARG  56          1HD       ARG  56 -16.447  11.370  -2.210
  386   2HD   ARG  56          2HD       ARG  56 -17.816  12.386  -2.704
  387    HE   ARG  56           HE       ARG  56 -18.013   9.888  -4.066
  388   1HH1  ARG  56          1HH1      ARG  56 -17.209   9.295  -1.106
  389   2HH1  ARG  56          2HH1      ARG  56 -18.774   8.987  -0.432
  390   1HH2  ARG  56          1HH2      ARG  56 -20.492  10.341  -3.122
  391   2HH2  ARG  56          2HH2      ARG  56 -20.634   9.579  -1.573
  392    H    GLU  57           H        GLU  57 -14.827  14.412  -2.501
  393    HA   GLU  57           HA       GLU  57 -17.294  15.787  -2.619
  394   1HB   GLU  57          2HB       GLU  57 -14.762  16.540  -1.118
  395   2HB   GLU  57          1HB       GLU  57 -16.412  16.970  -0.663
  396   1HG   GLU  57          1HG       GLU  57 -16.822  14.384  -0.716
  397   2HG   GLU  57          2HG       GLU  57 -15.068  14.283  -0.571
  398    H    LEU  58           H        LEU  58 -14.006  16.977  -3.362
  399    HA   LEU  58           HA       LEU  58 -14.654  19.680  -3.926
  400   1HB   LEU  58          1HB       LEU  58 -12.573  17.747  -4.972
  401   2HB   LEU  58          2HB       LEU  58 -12.558  19.462  -5.383
  402    HG   LEU  58           HG       LEU  58 -12.484  18.328  -2.571
  403   1HD1  LEU  58          1HD1      LEU  58 -10.416  18.278  -4.261
  404   2HD1  LEU  58          2HD1      LEU  58 -10.293  19.968  -3.770
  405   3HD1  LEU  58          3HD1      LEU  58 -10.202  18.688  -2.559
  406   1HD2  LEU  58          1HD2      LEU  58 -13.051  20.981  -3.675
  407   2HD2  LEU  58          2HD2      LEU  58 -13.280  20.379  -2.033
  408   3HD2  LEU  58          3HD2      LEU  58 -11.705  20.996  -2.534
  409    H    PHE  59           H        PHE  59 -15.231  16.771  -5.780
  410    HA   PHE  59           HA       PHE  59 -15.435  17.736  -8.414
  411   1HB   PHE  59          1HB       PHE  59 -15.656  15.381  -7.619
  412   2HB   PHE  59          2HB       PHE  59 -17.245  15.777  -6.963
  413    HD1  PHE  59           HD1      PHE  59 -19.130  16.387  -8.474
  414    HD2  PHE  59           HD2      PHE  59 -15.302  15.102 -10.003
  415    HE1  PHE  59           HE1      PHE  59 -20.156  15.990 -10.711
  416    HE2  PHE  59           HE2      PHE  59 -16.328  14.705 -12.239
  417    HZ   PHE  59           HZ       PHE  59 -18.755  15.149 -12.593
  418    H    ILE  60           H        ILE  60 -17.796  17.955  -5.758
  419    HA   ILE  60           HA       ILE  60 -19.852  19.206  -7.412
  420    HB   ILE  60           HB       ILE  60 -19.439  18.911  -4.419
  421   1HG1  ILE  60          1HG1      ILE  60 -19.638  16.778  -5.643
  422   2HG1  ILE  60          2HG1      ILE  60 -21.081  17.072  -4.671
  423   1HG2  ILE  60          1HG2      ILE  60 -21.392  20.407  -5.956
  424   2HG2  ILE  60          2HG2      ILE  60 -22.175  19.124  -5.032
  425   3HG2  ILE  60          3HG2      ILE  60 -21.181  20.326  -4.207
  426   1HD1  ILE  60          1HD1      ILE  60 -21.745  18.310  -7.027
  427   2HD1  ILE  60          2HD1      ILE  60 -20.782  16.948  -7.602
  428   3HD1  ILE  60          3HD1      ILE  60 -22.207  16.663  -6.602
  429    H    ALA  61           H        ALA  61 -17.359  20.326  -5.138
  430    HA   ALA  61           HA       ALA  61 -18.184  23.053  -4.936
  431   1HB   ALA  61          1HB       ALA  61 -15.935  23.366  -4.082
  432   2HB   ALA  61          2HB       ALA  61 -16.491  21.777  -3.556
  433   3HB   ALA  61          3HB       ALA  61 -15.371  21.915  -4.912
  434    H    ALA  62           H        ALA  62 -16.581  21.292  -7.492
  435    HA   ALA  62           HA       ALA  62 -15.862  23.834  -8.887
  436   1HB   ALA  62          1HB       ALA  62 -14.743  21.201  -8.596
  437   2HB   ALA  62          3HB       ALA  62 -14.038  22.605  -9.397
  438   3HB   ALA  62          2HB       ALA  62 -15.065  21.495 -10.305
  439    H    SER  63           H        SER  63 -17.091  20.632  -9.938
  440    HA   SER  63           HA       SER  63 -19.000  22.083 -11.744
  441   1HB   SER  63          1HB       SER  63 -17.257  19.650 -12.045
  442   2HB   SER  63          2HB       SER  63 -18.701  19.817 -13.038
  443    HG   SER  63           HG       SER  63 -16.639  21.757 -12.781
  444    H    LEU   8           H        LEU   8  22.723 -26.562  -5.743
  445    HA   LEU   8           HA       LEU   8  21.627 -28.849  -7.051
  446   1HB   LEU   8          1HB       LEU   8  24.052 -27.715  -8.174
  447   2HB   LEU   8          2HB       LEU   8  24.338 -29.366  -7.623
  448    HG   LEU   8           HG       LEU   8  23.545 -29.335  -9.963
  449   1HD1  LEU   8          1HD1      LEU   8  22.129 -30.641  -7.734
  450   2HD1  LEU   8          2HD1      LEU   8  21.200 -30.575  -9.233
  451   3HD1  LEU   8          3HD1      LEU   8  22.788 -31.341  -9.212
  452   1HD2  LEU   8          1HD2      LEU   8  21.738 -27.376  -8.876
  453   2HD2  LEU   8          2HD2      LEU   8  21.984 -27.825 -10.563
  454   3HD2  LEU   8          3HD2      LEU   8  20.801 -28.692  -9.583
  455    H    GLU   9           H        GLU   9  21.621 -30.418  -5.483
  456    HA   GLU   9           HA       GLU   9  22.168 -31.543  -3.476
  457   1HB   GLU   9          1HB       GLU   9  24.180 -31.778  -5.162
  458   2HB   GLU   9          2HB       GLU   9  25.009 -30.721  -4.019
  459   1HG   GLU   9          1HG       GLU   9  24.537 -32.289  -2.191
  460   2HG   GLU   9          2HG       GLU   9  23.653 -33.338  -3.301
  461    HA   PRO  10           HA       PRO  10  22.602 -27.527  -1.219
  462   1HB   PRO  10          1HB       PRO  10  20.402 -27.870   0.372
  463   2HB   PRO  10          2HB       PRO  10  20.320 -27.149  -1.248
  464   1HG   PRO  10          2HG       PRO  10  19.650 -29.911  -0.370
  465   2HG   PRO  10          1HG       PRO  10  18.847 -28.879  -1.564
  466   1HD   PRO  10          1HD       PRO  10  20.542 -30.920  -2.217
  467   2HD   PRO  10          2HD       PRO  10  20.272 -29.494  -3.243
  468    H    ASP  11           H        ASP  11  21.433 -30.595   0.224
  469    HA   ASP  11           HA       ASP  11  22.219 -31.820   2.080
  470   1HB   ASP  11          1HB       ASP  11  24.465 -30.603   0.734
  471   2HB   ASP  11          2HB       ASP  11  24.780 -30.664   2.468
  472    H    ASN  12           H        ASN  12  24.085 -28.868   2.736
  473    HA   ASN  12           HA       ASN  12  22.245 -28.249   5.013
  474   1HB   ASN  12          1HB       ASN  12  24.308 -27.960   6.409
  475   2HB   ASN  12          2HB       ASN  12  24.095 -29.618   5.843
  476   2HD2  ASN  12          2HD2      ASN  12  25.869 -26.587   5.099
  477   1HD2  ASN  12          1HD2      ASN  12  27.157 -27.355   4.304
  478    H    VAL  13           H        VAL  13  22.882 -27.013   2.298
  479    HA   VAL  13           HA       VAL  13  24.418 -24.615   2.721
  480    HB   VAL  13           HB       VAL  13  22.541 -25.774   0.699
  481   1HG1  VAL  13          1HG1      VAL  13  23.263 -22.840   0.862
  482   2HG1  VAL  13          2HG1      VAL  13  22.885 -23.622  -0.673
  483   3HG1  VAL  13          3HG1      VAL  13  21.671 -23.556   0.606
  484   1HG2  VAL  13          1HG2      VAL  13  25.387 -25.014   0.980
  485   2HG2  VAL  13          2HG2      VAL  13  24.660 -26.365   0.110
  486   3HG2  VAL  13          3HG2      VAL  13  24.688 -24.760  -0.619
  487    HA   PRO  14           HA       PRO  14  20.252 -22.403   3.414
  488   1HB   PRO  14          1HB       PRO  14  17.957 -23.884   3.530
  489   2HB   PRO  14          2HB       PRO  14  18.605 -23.233   2.012
  490   1HG   PRO  14          2HG       PRO  14  18.768 -25.990   3.106
  491   2HG   PRO  14          1HG       PRO  14  18.566 -25.447   1.435
  492   1HD   PRO  14          1HD       PRO  14  20.938 -26.328   2.478
  493   2HD   PRO  14          2HD       PRO  14  20.800 -25.211   1.105
  494    H    MET  15           H        MET  15  20.006 -25.717   4.734
  495    HA   MET  15           HA       MET  15  19.771 -26.467   6.959
  496   1HB   MET  15          1HB       MET  15  21.934 -24.893   6.732
  497   2HB   MET  15          2HB       MET  15  21.021 -23.919   7.884
  498   1HG   MET  15          1HG       MET  15  20.717 -26.460   8.906
  499   2HG   MET  15          2HG       MET  15  22.363 -26.506   8.273
  500   1HE   MET  15          1HE       MET  15  21.249 -26.963  10.856
  501   2HE   MET  15          2HE       MET  15  22.608 -26.411  11.832
  502   3HE   MET  15          3HE       MET  15  21.030 -25.649  12.020
  503    H    ASP  16           H        ASP  16  19.536 -24.677   9.287
  504    HA   ASP  16           HA       ASP  16  16.932 -23.307   8.756
  505   1HB   ASP  16          1HB       ASP  16  17.496 -25.754  10.257
  506   2HB   ASP  16          2HB       ASP  16  16.658 -24.549  11.236
  507    H    MET  17           H        MET  17  19.319 -21.918   9.076
  508    HA   MET  17           HA       MET  17  20.176 -21.263  11.680
  509   1HB   MET  17          1HB       MET  17  20.875 -19.140  10.600
  510   2HB   MET  17          2HB       MET  17  21.217 -20.528   9.566
  511   1HG   MET  17          1HG       MET  17  19.018 -20.107   8.408
  512   2HG   MET  17          2HG       MET  17  18.878 -18.615   9.337
  513   1HE   MET  17          1HE       MET  17  20.254 -20.705   6.906
  514   2HE   MET  17          2HE       MET  17  20.193 -19.528   5.597
  515   3HE   MET  17          3HE       MET  17  21.750 -20.022   6.256
  516    H    SER  18           H        SER  18  17.412 -19.971   9.830
  517    HA   SER  18           HA       SER  18  16.644 -17.959  11.730
  518   1HB   SER  18          1HB       SER  18  14.838 -19.517   9.868
  519   2HB   SER  18          2HB       SER  18  14.668 -17.840  10.383
  520    HG   SER  18           HG       SER  18  15.855 -18.688   8.240
  521    HA   PRO  19           HA       PRO  19  14.613 -20.496  14.706
  522   1HB   PRO  19          1HB       PRO  19  12.931 -18.663  15.832
  523   2HB   PRO  19          2HB       PRO  19  14.686 -18.650  16.079
  524   1HG   PRO  19          1HG       PRO  19  13.013 -16.862  14.471
  525   2HG   PRO  19          2HG       PRO  19  14.619 -16.594  15.154
  526   1HD   PRO  19          1HD       PRO  19  13.955 -17.243  12.459
  527   2HD   PRO  19          2HD       PRO  19  15.573 -17.056  13.168
  528    H    LYS  20           H        LYS  20  13.248 -20.111  11.910
  529    HA   LYS  20           HA       LYS  20  11.300 -20.962  10.895
  530   1HB   LYS  20          1HB       LYS  20  11.849 -22.685  12.758
  531   2HB   LYS  20          2HB       LYS  20  10.509 -21.948  13.635
  532   1HG   LYS  20          1HG       LYS  20   9.996 -22.645  10.792
  533   2HG   LYS  20          2HG       LYS  20  10.168 -23.997  11.911
  534   1HD   LYS  20          1HD       LYS  20   8.560 -22.151  13.273
  535   2HD   LYS  20          2HD       LYS  20   7.957 -22.134  11.615
  536   1HE   LYS  20          1HE       LYS  20   8.077 -24.745  11.798
  537   2HE   LYS  20          2HE       LYS  20   8.083 -24.443  13.547
  538   1HZ   LYS  20          1HZ       LYS  20   6.181 -22.846  13.048
  539   2HZ   LYS  20          2HZ       LYS  20   6.056 -23.632  11.551
  540   3HZ   LYS  20          3HZ       LYS  20   5.830 -24.507  12.990
  541    H    ALA  21           H        ALA  21  10.133 -20.128  14.187
  542    HA   ALA  21           HA       ALA  21   7.629 -19.114  13.548
  543   1HB   ALA  21          1HB       ALA  21   9.642 -18.804  15.659
  544   2HB   ALA  21          3HB       ALA  21   7.901 -19.044  15.801
  545   3HB   ALA  21          2HB       ALA  21   8.550 -17.425  15.540
  546    H    LEU  22           H        LEU  22  10.684 -17.255  13.556
  547    HA   LEU  22           HA       LEU  22   9.381 -14.829  12.545
  548   1HB   LEU  22          1HB       LEU  22  12.196 -15.759  13.129
  549   2HB   LEU  22          2HB       LEU  22  11.899 -14.205  12.351
  550    HG   LEU  22           HG       LEU  22  10.363 -13.621  14.256
  551   1HD1  LEU  22          1HD1      LEU  22  11.285 -16.340  15.100
  552   2HD1  LEU  22          2HD1      LEU  22  10.997 -15.129  16.347
  553   3HD1  LEU  22          3HD1      LEU  22   9.694 -15.603  15.258
  554   1HD2  LEU  22          1HD2      LEU  22  13.300 -14.112  14.514
  555   2HD2  LEU  22          2HD2      LEU  22  12.409 -12.592  14.567
  556   3HD2  LEU  22          3HD2      LEU  22  12.420 -13.657  15.973
  557    H    GLN  23           H        GLN  23  11.551 -17.339  11.297
  558    HA   GLN  23           HA       GLN  23  12.043 -16.386   8.698
  559   1HB   GLN  23          1HB       GLN  23  12.858 -18.482   9.956
  560   2HB   GLN  23          2HB       GLN  23  11.387 -19.260   9.372
  561   1HG   GLN  23          1HG       GLN  23  12.047 -18.630   7.037
  562   2HG   GLN  23          2HG       GLN  23  13.574 -18.023   7.677
  563   2HE2  GLN  23          2HE2      GLN  23  11.592 -21.030   8.046
  564   1HE2  GLN  23          1HE2      GLN  23  12.915 -22.086   7.916
  565    H    GLN  24           H        GLN  24   9.333 -18.523   9.694
  566    HA   GLN  24           HA       GLN  24   8.001 -18.376   7.129
  567   1HB   GLN  24          1HB       GLN  24   7.824 -20.174   8.896
  568   2HB   GLN  24          2HB       GLN  24   6.880 -19.046   9.867
  569   1HG   GLN  24          1HG       GLN  24   5.917 -19.229   7.110
  570   2HG   GLN  24          2HG       GLN  24   5.854 -20.777   7.954
  571   2HE2  GLN  24          2HE2      GLN  24   3.835 -18.355   7.271
  572   1HE2  GLN  24          1HE2      GLN  24   2.935 -18.258   8.707
  573    H    LYS  25           H        LYS  25   7.772 -16.541  10.149
  574    HA   LYS  25           HA       LYS  25   5.340 -15.126   9.526
  575   1HB   LYS  25          1HB       LYS  25   7.657 -14.892  11.409
  576   2HB   LYS  25          2HB       LYS  25   6.580 -13.504  11.247
  577   1HG   LYS  25          1HG       LYS  25   4.660 -14.828  11.865
  578   2HG   LYS  25          2HG       LYS  25   5.605 -16.316  11.809
  579   1HD   LYS  25          1HD       LYS  25   6.315 -16.020  13.925
  580   2HD   LYS  25          2HD       LYS  25   6.867 -14.385  13.558
  581   1HE   LYS  25          1HE       LYS  25   3.974 -14.437  13.646
  582   2HE   LYS  25          2HE       LYS  25   4.648 -15.086  15.155
  583   1HZ   LYS  25          1HZ       LYS  25   5.745 -12.654  13.877
  584   2HZ   LYS  25          2HZ       LYS  25   4.455 -12.570  14.981
  585   3HZ   LYS  25          3HZ       LYS  25   5.959 -13.192  15.471
  586    H    ILE  26           H        ILE  26   8.782 -14.140   9.287
  587    HA   ILE  26           HA       ILE  26   8.343 -11.596   8.092
  588    HB   ILE  26           HB       ILE  26  10.610 -13.599   7.837
  589   1HG1  ILE  26          1HG1      ILE  26  10.377 -11.174   9.637
  590   2HG1  ILE  26          2HG1      ILE  26   9.915 -12.796  10.153
  591   1HG2  ILE  26          1HG2      ILE  26  10.535 -11.730   6.102
  592   2HG2  ILE  26          2HG2      ILE  26  10.729 -10.600   7.442
  593   3HG2  ILE  26          3HG2      ILE  26  11.989 -11.785   7.098
  594   1HD1  ILE  26          1HD1      ILE  26  12.621 -12.347   8.930
  595   2HD1  ILE  26          2HD1      ILE  26  12.352 -11.940  10.625
  596   3HD1  ILE  26          3HD1      ILE  26  12.107 -13.595  10.066
  597    H    HIS  27           H        HIS  27   9.105 -14.729   6.519
  598    HA   HIS  27           HA       HIS  27   8.910 -13.797   3.826
  599   1HB   HIS  27          1HB       HIS  27   9.754 -16.026   4.988
  600   2HB   HIS  27          2HB       HIS  27   8.111 -16.570   4.650
  601    HD1  HIS  27           HD1      HIS  27   8.568 -18.119   2.690
  602    HD2  HIS  27           HD2      HIS  27  10.228 -14.333   2.151
  603    HE1  HIS  27           HE1      HIS  27   9.396 -18.034   0.298
  604    H    GLU  28           H        GLU  28   6.460 -14.956   6.106
  605    HA   GLU  28           HA       GLU  28   4.331 -15.067   4.099
  606   1HB   GLU  28          1HB       GLU  28   4.497 -16.484   6.158
  607   2HB   GLU  28          2HB       GLU  28   4.243 -15.037   7.134
  608   1HG   GLU  28          2HG       GLU  28   2.077 -15.943   6.949
  609   2HG   GLU  28          1HG       GLU  28   2.107 -14.705   5.692
  610    H    LEU  29           H        LEU  29   5.320 -12.815   6.684
  611    HA   LEU  29           HA       LEU  29   3.096 -10.998   6.331
  612   1HB   LEU  29          1HB       LEU  29   5.840 -10.875   7.595
  613   2HB   LEU  29          2HB       LEU  29   4.743  -9.495   7.630
  614    HG   LEU  29           HG       LEU  29   3.845 -12.229   8.534
  615   1HD1  LEU  29          1HD1      LEU  29   5.908 -11.484   9.794
  616   2HD1  LEU  29          2HD1      LEU  29   4.998 -10.066  10.315
  617   3HD1  LEU  29          3HD1      LEU  29   4.471 -11.678  10.797
  618   1HD2  LEU  29          1HD2      LEU  29   2.806  -9.463   8.509
  619   2HD2  LEU  29          2HD2      LEU  29   1.929 -10.993   8.542
  620   3HD2  LEU  29          3HD2      LEU  29   2.578 -10.316  10.036
  621    H    GLU  30           H        GLU  30   6.356 -11.213   4.947
  622    HA   GLU  30           HA       GLU  30   6.476  -8.641   3.721
  623   1HB   GLU  30          1HB       GLU  30   8.283 -10.409   4.053
  624   2HB   GLU  30          2HB       GLU  30   7.600 -11.247   2.659
  625   1HG   GLU  30          1HG       GLU  30   7.825  -8.652   1.743
  626   2HG   GLU  30          2HG       GLU  30   9.261  -8.828   2.753
  627    H    GLY  31           H        GLY  31   5.174 -11.744   2.524
  628   1HA   GLY  31          2HA       GLY  31   4.017 -12.205   0.510
  629   2HA   GLY  31          1HA       GLY  31   4.408 -10.578  -0.046
  630    H    LEU  32           H        LEU  32   2.961 -10.957   3.091
  631    HA   LEU  32           HA       LEU  32   0.191 -10.862   2.365
  632   1HB   LEU  32          1HB       LEU  32   1.516 -11.293   4.613
  633   2HB   LEU  32          2HB       LEU  32   1.303  -9.555   4.830
  634    HG   LEU  32           HG       LEU  32  -1.192 -10.023   4.242
  635   1HD1  LEU  32          1HD1      LEU  32  -0.027 -12.742   4.572
  636   2HD1  LEU  32          2HD1      LEU  32  -1.590 -12.457   5.336
  637   3HD1  LEU  32          3HD1      LEU  32  -1.402 -12.219   3.599
  638   1HD2  LEU  32          1HD2      LEU  32   0.339 -10.251   6.721
  639   2HD2  LEU  32          2HD2      LEU  32  -1.194  -9.429   6.425
  640   3HD2  LEU  32          3HD2      LEU  32  -1.175 -11.154   6.792
  641    H    MET  33           H        MET  33   2.677  -8.417   2.412
  642    HA   MET  33           HA       MET  33   1.038  -6.078   2.700
  643   1HB   MET  33          1HB       MET  33   3.738  -6.776   1.582
  644   2HB   MET  33          2HB       MET  33   3.102  -5.149   1.337
  645   1HG   MET  33          1HG       MET  33   3.406  -4.582   3.510
  646   2HG   MET  33          2HG       MET  33   2.774  -6.124   4.087
  647   1HE   MET  33          1HE       MET  33   5.691  -3.984   3.059
  648   2HE   MET  33          2HE       MET  33   7.061  -5.076   2.858
  649   3HE   MET  33          3HE       MET  33   5.743  -5.101   1.687
  650    H    MET  34           H        MET  34   2.428  -7.526  -0.281
  651    HA   MET  34           HA       MET  34   1.155  -5.904  -2.186
  652   1HB   MET  34          1HB       MET  34   2.777  -8.117  -2.139
  653   2HB   MET  34          2HB       MET  34   1.288  -8.790  -2.804
  654   1HG   MET  34          1HG       MET  34   1.994  -7.969  -4.792
  655   2HG   MET  34          2HG       MET  34   1.533  -6.389  -4.160
  656   1HE   MET  34          1HE       MET  34   2.710  -4.824  -3.217
  657   2HE   MET  34          2HE       MET  34   3.860  -5.432  -2.029
  658   3HE   MET  34          3HE       MET  34   4.437  -4.485  -3.398
  659    H    GLN  35           H        GLN  35  -0.141  -8.684  -0.408
  660    HA   GLN  35           HA       GLN  35  -2.538  -9.086  -1.893
  661   1HB   GLN  35          1HB       GLN  35  -1.671 -10.639  -0.224
  662   2HB   GLN  35          2HB       GLN  35  -1.853  -9.429   1.045
  663   1HG   GLN  35          2HG       GLN  35  -3.899 -10.317   1.409
  664   2HG   GLN  35          1HG       GLN  35  -4.383  -9.548  -0.103
  665   2HE2  GLN  35          2HE2      GLN  35  -2.689 -12.557   0.970
  666   1HE2  GLN  35          1HE2      GLN  35  -3.413 -13.552  -0.198
  667    H    HIS  36           H        HIS  36  -2.542  -7.644   1.371
  668    HA   HIS  36           HA       HIS  36  -5.007  -6.322   1.183
  669   1HB   HIS  36          1HB       HIS  36  -2.448  -5.701   2.679
  670   2HB   HIS  36          2HB       HIS  36  -3.968  -4.866   3.000
  671    HD1  HIS  36           HD1      HIS  36  -6.060  -6.864   3.175
  672    HD2  HIS  36           HD2      HIS  36  -2.201  -7.791   4.449
  673    HE1  HIS  36           HE1      HIS  36  -6.278  -8.842   4.742
  674    H    ALA  37           H        ALA  37  -1.766  -4.999   0.389
  675    HA   ALA  37           HA       ALA  37  -2.490  -2.359  -0.310
  676   1HB   ALA  37          1HB       ALA  37  -0.189  -3.128  -0.169
  677   2HB   ALA  37          3HB       ALA  37  -0.452  -4.304  -1.456
  678   3HB   ALA  37          2HB       ALA  37  -0.463  -2.578  -1.821
  679    H    GLN  38           H        GLN  38  -2.654  -5.372  -2.213
  680    HA   GLN  38           HA       GLN  38  -3.486  -4.173  -4.699
  681   1HB   GLN  38          1HB       GLN  38  -3.239  -6.827  -3.433
  682   2HB   GLN  38          2HB       GLN  38  -4.514  -6.734  -4.649
  683   1HG   GLN  38          1HG       GLN  38  -3.028  -6.236  -6.368
  684   2HG   GLN  38          2HG       GLN  38  -1.822  -5.566  -5.269
  685   2HE2  GLN  38          2HE2      GLN  38  -0.704  -7.334  -6.948
  686   1HE2  GLN  38          1HE2      GLN  38  -0.465  -8.852  -6.230
  687    H    ASN  39           H        ASN  39  -5.193  -5.304  -1.818
  688    HA   ASN  39           HA       ASN  39  -7.855  -4.873  -3.010
  689   1HB   ASN  39          1HB       ASN  39  -6.883  -5.534  -0.208
  690   2HB   ASN  39          2HB       ASN  39  -8.569  -5.573  -0.724
  691   2HD2  ASN  39          2HD2      ASN  39  -8.274  -7.974  -0.043
  692   1HD2  ASN  39          1HD2      ASN  39  -7.691  -9.044  -1.225
  693    H    LEU  40           H        LEU  40  -5.541  -2.773  -2.090
  694    HA   LEU  40           HA       LEU  40  -5.558  -0.521  -1.499
  695   1HB   LEU  40          1HB       LEU  40  -8.084  -1.151  -2.669
  696   2HB   LEU  40          2HB       LEU  40  -8.375  -0.040  -1.329
  697    HG   LEU  40           HG       LEU  40  -6.127   0.512  -3.241
  698   1HD1  LEU  40          1HD1      LEU  40  -8.494   0.057  -4.359
  699   2HD1  LEU  40          2HD1      LEU  40  -8.842   1.674  -3.750
  700   3HD1  LEU  40          3HD1      LEU  40  -7.505   1.424  -4.872
  701   1HD2  LEU  40          1HD2      LEU  40  -7.383   1.788  -1.007
  702   2HD2  LEU  40          2HD2      LEU  40  -6.023   2.368  -1.970
  703   3HD2  LEU  40          3HD2      LEU  40  -7.672   2.781  -2.437
  704    H    GLU  41           H        GLU  41  -6.122  -2.834   0.526
  705    HA   GLU  41           HA       GLU  41  -7.644  -1.687   2.692
  706   1HB   GLU  41          1HB       GLU  41  -5.467  -3.776   2.427
  707   2HB   GLU  41          2HB       GLU  41  -6.184  -3.388   3.991
  708   1HG   GLU  41          1HG       GLU  41  -7.875  -4.109   1.594
  709   2HG   GLU  41          2HG       GLU  41  -7.246  -5.335   2.697
  710    H    PHE  42           H        PHE  42  -4.161  -1.892   2.029
  711    HA   PHE  42           HA       PHE  42  -2.363  -0.532   2.619
  712   1HB   PHE  42          1HB       PHE  42  -4.759   1.208   2.485
  713   2HB   PHE  42          2HB       PHE  42  -3.365   1.898   3.313
  714    HD1  PHE  42           HD1      PHE  42  -1.079   0.754   1.887
  715    HD2  PHE  42           HD2      PHE  42  -4.848   2.186   0.343
  716    HE1  PHE  42           HE1      PHE  42   0.000   1.226  -0.310
  717    HE2  PHE  42           HE2      PHE  42  -3.767   2.659  -1.854
  718    HZ   PHE  42           HZ       PHE  42  -1.342   2.181  -2.174
  719    H    GLU  43           H        GLU  43  -4.973   0.279   4.971
  720    HA   GLU  43           HA       GLU  43  -3.409   0.948   7.171
  721   1HB   GLU  43          1HB       GLU  43  -5.842   1.031   7.145
  722   2HB   GLU  43          2HB       GLU  43  -5.938  -0.722   6.984
  723   1HG   GLU  43          1HG       GLU  43  -4.644  -0.836   9.198
  724   2HG   GLU  43          2HG       GLU  43  -5.015   0.881   9.373
  725    H    GLU  44           H        GLU  44  -4.641  -2.347   6.559
  726    HA   GLU  44           HA       GLU  44  -2.684  -3.522   8.398
  727   1HB   GLU  44          2HB       GLU  44  -3.861  -5.585   7.823
  728   2HB   GLU  44          1HB       GLU  44  -5.043  -4.304   8.080
  729   1HG   GLU  44          1HG       GLU  44  -5.213  -3.945   5.654
  730   2HG   GLU  44          2HG       GLU  44  -3.991  -5.185   5.374
  731    H    ALA  45           H        ALA  45  -2.825  -2.786   4.991
  732    HA   ALA  45           HA       ALA  45  -0.913  -4.841   4.165
  733   1HB   ALA  45          1HB       ALA  45  -1.369  -2.416   2.529
  734   2HB   ALA  45          2HB       ALA  45  -2.821  -3.317   2.964
  735   3HB   ALA  45          3HB       ALA  45  -1.518  -4.114   2.083
  736    H    ALA  46           H        ALA  46  -0.746  -1.273   4.471
  737    HA   ALA  46           HA       ALA  46   2.132  -1.287   3.978
  738   1HB   ALA  46          1HB       ALA  46   1.864   1.042   3.943
  739   2HB   ALA  46          3HB       ALA  46   0.282   0.457   3.426
  740   3HB   ALA  46          2HB       ALA  46   0.522   0.999   5.089
  741    H    GLN  47           H        GLN  47   0.121  -1.550   6.808
  742    HA   GLN  47           HA       GLN  47   2.012  -0.485   8.724
  743   1HB   GLN  47          1HB       GLN  47  -0.453  -2.186   8.727
  744   2HB   GLN  47          2HB       GLN  47   0.525  -2.141  10.192
  745   1HG   GLN  47          1HG       GLN  47  -0.099   0.466   8.879
  746   2HG   GLN  47          2HG       GLN  47  -1.404  -0.342   9.747
  747   2HE2  GLN  47          2HE2      GLN  47   2.024  -0.609  10.680
  748   1HE2  GLN  47          1HE2      GLN  47   1.860   0.226  12.147
  749    H    ILE  48           H        ILE  48   1.780  -3.490   6.977
  750    HA   ILE  48           HA       ILE  48   3.222  -5.183   8.809
  751    HB   ILE  48           HB       ILE  48   2.860  -5.202   5.796
  752   1HG1  ILE  48          1HG1      ILE  48   1.445  -6.863   7.892
  753   2HG1  ILE  48          2HG1      ILE  48   0.826  -5.298   7.363
  754   1HG2  ILE  48          1HG2      ILE  48   4.782  -6.593   6.521
  755   2HG2  ILE  48          2HG2      ILE  48   3.732  -7.429   7.664
  756   3HG2  ILE  48          3HG2      ILE  48   3.449  -7.586   5.931
  757   1HD1  ILE  48          1HD1      ILE  48   1.539  -7.443   5.366
  758   2HD1  ILE  48          2HD1      ILE  48  -0.046  -7.408   6.139
  759   3HD1  ILE  48          3HD1      ILE  48   0.483  -6.047   5.150
  760    H    ARG  49           H        ARG  49   4.254  -2.797   6.425
  761    HA   ARG  49           HA       ARG  49   6.913  -3.590   5.943
  762   1HB   ARG  49          2HB       ARG  49   7.269  -1.215   5.465
  763   2HB   ARG  49          1HB       ARG  49   5.661  -1.684   4.915
  764   1HG   ARG  49          2HG       ARG  49   5.026   0.174   6.088
  765   2HG   ARG  49          1HG       ARG  49   5.082  -0.938   7.455
  766   1HD   ARG  49          1HD       ARG  49   7.583  -0.262   7.650
  767   2HD   ARG  49          2HD       ARG  49   7.133   1.117   6.626
  768    HE   ARG  49           HE       ARG  49   5.316   0.652   8.882
  769   1HH1  ARG  49          1HH1      ARG  49   8.513   1.675   8.467
  770   2HH1  ARG  49          2HH1      ARG  49   8.307   3.191   9.278
  771   1HH2  ARG  49          1HH2      ARG  49   4.871   2.852   9.604
  772   2HH2  ARG  49          2HH2      ARG  49   6.245   3.858   9.922
  773    H    ASP  50           H        ASP  50   5.483  -2.234   8.848
  774    HA   ASP  50           HA       ASP  50   8.036  -1.556  10.108
  775   1HB   ASP  50          1HB       ASP  50   5.376  -0.896  10.421
  776   2HB   ASP  50          2HB       ASP  50   5.651  -1.980  11.785
  777    H    GLN  51           H        GLN  51   5.732  -4.260  10.211
  778    HA   GLN  51           HA       GLN  51   7.069  -5.659  12.381
  779   1HB   GLN  51          2HB       GLN  51   5.172  -6.619  10.212
  780   2HB   GLN  51          1HB       GLN  51   5.505  -7.446  11.734
  781   1HG   GLN  51          1HG       GLN  51   4.531  -5.648  13.010
  782   2HG   GLN  51          2HG       GLN  51   4.390  -4.634  11.573
  783   2HE2  GLN  51          2HE2      GLN  51   3.508  -8.084  12.188
  784   1HE2  GLN  51          1HE2      GLN  51   1.901  -7.914  11.669
  785    H    LEU  52           H        LEU  52   7.294  -5.679   8.850
  786    HA   LEU  52           HA       LEU  52   8.887  -8.074   8.611
  787   1HB   LEU  52          1HB       LEU  52   7.722  -6.027   6.985
  788   2HB   LEU  52          2HB       LEU  52   9.421  -6.174   6.534
  789    HG   LEU  52           HG       LEU  52   8.006  -7.722   5.222
  790   1HD1  LEU  52          1HD1      LEU  52  10.005  -8.804   7.194
  791   2HD1  LEU  52          2HD1      LEU  52   9.208  -9.889   6.055
  792   3HD1  LEU  52          3HD1      LEU  52  10.188  -8.549   5.459
  793   1HD2  LEU  52          1HD2      LEU  52   6.912  -8.232   7.876
  794   2HD2  LEU  52          2HD2      LEU  52   6.234  -8.624   6.297
  795   3HD2  LEU  52          3HD2      LEU  52   7.374  -9.729   7.067
  796    H    HIS  53           H        HIS  53   9.778  -4.598   8.555
  797    HA   HIS  53           HA       HIS  53  12.622  -5.067   8.487
  798   1HB   HIS  53          1HB       HIS  53  10.782  -2.771   9.156
  799   2HB   HIS  53          2HB       HIS  53  12.530  -2.597   9.317
  800    HD1  HIS  53           HD1      HIS  53  13.489  -4.176   6.877
  801    HD2  HIS  53           HD2      HIS  53  10.310  -1.483   6.737
  802    HE1  HIS  53           HE1      HIS  53  13.263  -3.460   4.458
  803    H    GLN  54           H        GLN  54  10.294  -4.532  11.122
  804    HA   GLN  54           HA       GLN  54  12.263  -4.349  13.232
  805   1HB   GLN  54          1HB       GLN  54   9.864  -3.544  13.229
  806   2HB   GLN  54          2HB       GLN  54   9.364  -5.231  13.357
  807   1HG   GLN  54          1HG       GLN  54  10.490  -5.482  15.474
  808   2HG   GLN  54          2HG       GLN  54  11.250  -3.898  15.316
  809   2HE2  GLN  54          2HE2      GLN  54   9.218  -2.203  14.625
  810   1HE2  GLN  54          1HE2      GLN  54   7.974  -2.229  15.779
  811    H    LEU  55           H        LEU  55  10.283  -7.025  11.939
  812    HA   LEU  55           HA       LEU  55  10.983  -9.040  13.798
  813   1HB   LEU  55          1HB       LEU  55  10.114  -8.873  10.940
  814   2HB   LEU  55          2HB       LEU  55  10.671 -10.437  11.535
  815    HG   LEU  55           HG       LEU  55   8.703  -8.865  13.167
  816   1HD1  LEU  55          1HD1      LEU  55   8.245  -9.798  10.476
  817   2HD1  LEU  55          2HD1      LEU  55   7.270 -10.742  11.604
  818   3HD1  LEU  55          3HD1      LEU  55   7.124  -8.984  11.567
  819   1HD2  LEU  55          1HD2      LEU  55   9.767 -10.924  14.058
  820   2HD2  LEU  55          2HD2      LEU  55   8.028 -11.130  13.851
  821   3HD2  LEU  55          3HD2      LEU  55   9.144 -11.829  12.678
  822    H    ARG  56           H        ARG  56  12.779  -7.732  11.052
  823    HA   ARG  56           HA       ARG  56  14.749  -9.734  10.708
  824   1HB   ARG  56          1HB       ARG  56  14.443  -7.803   9.238
  825   2HB   ARG  56          2HB       ARG  56  14.899  -6.706  10.542
  826   1HG   ARG  56          1HG       ARG  56  16.997  -8.559  10.407
  827   2HG   ARG  56          2HG       ARG  56  16.605  -8.201   8.725
  828   1HD   ARG  56          1HD       ARG  56  16.510  -5.696   9.922
  829   2HD   ARG  56          2HD       ARG  56  17.885  -6.483  10.724
  830    HE   ARG  56           HE       ARG  56  18.009  -7.078   7.936
  831   1HH1  ARG  56          1HH1      ARG  56  17.264  -4.059   8.231
  832   2HH1  ARG  56          2HH1      ARG  56  18.839  -3.352   8.092
  833   1HH2  ARG  56          1HH2      ARG  56  20.516  -6.346   8.584
  834   2HH2  ARG  56          2HH2      ARG  56  20.680  -4.647   8.293
  835    H    GLU  57           H        GLU  57  14.935  -6.815  12.792
  836    HA   GLU  57           HA       GLU  57  17.421  -7.364  14.018
  837   1HB   GLU  57          2HB       GLU  57  14.939  -6.097  15.226
  838   2HB   GLU  57          1HB       GLU  57  16.605  -5.812  15.731
  839   1HG   GLU  57          1HG       GLU  57  16.972  -5.132  13.228
  840   2HG   GLU  57          2HG       GLU  57  15.219  -4.933  13.212
  841    H    LEU  58           H        LEU  58  14.138  -8.359  15.022
  842    HA   LEU  58           HA       LEU  58  14.819  -9.681  17.436
  843   1HB   LEU  58          1HB       LEU  58  12.681 -10.097  15.332
  844   2HB   LEU  58          2HB       LEU  58  12.686 -10.980  16.860
  845    HG   LEU  58           HG       LEU  58  12.658  -7.960  16.576
  846   1HD1  LEU  58          1HD1      LEU  58  10.550  -9.529  16.094
  847   2HD1  LEU  58          2HD1      LEU  58  10.467  -9.539  17.855
  848   3HD1  LEU  58          3HD1      LEU  58  10.384  -8.012  16.978
  849   1HD2  LEU  58          1HD2      LEU  58  13.242  -9.785  18.790
  850   2HD2  LEU  58          2HD2      LEU  58  13.500  -8.043  18.677
  851   3HD2  LEU  58          3HD2      LEU  58  11.925  -8.673  19.161
  852    H    PHE  59           H        PHE  59  15.303 -10.638  14.106
  853    HA   PHE  59           HA       PHE  59  15.461 -13.441  14.276
  854   1HB   PHE  59          1HB       PHE  59  15.662 -12.011  12.241
  855   2HB   PHE  59          2HB       PHE  59  17.271 -11.523  12.771
  856    HD1  PHE  59           HD1      PHE  59  19.130 -13.178  12.882
  857    HD2  PHE  59           HD2      PHE  59  15.247 -14.209  11.302
  858    HE1  PHE  59           HE1      PHE  59  20.098 -15.226  11.840
  859    HE2  PHE  59           HE2      PHE  59  16.215 -16.255  10.259
  860    HZ   PHE  59           HZ       PHE  59  18.641 -16.764  10.529
  861    H    ILE  60           H        ILE  60  17.887 -10.999  15.189
  862    HA   ILE  60           HA       ILE  60  19.925 -12.978  15.870
  863    HB   ILE  60           HB       ILE  60  19.576 -10.018  16.450
  864   1HG1  ILE  60          2HG1      ILE  60  19.711 -10.585  14.053
  865   2HG1  ILE  60          1HG1      ILE  60  21.181  -9.764  14.579
  866   1HG2  ILE  60          1HG2      ILE  60  21.518 -11.953  17.400
  867   2HG2  ILE  60          2HG2      ILE  60  22.300 -10.715  16.418
  868   3HG2  ILE  60          3HG2      ILE  60  21.346 -10.250  17.826
  869   1HD1  ILE  60          1HD1      ILE  60  21.811 -12.386  15.078
  870   2HD1  ILE  60          2HD1      ILE  60  20.813 -12.531  13.631
  871   3HD1  ILE  60          3HD1      ILE  60  22.256 -11.517  13.609
  872    H    ALA  61           H        ALA  61  17.505 -11.074  17.648
  873    HA   ALA  61           HA       ALA  61  18.379 -11.675  20.299
  874   1HB   ALA  61          1HB       ALA  61  16.698  -9.958  19.509
  875   2HB   ALA  61          3HB       ALA  61  15.550 -11.277  19.281
  876   3HB   ALA  61          2HB       ALA  61  16.157 -10.906  20.895
  877    H    ALA  62           H        ALA  62  16.689 -13.593  17.920
  878    HA   ALA  62           HA       ALA  62  15.981 -15.643  19.974
  879   1HB   ALA  62          1HB       ALA  62  15.111 -16.320  17.347
  880   2HB   ALA  62          3HB       ALA  62  14.825 -14.592  17.560
  881   3HB   ALA  62          2HB       ALA  62  14.125 -15.750  18.693
  882    H    SER  63           H        SER  63  17.130 -15.757  16.578
  883    HA   SER  63           HA       SER  63  19.021 -17.936  17.411
  884   1HB   SER  63          1HB       SER  63  17.231 -17.498  15.032
  885   2HB   SER  63          2HB       SER  63  18.655 -18.523  14.878
  886    HG   SER  63           HG       SER  63  16.632 -18.795  16.855

  No H/Q in entry =         886
  Start of MODEL    5
    1    H    LEU   8           H        LEU   8  -9.876  15.752 -36.629
    2    HA   LEU   8           HA       LEU   8 -12.099  14.042 -35.876
    3   1HB   LEU   8          1HB       LEU   8  -9.291  13.110 -35.704
    4   2HB   LEU   8          2HB       LEU   8 -10.257  12.844 -34.253
    5    HG   LEU   8           HG       LEU   8 -12.053  11.902 -35.857
    6   1HD1  LEU   8          1HD1      LEU   8  -9.589  11.887 -37.622
    7   2HD1  LEU   8          2HD1      LEU   8 -11.023  10.908 -37.935
    8   3HD1  LEU   8          3HD1      LEU   8 -11.134  12.669 -37.959
    9   1HD2  LEU   8          1HD2      LEU   8  -9.411  10.561 -35.254
   10   2HD2  LEU   8          2HD2      LEU   8 -10.939  10.391 -34.392
   11   3HD2  LEU   8          3HD2      LEU   8 -10.749   9.687 -35.997
   12    H    GLU   9           H        GLU   9 -12.914  14.728 -33.882
   13    HA   GLU   9           HA       GLU   9 -11.289  16.013 -31.850
   14   1HB   GLU   9          1HB       GLU   9 -11.682  17.593 -33.983
   15   2HB   GLU   9          2HB       GLU   9 -13.197  17.919 -33.138
   16   1HG   GLU   9          1HG       GLU   9 -11.903  18.467 -31.084
   17   2HG   GLU   9          2HG       GLU   9 -10.407  18.221 -31.987
   18    HA   PRO  10           HA       PRO  10 -15.661  14.601 -30.846
   19   1HB   PRO  10          1HB       PRO  10 -14.993  12.478 -29.254
   20   2HB   PRO  10          2HB       PRO  10 -15.233  12.332 -31.007
   21   1HG   PRO  10          2HG       PRO  10 -12.704  12.498 -29.453
   22   2HG   PRO  10          1HG       PRO  10 -13.088  11.530 -30.883
   23   1HD   PRO  10          1HD       PRO  10 -11.639  13.844 -30.966
   24   2HD   PRO  10          2HD       PRO  10 -12.608  13.237 -32.327
   25    H    ASP  11           H        ASP  11 -12.813  14.351 -28.693
   26    HA   ASP  11           HA       ASP  11 -12.409  15.238 -26.550
   27   1HB   ASP  11          1HB       ASP  11 -14.215  17.155 -27.971
   28   2HB   ASP  11          2HB       ASP  11 -13.919  17.422 -26.253
   29    H    ASN  12           H        ASN  12 -15.796  16.263 -26.621
   30    HA   ASN  12           HA       ASN  12 -16.451  14.107 -24.647
   31   1HB   ASN  12          2HB       ASN  12 -17.536  15.823 -23.262
   32   2HB   ASN  12          1HB       ASN  12 -15.853  16.263 -23.545
   33   2HD2  ASN  12          2HD2      ASN  12 -15.432  17.985 -25.175
   34   1HD2  ASN  12          1HD2      ASN  12 -16.654  19.091 -25.576
   35    H    VAL  13           H        VAL  13 -17.149  14.098 -27.425
   36    HA   VAL  13           HA       VAL  13 -19.829  15.168 -27.767
   37    HB   VAL  13           HB       VAL  13 -18.094  14.828 -29.549
   38   1HG1  VAL  13          1HG1      VAL  13 -18.758  11.935 -28.980
   39   2HG1  VAL  13          2HG1      VAL  13 -18.112  12.456 -30.535
   40   3HG1  VAL  13          3HG1      VAL  13 -17.170  12.695 -29.065
   41   1HG2  VAL  13          1HG2      VAL  13 -20.810  13.525 -29.860
   42   2HG2  VAL  13          2HG2      VAL  13 -20.381  15.198 -30.215
   43   3HG2  VAL  13          3HG2      VAL  13 -19.747  13.893 -31.217
   44    HA   PRO  14           HA       PRO  14 -21.134  10.679 -26.978
   45   1HB   PRO  14          1HB       PRO  14 -19.595   9.137 -25.334
   46   2HB   PRO  14          2HB       PRO  14 -19.357   9.202 -27.091
   47   1HG   PRO  14          2HG       PRO  14 -17.742  10.369 -24.934
   48   2HG   PRO  14          1HG       PRO  14 -17.278   9.918 -26.579
   49   1HD   PRO  14          1HD       PRO  14 -17.831  12.519 -25.598
   50   2HD   PRO  14          2HD       PRO  14 -17.514  12.043 -27.274
   51    H    MET  15           H        MET  15 -19.151  11.483 -24.097
   52    HA   MET  15           HA       MET  15 -21.340  12.610 -22.604
   53   1HB   MET  15          1HB       MET  15 -21.634  10.654 -21.059
   54   2HB   MET  15          2HB       MET  15 -22.154  10.309 -22.709
   55   1HG   MET  15          1HG       MET  15 -20.266   8.990 -23.164
   56   2HG   MET  15          2HG       MET  15 -19.333   9.704 -21.848
   57   1HE   MET  15          1HE       MET  15 -20.478   7.005 -23.178
   58   2HE   MET  15          2HE       MET  15 -20.754   5.805 -21.918
   59   3HE   MET  15          3HE       MET  15 -22.114   6.710 -22.598
   60    H    ASP  16           H        ASP  16 -20.687  12.864 -20.236
   61    HA   ASP  16           HA       ASP  16 -17.964  12.282 -19.419
   62   1HB   ASP  16          1HB       ASP  16 -18.516  14.581 -21.083
   63   2HB   ASP  16          2HB       ASP  16 -17.926  15.112 -19.509
   64    H    MET  17           H        MET  17 -19.638  11.616 -17.708
   65    HA   MET  17           HA       MET  17 -21.175  13.472 -16.207
   66   1HB   MET  17          1HB       MET  17 -21.052  11.685 -14.477
   67   2HB   MET  17          2HB       MET  17 -21.359  11.023 -16.084
   68   1HG   MET  17          1HG       MET  17 -19.068  10.352 -16.339
   69   2HG   MET  17          2HG       MET  17 -18.582  11.249 -14.900
   70   1HE   MET  17          1HE       MET  17 -18.936   8.076 -16.288
   71   2HE   MET  17          2HE       MET  17 -17.641   8.316 -15.116
   72   3HE   MET  17          3HE       MET  17 -18.848   7.048 -14.860
   73    H    SER  18           H        SER  18 -17.728  12.775 -16.152
   74    HA   SER  18           HA       SER  18 -17.360  14.359 -13.662
   75   1HB   SER  18          1HB       SER  18 -15.138  13.166 -15.282
   76   2HB   SER  18          2HB       SER  18 -15.311  13.271 -13.533
   77    HG   SER  18           HG       SER  18 -16.176  11.351 -15.293
   78    HA   PRO  19           HA       PRO  19 -15.990  17.858 -15.952
   79   1HB   PRO  19          1HB       PRO  19 -14.402  19.086 -14.103
   80   2HB   PRO  19          2HB       PRO  19 -16.169  19.016 -13.968
   81   1HG   PRO  19          2HG       PRO  19 -14.117  17.551 -12.463
   82   2HG   PRO  19          1HG       PRO  19 -15.783  17.942 -12.019
   83   1HD   PRO  19          1HD       PRO  19 -14.787  15.456 -12.965
   84   2HD   PRO  19          2HD       PRO  19 -16.478  15.894 -12.648
   85    H    LYS  20           H        LYS  20 -14.083  15.307 -15.757
   86    HA   LYS  20           HA       LYS  20 -12.043  14.726 -16.789
   87   1HB   LYS  20          1HB       LYS  20 -13.028  16.482 -18.412
   88   2HB   LYS  20          2HB       LYS  20 -11.883  17.609 -17.682
   89   1HG   LYS  20          1HG       LYS  20 -11.018  14.930 -18.780
   90   2HG   LYS  20          2HG       LYS  20 -11.078  16.381 -19.781
   91   1HD   LYS  20          1HD       LYS  20  -9.751  17.305 -17.569
   92   2HD   LYS  20          2HD       LYS  20  -9.170  15.642 -17.656
   93   1HE   LYS  20          1HE       LYS  20  -9.239  17.341 -20.148
   94   2HE   LYS  20          2HE       LYS  20  -7.874  17.452 -19.019
   95   1HZ   LYS  20          1HZ       LYS  20  -8.929  14.856 -19.978
   96   2HZ   LYS  20          2HZ       LYS  20  -7.698  15.685 -20.803
   97   3HZ   LYS  20          3HZ       LYS  20  -7.447  15.165 -19.209
   98    H    ALA  21           H        ALA  21 -11.591  18.137 -15.738
   99    HA   ALA  21           HA       ALA  21  -8.932  18.031 -14.922
  100   1HB   ALA  21          1HB       ALA  21  -9.565  20.132 -14.399
  101   2HB   ALA  21          2HB       ALA  21 -10.423  19.514 -12.987
  102   3HB   ALA  21          3HB       ALA  21 -11.258  19.656 -14.535
  103    H    LEU  22           H        LEU  22 -11.781  17.183 -12.929
  104    HA   LEU  22           HA       LEU  22 -10.152  16.297 -10.673
  105   1HB   LEU  22          1HB       LEU  22 -12.309  17.165 -10.189
  106   2HB   LEU  22          2HB       LEU  22 -13.063  16.244 -11.485
  107    HG   LEU  22           HG       LEU  22 -12.888  14.194 -10.257
  108   1HD1  LEU  22          1HD1      LEU  22 -11.106  15.776  -8.391
  109   2HD1  LEU  22          2HD1      LEU  22 -11.785  14.204  -7.966
  110   3HD1  LEU  22          3HD1      LEU  22 -10.683  14.347  -9.336
  111   1HD2  LEU  22          1HD2      LEU  22 -14.558  16.071  -9.499
  112   2HD2  LEU  22          2HD2      LEU  22 -14.362  14.635  -8.494
  113   3HD2  LEU  22          3HD2      LEU  22 -13.545  16.136  -8.057
  114    H    GLN  23           H        GLN  23 -12.395  14.550 -12.842
  115    HA   GLN  23           HA       GLN  23 -11.800  11.913 -12.202
  116   1HB   GLN  23          1HB       GLN  23 -13.530  12.583 -13.766
  117   2HB   GLN  23          2HB       GLN  23 -12.332  13.232 -14.885
  118   1HG   GLN  23          1HG       GLN  23 -11.369  10.915 -15.084
  119   2HG   GLN  23          2HG       GLN  23 -12.720  10.324 -14.115
  120   2HE2  GLN  23          2HE2      GLN  23 -13.934   9.195 -15.696
  121   1HE2  GLN  23          1HE2      GLN  23 -14.542   9.915 -17.107
  122    H    GLN  24           H        GLN  24  -9.877  14.124 -14.202
  123    HA   GLN  24           HA       GLN  24  -8.016  12.106 -15.149
  124   1HB   GLN  24          1HB       GLN  24  -8.545  14.342 -16.192
  125   2HB   GLN  24          2HB       GLN  24  -7.676  15.106 -14.860
  126   1HG   GLN  24          1HG       GLN  24  -6.127  12.951 -16.068
  127   2HG   GLN  24          2HG       GLN  24  -6.550  14.196 -17.244
  128   2HE2  GLN  24          2HE2      GLN  24  -4.320  13.416 -14.794
  129   1HE2  GLN  24          1HE2      GLN  24  -3.675  14.967 -14.551
  130    H    LYS  25           H        LYS  25  -8.101  14.353 -12.400
  131    HA   LYS  25           HA       LYS  25  -5.393  13.849 -11.510
  132   1HB   LYS  25          1HB       LYS  25  -7.818  15.285 -10.685
  133   2HB   LYS  25          2HB       LYS  25  -6.889  14.664  -9.320
  134   1HG   LYS  25          2HG       LYS  25  -5.395  16.323  -9.577
  135   2HG   LYS  25          1HG       LYS  25  -5.046  15.755 -11.210
  136   1HD   LYS  25          1HD       LYS  25  -6.438  17.293 -12.195
  137   2HD   LYS  25          2HD       LYS  25  -7.568  17.294 -10.840
  138   1HE   LYS  25          1HE       LYS  25  -4.804  18.420 -10.441
  139   2HE   LYS  25          2HE       LYS  25  -6.053  19.410 -11.224
  140   1HZ   LYS  25          1HZ       LYS  25  -7.552  18.848  -9.377
  141   2HZ   LYS  25          2HZ       LYS  25  -6.288  18.022  -8.605
  142   3HZ   LYS  25          3HZ       LYS  25  -6.182  19.700  -8.845
  143    H    ILE  26           H        ILE  26  -8.584  12.605 -10.463
  144    HA   ILE  26           HA       ILE  26  -7.715  10.911  -8.370
  145    HB   ILE  26           HB       ILE  26  -9.954  10.610 -10.399
  146   1HG1  ILE  26          1HG1      ILE  26 -10.186  11.638  -7.575
  147   2HG1  ILE  26          2HG1      ILE  26  -9.718  12.723  -8.885
  148   1HG2  ILE  26          1HG2      ILE  26  -9.069   8.732  -8.544
  149   2HG2  ILE  26          2HG2      ILE  26 -10.391   9.549  -7.711
  150   3HG2  ILE  26          3HG2      ILE  26 -10.672   8.785  -9.276
  151   1HD1  ILE  26          1HD1      ILE  26 -12.086  10.963  -9.336
  152   2HD1  ILE  26          2HD1      ILE  26 -12.284  12.332  -8.242
  153   3HD1  ILE  26          3HD1      ILE  26 -11.781  12.603  -9.910
  154    H    HIS  27           H        HIS  27  -8.345   9.995 -11.786
  155    HA   HIS  27           HA       HIS  27  -7.416   7.330 -11.653
  156   1HB   HIS  27          1HB       HIS  27  -8.504   8.953 -13.516
  157   2HB   HIS  27          2HB       HIS  27  -6.833   8.957 -14.079
  158    HD1  HIS  27           HD1      HIS  27  -5.777   6.593 -14.671
  159    HD2  HIS  27           HD2      HIS  27  -9.885   6.550 -13.962
  160    HE1  HIS  27           HE1      HIS  27  -6.634   4.378 -15.552
  161    H    GLU  28           H        GLU  28  -5.619  10.352 -11.862
  162    HA   GLU  28           HA       GLU  28  -3.074   9.113 -12.568
  163   1HB   GLU  28          1HB       GLU  28  -4.184  11.629 -12.605
  164   2HB   GLU  28          2HB       GLU  28  -3.101  11.737 -11.216
  165   1HG   GLU  28          2HG       GLU  28  -1.932  12.383 -13.289
  166   2HG   GLU  28          1HG       GLU  28  -1.234  10.913 -12.608
  167    H    LEU  29           H        LEU  29  -4.580  10.299  -9.558
  168    HA   LEU  29           HA       LEU  29  -2.257   9.661  -7.909
  169   1HB   LEU  29          1HB       LEU  29  -5.159  10.356  -7.362
  170   2HB   LEU  29          2HB       LEU  29  -3.951  10.172  -6.091
  171    HG   LEU  29           HG       LEU  29  -3.608  12.066  -8.426
  172   1HD1  LEU  29          1HD1      LEU  29  -5.512  12.324  -6.431
  173   2HD1  LEU  29          2HD1      LEU  29  -4.146  13.235  -5.791
  174   3HD1  LEU  29          3HD1      LEU  29  -4.825  13.654  -7.364
  175   1HD2  LEU  29          1HD2      LEU  29  -2.037  11.255  -6.065
  176   2HD2  LEU  29          2HD2      LEU  29  -1.501  12.012  -7.565
  177   3HD2  LEU  29          3HD2      LEU  29  -2.175  13.002  -6.271
  178    H    GLU  30           H        GLU  30  -5.432   8.144  -8.527
  179    HA   GLU  30           HA       GLU  30  -5.191   5.988  -6.673
  180   1HB   GLU  30          1HB       GLU  30  -7.239   6.753  -7.890
  181   2HB   GLU  30          2HB       GLU  30  -6.568   6.081  -9.377
  182   1HG   GLU  30          1HG       GLU  30  -6.390   4.069  -7.363
  183   2HG   GLU  30          2HG       GLU  30  -8.029   4.722  -7.326
  184    H    GLY  31           H        GLY  31  -4.090   6.336 -10.037
  185   1HA   GLY  31          2HA       GLY  31  -2.751   4.925 -11.361
  186   2HA   GLY  31          1HA       GLY  31  -3.223   3.591 -10.307
  187    H    LEU  32           H        LEU  32  -1.818   6.471  -8.931
  188    HA   LEU  32           HA       LEU  32   0.947   5.614  -8.998
  189   1HB   LEU  32          1HB       LEU  32  -0.374   7.918  -8.507
  190   2HB   LEU  32          2HB       LEU  32  -0.087   7.398  -6.846
  191    HG   LEU  32           HG       LEU  32   2.324   7.148  -7.348
  192   1HD1  LEU  32          1HD1      LEU  32   1.311   7.609 -10.074
  193   2HD1  LEU  32          2HD1      LEU  32   2.745   8.555  -9.675
  194   3HD1  LEU  32          3HD1      LEU  32   2.785   6.797  -9.543
  195   1HD2  LEU  32          1HD2      LEU  32   0.811   9.613  -7.306
  196   2HD2  LEU  32          2HD2      LEU  32   2.388   9.272  -6.593
  197   3HD2  LEU  32          3HD2      LEU  32   2.277   9.823  -8.264
  198    H    MET  33           H        MET  33  -1.667   5.355  -6.583
  199    HA   MET  33           HA       MET  33  -0.224   4.316  -4.397
  200   1HB   MET  33          1HB       MET  33  -2.990   4.198  -5.486
  201   2HB   MET  33          2HB       MET  33  -2.589   2.994  -4.261
  202   1HG   MET  33          1HG       MET  33  -2.229   4.589  -2.611
  203   2HG   MET  33          2HG       MET  33  -1.813   5.847  -3.775
  204   1HE   MET  33          1HE       MET  33  -4.418   3.234  -3.636
  205   2HE   MET  33          2HE       MET  33  -5.000   3.876  -2.103
  206   3HE   MET  33          3HE       MET  33  -5.991   4.039  -3.551
  207    H    MET  34           H        MET  34  -1.776   2.490  -7.065
  208    HA   MET  34           HA       MET  34  -1.110  -0.125  -6.303
  209   1HB   MET  34          2HB       MET  34  -1.125   1.146  -9.061
  210   2HB   MET  34          1HB       MET  34  -1.286  -0.581  -8.735
  211   1HG   MET  34          1HG       MET  34  -3.226   0.410  -7.104
  212   2HG   MET  34          2HG       MET  34  -3.269   1.595  -8.409
  213   1HE   MET  34          1HE       MET  34  -3.327  -2.093  -7.400
  214   2HE   MET  34          2HE       MET  34  -4.915  -1.368  -7.164
  215   3HE   MET  34          3HE       MET  34  -4.701  -2.676  -8.336
  216    H    GLN  35           H        GLN  35   0.889   2.186  -8.167
  217    HA   GLN  35           HA       GLN  35   3.085   0.565  -8.799
  218   1HB   GLN  35          1HB       GLN  35   2.809   2.860  -9.556
  219   2HB   GLN  35          2HB       GLN  35   2.927   3.461  -7.904
  220   1HG   GLN  35          2HG       GLN  35   5.152   3.641  -8.188
  221   2HG   GLN  35          1HG       GLN  35   5.230   1.883  -8.312
  222   2HE2  GLN  35          2HE2      GLN  35   4.678   4.817 -10.317
  223   1HE2  GLN  35          1HE2      GLN  35   5.261   4.129 -11.754
  224    H    HIS  36           H        HIS  36   3.426   2.887  -6.123
  225    HA   HIS  36           HA       HIS  36   5.497   1.538  -4.778
  226   1HB   HIS  36          1HB       HIS  36   3.406   3.563  -4.153
  227   2HB   HIS  36          2HB       HIS  36   4.248   2.849  -2.777
  228    HD1  HIS  36           HD1      HIS  36   5.324   5.315  -2.505
  229    HD2  HIS  36           HD2      HIS  36   6.501   3.185  -5.890
  230    HE1  HIS  36           HE1      HIS  36   7.404   6.460  -3.385
  231    H    ALA  37           H        ALA  37   1.990   1.411  -4.052
  232    HA   ALA  37           HA       ALA  37   1.929  -0.351  -1.898
  233   1HB   ALA  37          1HB       ALA  37  -0.304  -0.988  -2.853
  234   2HB   ALA  37          3HB       ALA  37  -0.020   0.751  -2.887
  235   3HB   ALA  37          2HB       ALA  37   0.155  -0.201  -4.361
  236    H    GLN  38           H        GLN  38   2.491  -1.115  -5.315
  237    HA   GLN  38           HA       GLN  38   2.409  -4.014  -4.915
  238   1HB   GLN  38          1HB       GLN  38   2.912  -2.036  -7.084
  239   2HB   GLN  38          2HB       GLN  38   3.646  -3.627  -7.294
  240   1HG   GLN  38          1HG       GLN  38   1.086  -4.222  -6.405
  241   2HG   GLN  38          2HG       GLN  38   0.833  -2.845  -7.477
  242   2HE2  GLN  38          2HE2      GLN  38   1.152  -6.207  -7.466
  243   1HE2  GLN  38          1HE2      GLN  38   1.563  -6.429  -9.098
  244    H    ASN  39           H        ASN  39   4.866  -1.472  -5.051
  245    HA   ASN  39           HA       ASN  39   7.062  -3.453  -4.768
  246   1HB   ASN  39          1HB       ASN  39   6.756  -0.524  -5.362
  247   2HB   ASN  39          2HB       ASN  39   8.314  -1.118  -4.786
  248   2HD2  ASN  39          2HD2      ASN  39   7.619  -0.115  -7.532
  249   1HD2  ASN  39          1HD2      ASN  39   7.987  -1.392  -8.588
  250    H    LEU  40           H        LEU  40   4.967  -2.747  -2.631
  251    HA   LEU  40           HA       LEU  40   4.928  -2.431  -0.303
  252   1HB   LEU  40          2HB       LEU  40   7.860  -3.108  -0.710
  253   2HB   LEU  40          1HB       LEU  40   6.987  -3.222   0.817
  254    HG   LEU  40           HG       LEU  40   5.335  -4.729  -0.578
  255   1HD1  LEU  40          1HD1      LEU  40   7.726  -4.427  -2.312
  256   2HD1  LEU  40          2HD1      LEU  40   7.115  -6.070  -2.124
  257   3HD1  LEU  40          3HD1      LEU  40   6.059  -4.803  -2.748
  258   1HD2  LEU  40          1HD2      LEU  40   7.962  -5.354   0.699
  259   2HD2  LEU  40          2HD2      LEU  40   6.338  -5.860   1.167
  260   3HD2  LEU  40          3HD2      LEU  40   7.157  -6.656  -0.178
  261    H    GLU  41           H        GLU  41   5.621  -0.109  -2.114
  262    HA   GLU  41           HA       GLU  41   7.268   1.528  -0.224
  263   1HB   GLU  41          1HB       GLU  41   6.500   1.765  -3.144
  264   2HB   GLU  41          2HB       GLU  41   7.311   3.064  -2.270
  265   1HG   GLU  41          1HG       GLU  41   8.472   0.310  -2.115
  266   2HG   GLU  41          2HG       GLU  41   8.716   1.242  -3.594
  267    H    PHE  42           H        PHE  42   4.224   0.757  -0.244
  268    HA   PHE  42           HA       PHE  42   2.647   3.044  -0.747
  269   1HB   PHE  42          1HB       PHE  42   1.085   1.893   0.870
  270   2HB   PHE  42          2HB       PHE  42   1.686   0.867  -0.429
  271    HD1  PHE  42           HD1      PHE  42   2.658   1.922   3.068
  272    HD2  PHE  42           HD2      PHE  42   2.511  -1.250   0.138
  273    HE1  PHE  42           HE1      PHE  42   3.564   0.324   4.746
  274    HE2  PHE  42           HE2      PHE  42   3.400  -2.841   1.817
  275    HZ   PHE  42           HZ       PHE  42   3.931  -2.056   4.126
  276    H    GLU  43           H        GLU  43   5.054   2.702   1.691
  277    HA   GLU  43           HA       GLU  43   3.991   3.976   3.950
  278   1HB   GLU  43          1HB       GLU  43   6.277   3.102   3.765
  279   2HB   GLU  43          2HB       GLU  43   6.674   4.339   2.571
  280   1HG   GLU  43          1HG       GLU  43   5.954   6.033   4.401
  281   2HG   GLU  43          2HG       GLU  43   6.129   4.678   5.516
  282    H    GLU  44           H        GLU  44   5.820   5.725   1.434
  283    HA   GLU  44           HA       GLU  44   4.490   8.259   2.112
  284   1HB   GLU  44          1HB       GLU  44   6.017   9.101   0.329
  285   2HB   GLU  44          2HB       GLU  44   6.877   8.127   1.522
  286   1HG   GLU  44          1HG       GLU  44   7.179   6.353   0.064
  287   2HG   GLU  44          2HG       GLU  44   5.745   6.751  -0.883
  288    H    ALA  45           H        ALA  45   4.046   5.647  -0.130
  289    HA   ALA  45           HA       ALA  45   2.611   7.133  -2.180
  290   1HB   ALA  45          1HB       ALA  45   1.975   4.396  -2.292
  291   2HB   ALA  45          3HB       ALA  45   3.598   4.458  -1.607
  292   3HB   ALA  45          2HB       ALA  45   3.269   5.211  -3.169
  293    H    ALA  46           H        ALA  46   1.563   4.858   0.385
  294    HA   ALA  46           HA       ALA  46  -1.186   4.850  -0.116
  295   1HB   ALA  46          1HB       ALA  46   0.454   4.741   2.419
  296   2HB   ALA  46          3HB       ALA  46  -0.263   3.398   1.525
  297   3HB   ALA  46          2HB       ALA  46  -1.291   4.507   2.433
  298    H    GLN  47           H        GLN  47   0.774   7.453   1.161
  299    HA   GLN  47           HA       GLN  47  -1.108   9.000   2.571
  300   1HB   GLN  47          1HB       GLN  47   1.000   9.924   0.594
  301   2HB   GLN  47          2HB       GLN  47   0.327  10.878   1.916
  302   1HG   GLN  47          1HG       GLN  47   1.122   8.811   3.375
  303   2HG   GLN  47          2HG       GLN  47   2.233   8.570   2.024
  304   2HE2  GLN  47          2HE2      GLN  47   3.810  10.293   1.576
  305   1HE2  GLN  47          1HE2      GLN  47   4.169  11.470   2.746
  306    H    ILE  48           H        ILE  48  -0.710   8.565  -0.925
  307    HA   ILE  48           HA       ILE  48  -2.340  10.639  -1.925
  308    HB   ILE  48           HB       ILE  48  -1.998   7.746  -2.790
  309   1HG1  ILE  48          1HG1      ILE  48  -0.684  10.202  -3.958
  310   2HG1  ILE  48          2HG1      ILE  48   0.019   9.360  -2.576
  311   1HG2  ILE  48          1HG2      ILE  48  -3.061  10.147  -4.312
  312   2HG2  ILE  48          2HG2      ILE  48  -2.683   8.582  -5.034
  313   3HG2  ILE  48          3HG2      ILE  48  -3.982   8.715  -3.849
  314   1HD1  ILE  48          1HD1      ILE  48  -0.785   7.812  -5.025
  315   2HD1  ILE  48          2HD1      ILE  48   0.756   8.666  -4.990
  316   3HD1  ILE  48          3HD1      ILE  48   0.420   7.406  -3.803
  317    H    ARG  49           H        ARG  49  -3.188   7.687  -0.245
  318    HA   ARG  49           HA       ARG  49  -5.903   7.334  -0.882
  319   1HB   ARG  49          1HB       ARG  49  -4.724   5.805   0.543
  320   2HB   ARG  49          2HB       ARG  49  -4.306   7.080   1.680
  321   1HG   ARG  49          1HG       ARG  49  -7.147   7.051   1.455
  322   2HG   ARG  49          2HG       ARG  49  -6.615   5.386   1.683
  323   1HD   ARG  49          1HD       ARG  49  -6.998   6.556   3.862
  324   2HD   ARG  49          2HD       ARG  49  -5.305   6.061   3.668
  325    HE   ARG  49           HE       ARG  49  -4.791   8.399   2.980
  326   1HH1  ARG  49          1HH1      ARG  49  -8.123   8.219   3.218
  327   2HH1  ARG  49          2HH1      ARG  49  -8.312   9.630   4.205
  328   1HH2  ARG  49          1HH2      ARG  49  -4.912  10.019   4.764
  329   2HH2  ARG  49          2HH2      ARG  49  -6.494  10.649   5.079
  330    H    ASP  50           H        ASP  50  -4.386   9.753   1.219
  331    HA   ASP  50           HA       ASP  50  -6.839  10.809   2.332
  332   1HB   ASP  50          1HB       ASP  50  -4.268  11.005   2.965
  333   2HB   ASP  50          2HB       ASP  50  -4.345  12.429   1.929
  334    H    GLN  51           H        GLN  51  -4.918  11.507  -0.562
  335    HA   GLN  51           HA       GLN  51  -6.447  13.898  -1.275
  336   1HB   GLN  51          2HB       GLN  51  -4.587  12.123  -2.894
  337   2HB   GLN  51          1HB       GLN  51  -5.046  13.781  -3.286
  338   1HG   GLN  51          1HG       GLN  51  -3.920  14.636  -1.335
  339   2HG   GLN  51          2HG       GLN  51  -3.641  13.007  -0.716
  340   2HE2  GLN  51          2HE2      GLN  51  -3.142  14.431  -3.999
  341   1HE2  GLN  51          1HE2      GLN  51  -1.509  13.979  -4.103
  342    H    LEU  52           H        LEU  52  -6.380  10.482  -2.292
  343    HA   LEU  52           HA       LEU  52  -8.253  10.658  -4.436
  344   1HB   LEU  52          1HB       LEU  52  -6.906   8.674  -2.792
  345   2HB   LEU  52          2HB       LEU  52  -8.554   8.167  -3.162
  346    HG   LEU  52           HG       LEU  52  -6.979   7.407  -4.906
  347   1HD1  LEU  52          1HD1      LEU  52  -9.403   8.300  -5.344
  348   2HD1  LEU  52          2HD1      LEU  52  -8.575   9.644  -6.132
  349   3HD1  LEU  52          3HD1      LEU  52  -8.340   7.998  -6.719
  350   1HD2  LEU  52          1HD2      LEU  52  -5.638   9.712  -4.458
  351   2HD2  LEU  52          2HD2      LEU  52  -5.484   8.797  -5.958
  352   3HD2  LEU  52          3HD2      LEU  52  -6.565  10.189  -5.880
  353    H    HIS  53           H        HIS  53  -8.737  10.070  -0.946
  354    HA   HIS  53           HA       HIS  53 -11.570   9.636  -1.062
  355   1HB   HIS  53          1HB       HIS  53  -9.657   9.359   0.787
  356   2HB   HIS  53          2HB       HIS  53 -10.256  10.941   1.287
  357    HD1  HIS  53           HD1      HIS  53 -12.085   7.819   0.052
  358    HD2  HIS  53           HD2      HIS  53 -12.103  10.459   3.277
  359    HE1  HIS  53           HE1      HIS  53 -13.991   7.099   1.557
  360    H    GLN  54           H        GLN  54  -9.623  12.585  -0.558
  361    HA   GLN  54           HA       GLN  54 -11.918  14.318  -0.158
  362   1HB   GLN  54          1HB       GLN  54  -9.181  14.406   0.209
  363   2HB   GLN  54          2HB       GLN  54  -9.413  15.496  -1.157
  364   1HG   GLN  54          1HG       GLN  54 -10.908  16.884   0.064
  365   2HG   GLN  54          2HG       GLN  54 -11.116  15.675   1.331
  366   2HE2  GLN  54          2HE2      GLN  54  -7.971  16.553  -0.102
  367   1HE2  GLN  54          1HE2      GLN  54  -7.329  17.233   1.314
  368    H    LEU  55           H        LEU  55  -9.788  13.602  -2.936
  369    HA   LEU  55           HA       LEU  55 -11.013  15.468  -4.752
  370   1HB   LEU  55          1HB       LEU  55  -9.165  13.136  -4.817
  371   2HB   LEU  55          2HB       LEU  55  -9.947  13.554  -6.342
  372    HG   LEU  55           HG       LEU  55  -9.168  16.017  -5.297
  373   1HD1  LEU  55          1HD1      LEU  55  -7.215  13.840  -4.606
  374   2HD1  LEU  55          2HD1      LEU  55  -6.618  15.436  -5.053
  375   3HD1  LEU  55          3HD1      LEU  55  -7.684  15.253  -3.661
  376   1HD2  LEU  55          1HD2      LEU  55  -8.070  14.144  -7.387
  377   2HD2  LEU  55          2HD2      LEU  55  -8.972  15.643  -7.611
  378   3HD2  LEU  55          3HD2      LEU  55  -7.290  15.696  -7.084
  379    H    ARG  56           H        ARG  56 -11.922  12.287  -3.640
  380    HA   ARG  56           HA       ARG  56 -13.640  11.574  -5.860
  381   1HB   ARG  56          1HB       ARG  56 -12.629  10.025  -4.177
  382   2HB   ARG  56          2HB       ARG  56 -13.686  10.720  -2.947
  383   1HG   ARG  56          1HG       ARG  56 -15.512  10.129  -4.867
  384   2HG   ARG  56          2HG       ARG  56 -14.330   8.851  -5.157
  385   1HD   ARG  56          1HD       ARG  56 -14.506   8.053  -2.891
  386   2HD   ARG  56          2HD       ARG  56 -15.453   9.474  -2.405
  387    HE   ARG  56           HE       ARG  56 -16.537   7.778  -4.590
  388   1HH1  ARG  56          1HH1      ARG  56 -18.546   9.483  -3.740
  389   2HH1  ARG  56          2HH1      ARG  56 -19.316   8.709  -2.395
  390   1HH2  ARG  56          1HH2      ARG  56 -16.690   6.520  -1.811
  391   2HH2  ARG  56          2HH2      ARG  56 -18.264   7.032  -1.303
  392    H    GLU  57           H        GLU  57 -14.391  12.758  -2.554
  393    HA   GLU  57           HA       GLU  57 -17.184  13.100  -2.924
  394   1HB   GLU  57          1HB       GLU  57 -16.906  14.667  -0.984
  395   2HB   GLU  57          2HB       GLU  57 -16.060  13.136  -0.757
  396   1HG   GLU  57          1HG       GLU  57 -13.960  14.092  -1.087
  397   2HG   GLU  57          2HG       GLU  57 -14.609  15.443  -2.018
  398    H    LEU  58           H        LEU  58 -14.496  15.010  -4.058
  399    HA   LEU  58           HA       LEU  58 -15.915  17.499  -4.461
  400   1HB   LEU  58          1HB       LEU  58 -13.314  16.521  -4.596
  401   2HB   LEU  58          2HB       LEU  58 -13.693  16.905  -6.275
  402    HG   LEU  58           HG       LEU  58 -14.316  18.854  -4.060
  403   1HD1  LEU  58          1HD1      LEU  58 -11.752  17.960  -4.543
  404   2HD1  LEU  58          2HD1      LEU  58 -11.871  19.353  -5.618
  405   3HD1  LEU  58          3HD1      LEU  58 -12.161  19.546  -3.890
  406   1HD2  LEU  58          1HD2      LEU  58 -15.247  19.044  -6.436
  407   2HD2  LEU  58          2HD2      LEU  58 -14.361  20.449  -5.844
  408   3HD2  LEU  58          3HD2      LEU  58 -13.587  19.325  -6.961
  409    H    PHE  59           H        PHE  59 -15.808  14.486  -6.193
  410    HA   PHE  59           HA       PHE  59 -16.283  15.203  -8.859
  411   1HB   PHE  59          1HB       PHE  59 -16.020  12.916  -7.831
  412   2HB   PHE  59          2HB       PHE  59 -17.690  13.033  -7.274
  413    HD1  PHE  59           HD1      PHE  59 -19.535  13.443  -9.024
  414    HD2  PHE  59           HD2      PHE  59 -15.520  12.229 -10.048
  415    HE1  PHE  59           HE1      PHE  59 -20.335  12.683 -11.259
  416    HE2  PHE  59           HE2      PHE  59 -16.321  11.468 -12.282
  417    HZ   PHE  59           HZ       PHE  59 -18.728  11.695 -12.889
  418    H    ILE  60           H        ILE  60 -18.646  15.022  -6.184
  419    HA   ILE  60           HA       ILE  60 -20.919  15.746  -7.841
  420    HB   ILE  60           HB       ILE  60 -20.402  15.788  -4.849
  421   1HG1  ILE  60          2HG1      ILE  60 -20.179  13.564  -5.884
  422   2HG1  ILE  60          1HG1      ILE  60 -21.646  13.640  -4.906
  423   1HG2  ILE  60          1HG2      ILE  60 -22.744  16.530  -6.496
  424   2HG2  ILE  60          2HG2      ILE  60 -23.092  15.427  -5.164
  425   3HG2  ILE  60          3HG2      ILE  60 -22.339  16.988  -4.842
  426   1HD1  ILE  60          1HD1      ILE  60 -22.682  14.454  -7.244
  427   2HD1  ILE  60          2HD1      ILE  60 -21.347  13.486  -7.869
  428   3HD1  ILE  60          3HD1      ILE  60 -22.558  12.746  -6.821
  429    H    ALA  61           H        ALA  61 -18.623  17.528  -5.810
  430    HA   ALA  61           HA       ALA  61 -20.009  20.043  -5.783
  431   1HB   ALA  61          1HB       ALA  61 -18.247  19.607  -4.224
  432   2HB   ALA  61          2HB       ALA  61 -17.123  19.170  -5.512
  433   3HB   ALA  61          3HB       ALA  61 -17.617  20.850  -5.305
  434    H    ALA  62           H        ALA  62 -18.124  18.417  -8.224
  435    HA   ALA  62           HA       ALA  62 -18.090  20.920  -9.877
  436   1HB   ALA  62          1HB       ALA  62 -15.918  19.804  -9.211
  437   2HB   ALA  62          3HB       ALA  62 -16.150  19.940 -10.955
  438   3HB   ALA  62          2HB       ALA  62 -16.425  18.398 -10.147
  439    H    SER  63           H        SER  63 -18.222  17.361 -10.343
  440    HA   SER  63           HA       SER  63 -19.450  16.082 -11.908
  441   1HB   SER  63          1HB       SER  63 -21.126  17.516 -10.398
  442   2HB   SER  63          2HB       SER  63 -21.490  18.270 -11.948
  443    HG   SER  63           HG       SER  63 -22.429  16.019 -11.041
  444    H    LEU   8           H        LEU   8   8.685 -39.890   4.611
  445    HA   LEU   8           HA       LEU   8  10.932 -38.763   3.154
  446   1HB   LEU   8          1HB       LEU   8   8.129 -38.238   2.347
  447   2HB   LEU   8          2HB       LEU   8   9.147 -36.804   2.489
  448    HG   LEU   8           HG       LEU   8  10.880 -38.136   1.107
  449   1HD1  LEU   8          1HD1      LEU   8   8.352 -39.738   0.626
  450   2HD1  LEU   8          2HD1      LEU   8   9.770 -39.811  -0.419
  451   3HD1  LEU   8          3HD1      LEU   8   9.885 -40.336   1.261
  452   1HD2  LEU   8          1HD2      LEU   8   8.256 -37.088   0.028
  453   2HD2  LEU   8          2HD2      LEU   8   9.815 -36.266   0.088
  454   3HD2  LEU   8          3HD2      LEU   8   9.564 -37.599  -1.039
  455    H    GLU   9           H        GLU   9  11.820 -37.073   4.363
  456    HA   GLU   9           HA       GLU   9  10.277 -35.431   6.191
  457   1HB   GLU   9          1HB       GLU   9  10.595 -37.936   7.101
  458   2HB   GLU   9          2HB       GLU   9  12.140 -37.271   7.632
  459   1HG   GLU   9          1HG       GLU   9  10.924 -35.410   8.753
  460   2HG   GLU   9          2HG       GLU   9   9.396 -36.156   8.282
  461    HA   PRO  10           HA       PRO  10  14.679 -34.221   5.063
  462   1HB   PRO  10          1HB       PRO  10  14.063 -32.073   3.485
  463   2HB   PRO  10          2HB       PRO  10  14.238 -33.719   2.847
  464   1HG   PRO  10          2HG       PRO  10  11.767 -32.188   3.479
  465   2HG   PRO  10          1HG       PRO  10  12.097 -33.300   2.141
  466   1HD   PRO  10          1HD       PRO  10  10.653 -33.982   4.357
  467   2HD   PRO  10          2HD       PRO  10  11.567 -35.148   3.377
  468    H    ASP  11           H        ASP  11  11.911 -31.988   5.470
  469    HA   ASP  11           HA       ASP  11  11.590 -30.172   6.930
  470   1HB   ASP  11          1HB       ASP  11  13.347 -32.136   8.344
  471   2HB   ASP  11          2HB       ASP  11  13.117 -30.555   9.089
  472    H    ASN  12           H        ASN  12  14.974 -30.645   7.848
  473    HA   ASN  12           HA       ASN  12  15.695 -28.165   6.329
  474   1HB   ASN  12          2HB       ASN  12  16.835 -27.361   8.351
  475   2HB   ASN  12          1HB       ASN  12  15.142 -27.697   8.715
  476   2HD2  ASN  12          2HD2      ASN  12  14.667 -29.731   9.913
  477   1HD2  ASN  12          1HD2      ASN  12  15.877 -30.471  10.845
  478    H    VAL  13           H        VAL  13  16.290 -30.850   5.526
  479    HA   VAL  13           HA       VAL  13  18.959 -31.573   6.421
  480    HB   VAL  13           HB       VAL  13  17.157 -33.124   5.615
  481   1HG1  VAL  13          1HG1      VAL  13  17.833 -31.784   2.991
  482   2HG1  VAL  13          2HG1      VAL  13  17.132 -33.399   3.061
  483   3HG1  VAL  13          3HG1      VAL  13  16.245 -32.026   3.719
  484   1HG2  VAL  13          1HG2      VAL  13  19.856 -33.148   4.240
  485   2HG2  VAL  13          2HG2      VAL  13  19.419 -33.946   5.751
  486   3HG2  VAL  13          3HG2      VAL  13  18.744 -34.517   4.225
  487    HA   PRO  14           HA       PRO  14  20.278 -29.591   2.322
  488   1HB   PRO  14          1HB       PRO  14  18.797 -27.527   1.325
  489   2HB   PRO  14          2HB       PRO  14  18.494 -29.221   0.896
  490   1HG   PRO  14          2HG       PRO  14  16.963 -27.428   2.645
  491   2HG   PRO  14          1HG       PRO  14  16.438 -28.862   1.755
  492   1HD   PRO  14          1HD       PRO  14  17.033 -28.675   4.518
  493   2HD   PRO  14          2HD       PRO  14  16.654 -30.137   3.594
  494    H    MET  15           H        MET  15  18.404 -26.990   3.930
  495    HA   MET  15           HA       MET  15  20.650 -25.952   5.405
  496   1HB   MET  15          1HB       MET  15  20.995 -23.927   3.960
  497   2HB   MET  15          2HB       MET  15  21.453 -25.430   3.157
  498   1HG   MET  15          1HG       MET  15  19.546 -25.429   1.788
  499   2HG   MET  15          2HG       MET  15  18.664 -24.337   2.857
  500   1HE   MET  15          1HE       MET  15  19.750 -24.888  -0.122
  501   2HE   MET  15          2HE       MET  15  20.069 -23.351  -0.921
  502   3HE   MET  15          3HE       MET  15  21.407 -24.304  -0.264
  503    H    ASP  16           H        ASP  16  20.086 -23.730   6.325
  504    HA   ASP  16           HA       ASP  16  17.392 -22.688   6.033
  505   1HB   ASP  16          1HB       ASP  16  17.889 -24.953   7.761
  506   2HB   ASP  16          2HB       ASP  16  17.360 -23.573   8.724
  507    H    MET  17           H        MET  17  19.127 -20.918   5.855
  508    HA   MET  17           HA       MET  17  20.724 -20.056   8.038
  509   1HB   MET  17          1HB       MET  17  20.659 -17.890   6.813
  510   2HB   MET  17          2HB       MET  17  20.905 -19.253   5.722
  511   1HG   MET  17          1HG       MET  17  18.604 -19.228   5.036
  512   2HG   MET  17          2HG       MET  17  18.174 -18.086   6.310
  513   1HE   MET  17          1HE       MET  17  18.467 -18.532   2.870
  514   2HE   MET  17          2HE       MET  17  17.218 -17.432   3.448
  515   3HE   MET  17          3HE       MET  17  18.430 -16.869   2.288
  516    H    SER  18           H        SER  18  17.279 -19.689   7.431
  517    HA   SER  18           HA       SER  18  17.007 -17.736   9.660
  518   1HB   SER  18          1HB       SER  18  14.724 -18.876   8.087
  519   2HB   SER  18          2HB       SER  18  14.961 -17.235   8.680
  520    HG   SER  18           HG       SER  18  15.756 -18.409   6.330
  521    HA   PRO  19           HA       PRO  19  15.564 -20.873  12.388
  522   1HB   PRO  19          1HB       PRO  19  14.049 -19.392  14.108
  523   2HB   PRO  19          2HB       PRO  19  15.821 -19.304  14.056
  524   1HG   PRO  19          2HG       PRO  19  13.821 -17.377  13.102
  525   2HG   PRO  19          1HG       PRO  19  15.503 -17.119  13.580
  526   1HD   PRO  19          1HD       PRO  19  14.465 -17.290  10.943
  527   2HD   PRO  19          2HD       PRO  19  16.168 -17.167  11.429
  528    H    LYS  20           H        LYS  20  13.659 -19.898  10.019
  529    HA   LYS  20           HA       LYS  20  11.579 -20.654   9.199
  530   1HB   LYS  20          1HB       LYS  20  12.510 -22.740  10.412
  531   2HB   LYS  20          2HB       LYS  20  11.396 -22.319  11.714
  532   1HG   LYS  20          1HG       LYS  20  10.483 -22.584   8.845
  533   2HG   LYS  20          2HG       LYS  20  10.510 -23.956   9.954
  534   1HD   LYS  20          1HD       LYS  20   9.268 -22.051  11.483
  535   2HD   LYS  20          2HD       LYS  20   8.680 -21.643   9.871
  536   1HE   LYS  20          1HE       LYS  20   8.662 -24.515  10.796
  537   2HE   LYS  20          2HE       LYS  20   7.341 -23.417  11.239
  538   1HZ   LYS  20          1HZ       LYS  20   8.351 -23.639   8.465
  539   2HZ   LYS  20          2HZ       LYS  20   7.093 -24.623   9.043
  540   3HZ   LYS  20          3HZ       LYS  20   6.899 -22.938   8.998
  541    H    ALA  21           H        ALA  21  11.177 -20.595  12.773
  542    HA   ALA  21           HA       ALA  21   8.549 -19.692  12.936
  543   1HB   ALA  21          1HB       ALA  21  10.894 -19.859  14.575
  544   2HB   ALA  21          3HB       ALA  21   9.208 -19.805  15.092
  545   3HB   ALA  21          2HB       ALA  21  10.116 -18.307  14.887
  546    H    LEU  22           H        LEU  22  11.468 -17.638  12.648
  547    HA   LEU  22           HA       LEU  22   9.920 -15.170  12.458
  548   1HB   LEU  22          1HB       LEU  22  12.096 -15.025  13.398
  549   2HB   LEU  22          2HB       LEU  22  12.799 -16.033  12.139
  550    HG   LEU  22           HG       LEU  22  12.663 -14.270  10.520
  551   1HD1  LEU  22          1HD1      LEU  22  10.956 -12.867  12.588
  552   2HD1  LEU  22          2HD1      LEU  22  11.645 -12.039  11.191
  553   3HD1  LEU  22          3HD1      LEU  22  10.494 -13.355  10.958
  554   1HD2  LEU  22          1HD2      LEU  22  14.365 -14.133  12.513
  555   2HD2  LEU  22          2HD2      LEU  22  14.203 -12.756  11.422
  556   3HD2  LEU  22          3HD2      LEU  22  13.406 -12.734  12.996
  557    H    GLN  23           H        GLN  23  12.078 -16.832  10.138
  558    HA   GLN  23           HA       GLN  23  11.499 -15.452   7.798
  559   1HB   GLN  23          1HB       GLN  23  13.172 -17.200   7.976
  560   2HB   GLN  23          2HB       GLN  23  11.936 -18.414   8.299
  561   1HG   GLN  23          1HG       GLN  23  10.958 -17.918   6.033
  562   2HG   GLN  23          2HG       GLN  23  12.341 -16.869   5.721
  563   2HE2  GLN  23          2HE2      GLN  23  13.494 -18.108   4.177
  564   1HE2  GLN  23          1HE2      GLN  23  14.052 -19.686   4.462
  565    H    GLN  24           H        GLN  24   9.509 -17.928   9.380
  566    HA   GLN  24           HA       GLN  24   7.609 -18.201   7.201
  567   1HB   GLN  24          1HB       GLN  24   8.105 -19.850   9.046
  568   2HB   GLN  24          2HB       GLN  24   7.288 -18.760  10.165
  569   1HG   GLN  24          1HG       GLN  24   5.689 -19.257   7.778
  570   2HG   GLN  24          2HG       GLN  24   6.073 -20.750   8.634
  571   2HE2  GLN  24          2HE2      GLN  24   3.932 -18.105   8.607
  572   1HE2  GLN  24          1HE2      GLN  24   3.301 -18.288  10.173
  573    H    LYS  25           H        LYS  25   7.801 -16.204  10.131
  574    HA   LYS  25           HA       LYS  25   5.127 -15.114   9.934
  575   1HB   LYS  25          1HB       LYS  25   7.585 -14.813  11.513
  576   2HB   LYS  25          2HB       LYS  25   6.706 -13.297  11.315
  577   1HG   LYS  25          2HG       LYS  25   5.208 -13.961  12.854
  578   2HG   LYS  25          1HG       LYS  25   4.796 -15.353  11.852
  579   1HD   LYS  25          1HD       LYS  25   6.157 -16.781  13.031
  580   2HD   LYS  25          2HD       LYS  25   7.334 -15.520  13.399
  581   1HE   LYS  25          1HE       LYS  25   4.592 -15.362  14.629
  582   2HE   LYS  25          2HE       LYS  25   5.814 -16.435  15.341
  583   1HZ   LYS  25          1HZ       LYS  25   7.378 -14.557  15.304
  584   2HZ   LYS  25          2HZ       LYS  25   6.140 -13.540  14.747
  585   3HZ   LYS  25          3HZ       LYS  25   6.031 -14.243  16.290
  586    H    ILE  26           H        ILE  26   8.350 -13.868   8.996
  587    HA   ILE  26           HA       ILE  26   7.554 -11.353   7.972
  588    HB   ILE  26           HB       ILE  26   9.714 -13.292   7.081
  589   1HG1  ILE  26          1HG1      ILE  26  10.054 -10.883   8.862
  590   2HG1  ILE  26          2HG1      ILE  26   9.542 -12.429   9.539
  591   1HG2  ILE  26          1HG2      ILE  26   8.895 -10.952   5.816
  592   2HG2  ILE  26          2HG2      ILE  26  10.250 -10.431   6.819
  593   3HG2  ILE  26          3HG2      ILE  26  10.471 -11.723   5.639
  594   1HD1  ILE  26          1HD1      ILE  26  11.887 -12.447   7.692
  595   2HD1  ILE  26          2HD1      ILE  26  12.130 -11.791   9.312
  596   3HD1  ILE  26          3HD1      ILE  26  11.565 -13.450   9.107
  597    H    HIS  27           H        HIS  27   8.055 -14.390   6.121
  598    HA   HIS  27           HA       HIS  27   7.123 -13.478   3.614
  599   1HB   HIS  27          1HB       HIS  27   8.146 -15.761   4.632
  600   2HB   HIS  27          2HB       HIS  27   6.455 -16.242   4.498
  601    HD1  HIS  27           HD1      HIS  27   5.373 -16.108   2.078
  602    HD2  HIS  27           HD2      HIS  27   9.504 -15.557   2.183
  603    HE1  HIS  27           HE1      HIS  27   6.189 -16.358  -0.307
  604    H    GLU  28           H        GLU  28   5.329 -14.470   6.477
  605    HA   GLU  28           HA       GLU  28   2.755 -14.709   5.124
  606   1HB   GLU  28          1HB       GLU  28   3.872 -15.493   7.511
  607   2HB   GLU  28          2HB       GLU  28   2.841 -14.156   8.021
  608   1HG   GLU  28          2HG       GLU  28   1.598 -16.286   8.072
  609   2HG   GLU  28          1HG       GLU  28   0.922 -15.193   6.864
  610    H    LEU  29           H        LEU  29   4.376 -12.210   7.090
  611    HA   LEU  29           HA       LEU  29   2.114 -10.369   6.976
  612   1HB   LEU  29          1HB       LEU  29   5.035 -10.143   7.758
  613   2HB   LEU  29          2HB       LEU  29   3.875  -8.830   7.957
  614    HG   LEU  29           HG       LEU  29   3.451 -11.592   9.118
  615   1HD1  LEU  29          1HD1      LEU  29   5.429  -9.819   9.904
  616   2HD1  LEU  29          2HD1      LEU  29   4.089  -9.416  10.977
  617   3HD1  LEU  29          3HD1      LEU  29   4.711 -11.065  10.925
  618   1HD2  LEU  29          1HD2      LEU  29   1.967  -9.046   9.029
  619   2HD2  LEU  29          2HD2      LEU  29   1.378 -10.680   9.337
  620   3HD2  LEU  29          3HD2      LEU  29   2.102  -9.742  10.644
  621    H    GLU  30           H        GLU  30   5.260 -10.641   5.304
  622    HA   GLU  30           HA       GLU  30   5.082  -8.246   3.762
  623   1HB   GLU  30          1HB       GLU  30   7.084  -9.701   4.125
  624   2HB   GLU  30          2HB       GLU  30   6.357 -10.913   3.072
  625   1HG   GLU  30          1HG       GLU  30   6.248  -8.409   1.710
  626   2HG   GLU  30          2HG       GLU  30   7.888  -8.614   2.325
  627    H    GLY  31           H        GLY  31   3.858 -11.531   3.160
  628   1HA   GLY  31          2HA       GLY  31   2.469 -12.355   1.449
  629   2HA   GLY  31          1HA       GLY  31   2.975 -10.982   0.461
  630    H    LEU  32           H        LEU  32   1.629 -10.433   3.632
  631    HA   LEU  32           HA       LEU  32  -1.139 -10.161   2.828
  632   1HB   LEU  32          1HB       LEU  32   0.205 -10.388   5.159
  633   2HB   LEU  32          2HB       LEU  32  -0.020  -8.639   5.133
  634    HG   LEU  32           HG       LEU  32  -2.450  -8.965   4.784
  635   1HD1  LEU  32          1HD1      LEU  32  -1.538 -11.745   4.444
  636   2HD1  LEU  32          2HD1      LEU  32  -2.952 -11.579   5.485
  637   3HD1  LEU  32          3HD1      LEU  32  -2.993 -10.956   3.835
  638   1HD2  LEU  32          1HD2      LEU  32  -0.929  -9.673   7.140
  639   2HD2  LEU  32          2HD2      LEU  32  -2.480  -8.839   7.035
  640   3HD2  LEU  32          3HD2      LEU  32  -2.429 -10.600   7.089
  641    H    MET  33           H        MET  33   1.560  -7.862   3.225
  642    HA   MET  33           HA       MET  33   0.192  -5.425   2.867
  643   1HB   MET  33          1HB       MET  33   2.917  -6.526   2.410
  644   2HB   MET  33          2HB       MET  33   2.556  -4.999   1.607
  645   1HG   MET  33          1HG       MET  33   2.258  -3.857   3.606
  646   2HG   MET  33          2HG       MET  33   1.808  -5.315   4.490
  647   1HE   MET  33          1HE       MET  33   4.396  -4.506   1.988
  648   2HE   MET  33          2HE       MET  33   5.044  -3.248   3.036
  649   3HE   MET  33          3HE       MET  33   5.977  -4.717   2.755
  650    H    MET  34           H        MET  34   1.645  -7.516   0.342
  651    HA   MET  34           HA       MET  34   0.998  -6.027  -1.943
  652   1HB   MET  34          2HB       MET  34   0.916  -9.030  -1.500
  653   2HB   MET  34          1HB       MET  34   1.083  -8.236  -3.067
  654   1HG   MET  34          1HG       MET  34   3.083  -7.017  -1.684
  655   2HG   MET  34          2HG       MET  34   3.084  -8.605  -0.916
  656   1HE   MET  34          1HE       MET  34   3.165  -6.596  -4.171
  657   2HE   MET  34          2HE       MET  34   4.763  -6.628  -3.429
  658   3HE   MET  34          3HE       MET  34   4.504  -7.374  -5.012
  659    H    GLN  35           H        GLN  35  -1.061  -8.398  -0.227
  660    HA   GLN  35           HA       GLN  35  -3.283  -8.470  -1.930
  661   1HB   GLN  35          1HB       GLN  35  -3.029  -9.854   0.052
  662   2HB   GLN  35          2HB       GLN  35  -3.083  -8.436   1.098
  663   1HG   GLN  35          2HG       GLN  35  -5.317  -8.682   1.220
  664   2HG   GLN  35          1HG       GLN  35  -5.406  -8.301  -0.499
  665   2HE2  GLN  35          2HE2      GLN  35  -4.920 -11.072   1.741
  666   1HE2  GLN  35          1HE2      GLN  35  -5.560 -12.235   0.682
  667    H    HIS  36           H        HIS  36  -3.517  -6.548   1.058
  668    HA   HIS  36           HA       HIS  36  -5.540  -4.805   0.171
  669   1HB   HIS  36          1HB       HIS  36  -3.424  -4.854   2.264
  670   2HB   HIS  36          2HB       HIS  36  -4.214  -3.304   1.979
  671    HD1  HIS  36           HD1      HIS  36  -5.276  -3.702   4.433
  672    HD2  HIS  36           HD2      HIS  36  -6.580  -6.304   1.449
  673    HE1  HIS  36           HE1      HIS  36  -7.385  -4.797   5.310
  674    H    ALA  37           H        ALA  37  -2.007  -4.196   0.211
  675    HA   ALA  37           HA       ALA  37  -1.873  -1.636  -0.873
  676   1HB   ALA  37          1HB       ALA  37   0.046  -2.961  -0.117
  677   2HB   ALA  37          3HB       ALA  37  -0.186  -4.099  -1.444
  678   3HB   ALA  37          2HB       ALA  37   0.325  -2.447  -1.780
  679    H    GLN  38           H        GLN  38  -2.568  -4.676  -2.560
  680    HA   GLN  38           HA       GLN  38  -2.478  -3.476  -5.230
  681   1HB   GLN  38          1HB       GLN  38  -3.055  -6.098  -3.941
  682   2HB   GLN  38          2HB       GLN  38  -3.801  -5.823  -5.516
  683   1HG   GLN  38          1HG       GLN  38  -1.210  -4.893  -5.869
  684   2HG   GLN  38          2HG       GLN  38  -0.995  -6.320  -4.854
  685   2HE2  GLN  38          2HE2      GLN  38  -1.322  -5.345  -8.072
  686   1HE2  GLN  38          1HE2      GLN  38  -1.795  -6.832  -8.742
  687    H    ASN  39           H        ASN  39  -4.933  -4.241  -2.799
  688    HA   ASN  39           HA       ASN  39  -7.122  -3.334  -4.591
  689   1HB   ASN  39          1HB       ASN  39  -6.830  -4.743  -1.953
  690   2HB   ASN  39          2HB       ASN  39  -8.367  -3.968  -2.342
  691   2HD2  ASN  39          2HD2      ASN  39  -7.771  -6.908  -2.164
  692   1HD2  ASN  39          1HD2      ASN  39  -8.181  -7.546  -3.683
  693    H    LEU  40           H        LEU  40  -4.948  -1.557  -3.337
  694    HA   LEU  40           HA       LEU  40  -4.822   0.583  -2.376
  695   1HB   LEU  40          2HB       LEU  40  -7.770   0.485  -3.103
  696   2HB   LEU  40          1HB       LEU  40  -6.842   1.952  -2.793
  697    HG   LEU  40           HG       LEU  40  -5.245   0.983  -4.653
  698   1HD1  LEU  40          1HD1      LEU  40  -7.697  -0.682  -4.823
  699   2HD1  LEU  40          2HD1      LEU  40  -7.083  -0.059  -6.354
  700   3HD1  LEU  40          3HD1      LEU  40  -6.048  -1.051  -5.327
  701   1HD2  LEU  40          1HD2      LEU  40  -7.824   2.475  -4.860
  702   2HD2  LEU  40          2HD2      LEU  40  -6.186   3.010  -5.235
  703   3HD2  LEU  40          3HD2      LEU  40  -7.056   1.974  -6.365
  704    H    GLU  41           H        GLU  41  -5.575  -1.785  -0.651
  705    HA   GLU  41           HA       GLU  41  -7.146  -0.382   1.476
  706   1HB   GLU  41          1HB       GLU  41  -6.487  -3.274   0.867
  707   2HB   GLU  41          2HB       GLU  41  -7.261  -2.775   2.370
  708   1HG   GLU  41          1HG       GLU  41  -8.420  -1.807  -0.214
  709   2HG   GLU  41          2HG       GLU  41  -8.718  -3.478   0.265
  710    H    PHE  42           H        PHE  42  -4.107  -0.289   0.687
  711    HA   PHE  42           HA       PHE  42  -2.537  -1.470   2.715
  712   1HB   PHE  42          1HB       PHE  42  -0.929   0.363   2.048
  713   2HB   PHE  42          2HB       PHE  42  -1.574  -0.576   0.707
  714    HD1  PHE  42           HD1      PHE  42  -2.442   2.505   2.718
  715    HD2  PHE  42           HD2      PHE  42  -2.389   0.588  -1.153
  716    HE1  PHE  42           HE1      PHE  42  -3.314   4.586   1.672
  717    HE2  PHE  42           HE2      PHE  42  -3.246   2.673  -2.193
  718    HZ   PHE  42           HZ       PHE  42  -3.708   4.674  -0.780
  719    H    GLU  43           H        GLU  43  -4.855   1.050   3.109
  720    HA   GLU  43           HA       GLU  43  -3.706   2.816   4.955
  721   1HB   GLU  43          1HB       GLU  43  -6.000   2.965   4.095
  722   2HB   GLU  43          2HB       GLU  43  -6.439   1.485   4.949
  723   1HG   GLU  43          1HG       GLU  43  -5.647   2.735   7.081
  724   2HG   GLU  43          2HG       GLU  43  -5.783   4.192   6.098
  725    H    GLU  44           H        GLU  44  -5.623  -0.027   5.946
  726    HA   GLU  44           HA       GLU  44  -4.261  -0.139   8.552
  727   1HB   GLU  44          1HB       GLU  44  -5.851  -2.034   8.875
  728   2HB   GLU  44          2HB       GLU  44  -6.669  -0.585   8.291
  729   1HG   GLU  44          1HG       GLU  44  -7.029  -1.469   6.179
  730   2HG   GLU  44          2HG       GLU  44  -5.631  -2.540   6.275
  731    H    ALA  45           H        ALA  45  -3.904  -1.561   5.406
  732    HA   ALA  45           HA       ALA  45  -2.542  -3.998   6.233
  733   1HB   ALA  45          1HB       ALA  45  -3.516  -2.657   3.842
  734   2HB   ALA  45          3HB       ALA  45  -1.921  -3.358   3.567
  735   3HB   ALA  45          2HB       ALA  45  -3.247  -4.379   4.121
  736    H    ALA  46           H        ALA  46  -1.402  -0.934   4.752
  737    HA   ALA  46           HA       ALA  46   1.330  -1.511   4.572
  738   1HB   ALA  46          1HB       ALA  46   1.528   1.026   4.965
  739   2HB   ALA  46          2HB       ALA  46   0.473   0.505   3.651
  740   3HB   ALA  46          3HB       ALA  46  -0.218   1.007   5.196
  741    H    GLN  47           H        GLN  47  -0.581  -0.945   7.452
  742    HA   GLN  47           HA       GLN  47   1.352  -0.098   9.314
  743   1HB   GLN  47          2HB       GLN  47  -0.827  -2.181   9.665
  744   2HB   GLN  47          1HB       GLN  47  -0.104  -1.210  10.946
  745   1HG   GLN  47          1HG       GLN  47  -0.848   0.803   9.388
  746   2HG   GLN  47          2HG       GLN  47  -2.008  -0.383   8.790
  747   2HE2  GLN  47          2HE2      GLN  47  -3.596  -1.248  10.338
  748   1HE2  GLN  47          1HE2      GLN  47  -3.908  -0.447  11.802
  749    H    ILE  48           H        ILE  48   0.823  -3.313   7.916
  750    HA   ILE  48           HA       ILE  48   2.420  -4.914   9.602
  751    HB   ILE  48           HB       ILE  48   2.038  -4.913   6.588
  752   1HG1  ILE  48          1HG1      ILE  48   0.689  -6.681   8.630
  753   2HG1  ILE  48          2HG1      ILE  48   0.035  -5.095   8.222
  754   1HG2  ILE  48          1HG2      ILE  48   3.051  -7.088   8.444
  755   2HG2  ILE  48          2HG2      ILE  48   2.642  -7.324   6.744
  756   3HG2  ILE  48          3HG2      ILE  48   3.985  -6.271   7.191
  757   1HD1  ILE  48          1HD1      ILE  48   0.745  -7.033   6.035
  758   2HD1  ILE  48          2HD1      ILE  48  -0.793  -7.187   6.886
  759   3HD1  ILE  48          3HD1      ILE  48  -0.416  -5.706   6.007
  760    H    ARG  49           H        ARG  49   3.322  -2.498   7.234
  761    HA   ARG  49           HA       ARG  49   6.011  -3.103   6.680
  762   1HB   ARG  49          1HB       ARG  49   4.879  -1.265   5.631
  763   2HB   ARG  49          2HB       ARG  49   4.508  -0.520   7.181
  764   1HG   ARG  49          1HG       ARG  49   7.339  -0.826   7.051
  765   2HG   ARG  49          2HG       ARG  49   6.811  -0.120   5.525
  766   1HD   ARG  49          1HD       ARG  49   7.277   1.626   7.259
  767   2HD   ARG  49          2HD       ARG  49   5.577   1.639   6.750
  768    HE   ARG  49           HE       ARG  49   5.045   0.337   8.806
  769   1HH1  ARG  49          1HH1      ARG  49   8.382   0.500   8.657
  770   2HH1  ARG  49          2HH1      ARG  49   8.611   1.040  10.286
  771   1HH2  ARG  49          1HH2      ARG  49   5.236   1.584  10.861
  772   2HH2  ARG  49          2HH2      ARG  49   6.830   1.654  11.534
  773    H    ASP  50           H        ASP  50   4.579  -1.720   9.612
  774    HA   ASP  50           HA       ASP  50   7.074  -1.037  10.907
  775   1HB   ASP  50          1HB       ASP  50   4.528  -0.395  11.308
  776   2HB   ASP  50          2HB       ASP  50   4.570  -1.795  12.381
  777    H    GLN  51           H        GLN  51   5.049  -3.942  10.785
  778    HA   GLN  51           HA       GLN  51   6.558  -5.354  12.857
  779   1HB   GLN  51          1HB       GLN  51   4.634  -6.340  10.723
  780   2HB   GLN  51          2HB       GLN  51   5.083  -7.201  12.195
  781   1HG   GLN  51          1HG       GLN  51   4.032  -5.533  13.582
  782   2HG   GLN  51          2HG       GLN  51   3.773  -4.470  12.197
  783   2HE2  GLN  51          2HE2      GLN  51   3.156  -8.002  12.643
  784   1HE2  GLN  51          1HE2      GLN  51   1.519  -7.918  12.202
  785    H    LEU  52           H        LEU  52   6.442  -5.360   9.294
  786    HA   LEU  52           HA       LEU  52   8.235  -7.529   8.831
  787   1HB   LEU  52          1HB       LEU  52   6.943  -5.345   7.412
  788   2HB   LEU  52          2HB       LEU  52   8.576  -5.613   6.799
  789    HG   LEU  52           HG       LEU  52   6.933  -7.013   5.597
  790   1HD1  LEU  52          1HD1      LEU  52   9.342  -7.771   6.296
  791   2HD1  LEU  52          2HD1      LEU  52   8.490  -8.878   7.373
  792   3HD1  LEU  52          3HD1      LEU  52   8.228  -8.966   5.632
  793   1HD2  LEU  52          1HD2      LEU  52   5.617  -7.192   7.952
  794   2HD2  LEU  52          2HD2      LEU  52   5.407  -8.367   6.653
  795   3HD2  LEU  52          3HD2      LEU  52   6.495  -8.721   7.995
  796    H    HIS  53           H        HIS  53   8.847  -4.035   9.248
  797    HA   HIS  53           HA       HIS  53  11.672  -4.124   8.761
  798   1HB   HIS  53          1HB       HIS  53   9.828  -2.205   9.043
  799   2HB   HIS  53          2HB       HIS  53  10.451  -2.194  10.694
  800    HD1  HIS  53           HD1      HIS  53  12.223  -2.559   7.326
  801    HD2  HIS  53           HD2      HIS  53  12.367  -0.214  10.770
  802    HE1  HIS  53           HE1      HIS  53  14.181  -0.980   7.036
  803    H    GLN  54           H        GLN  54   9.753  -4.404  11.758
  804    HA   GLN  54           HA       GLN  54  12.067  -4.591  13.504
  805   1HB   GLN  54          1HB       GLN  54   9.346  -4.169  13.728
  806   2HB   GLN  54          2HB       GLN  54   9.532  -5.797  14.384
  807   1HG   GLN  54          1HG       GLN  54  11.074  -5.069  16.041
  808   2HG   GLN  54          2HG       GLN  54  11.325  -3.520  15.236
  809   2HE2  GLN  54          2HE2      GLN  54   8.131  -5.033  15.715
  810   1HE2  GLN  54          1HE2      GLN  54   7.545  -3.845  16.776
  811    H    LEU  55           H        LEU  55   9.834  -6.978  12.061
  812    HA   LEU  55           HA       LEU  55  10.997  -9.289  13.322
  813   1HB   LEU  55          1HB       LEU  55   9.140  -8.628  11.092
  814   2HB   LEU  55          2HB       LEU  55   9.867 -10.235  11.050
  815    HG   LEU  55           HG       LEU  55   9.134  -9.903  13.719
  816   1HD1  LEU  55          1HD1      LEU  55   7.202  -8.556  11.852
  817   2HD1  LEU  55          2HD1      LEU  55   6.593  -9.416  13.264
  818   3HD1  LEU  55          3HD1      LEU  55   7.709  -8.067  13.469
  819   1HD2  LEU  55          1HD2      LEU  55   7.955 -11.339  11.347
  820   2HD2  LEU  55          2HD2      LEU  55   8.852 -12.010  12.710
  821   3HD2  LEU  55          3HD2      LEU  55   7.191 -11.459  12.932
  822    H    ARG  56           H        ARG  56  11.935  -7.355  10.570
  823    HA   ARG  56           HA       ARG  56  13.569  -9.341   9.238
  824   1HB   ARG  56          1HB       ARG  56  12.616  -7.254   8.241
  825   2HB   ARG  56          2HB       ARG  56  13.720  -6.309   9.240
  826   1HG   ARG  56          1HG       ARG  56  15.473  -8.045   8.108
  827   2HG   ARG  56          2HG       ARG  56  14.278  -7.921   6.815
  828   1HD   ARG  56          1HD       ARG  56  14.535  -5.530   6.687
  829   2HD   ARG  56          2HD       ARG  56  15.502  -5.498   8.175
  830    HE   ARG  56           HE       ARG  56  16.500  -7.153   5.919
  831   1HH1  ARG  56          1HH1      ARG  56  18.545  -6.887   7.767
  832   2HH1  ARG  56          2HH1      ARG  56  19.361  -5.405   7.394
  833   1HH2  ARG  56          1HH2      ARG  56  16.752  -4.138   5.493
  834   2HH2  ARG  56          2HH2      ARG  56  18.346  -3.849   6.107
  835    H    GLU  57           H        GLU  57  14.444  -6.531  11.297
  836    HA   GLU  57           HA       GLU  57  17.224  -7.080  11.484
  837   1HB   GLU  57          1HB       GLU  57  17.023  -5.652  13.538
  838   2HB   GLU  57          2HB       GLU  57  16.179  -4.974  12.145
  839   1HG   GLU  57          1HG       GLU  57  14.071  -5.488  12.997
  840   2HG   GLU  57          2HG       GLU  57  14.691  -6.784  14.021
  841    H    LEU  58           H        LEU  58  14.500  -8.613  13.030
  842    HA   LEU  58           HA       LEU  58  15.912  -9.752  15.286
  843   1HB   LEU  58          1HB       LEU  58  13.304  -9.516  14.344
  844   2HB   LEU  58          2HB       LEU  58  13.623 -11.247  14.234
  845    HG   LEU  58           HG       LEU  58  14.332  -9.696  16.720
  846   1HD1  LEU  58          1HD1      LEU  58  11.750  -9.818  15.761
  847   2HD1  LEU  58          2HD1      LEU  58  11.834 -11.247  16.792
  848   3HD1  LEU  58          3HD1      LEU  58  12.188  -9.654  17.462
  849   1HD2  LEU  58          1HD2      LEU  58  15.176 -12.059  16.219
  850   2HD2  LEU  58          2HD2      LEU  58  14.316 -11.859  17.747
  851   3HD2  LEU  58          3HD2      LEU  58  13.498 -12.585  16.363
  852    H    PHE  59           H        PHE  59  15.731 -10.557  11.908
  853    HA   PHE  59           HA       PHE  59  16.110 -13.332  11.837
  854   1HB   PHE  59          1HB       PHE  59  15.878 -11.691   9.936
  855   2HB   PHE  59          2HB       PHE  59  17.568 -11.249  10.184
  856    HD1  PHE  59           HD1      PHE  59  19.349 -13.105  10.061
  857    HD2  PHE  59           HD2      PHE  59  15.296 -13.606   8.658
  858    HE1  PHE  59           HE1      PHE  59  20.065 -15.061   8.690
  859    HE2  PHE  59           HE2      PHE  59  16.011 -15.561   7.288
  860    HZ   PHE  59           HZ       PHE  59  18.395 -16.289   7.304
  861    H    ILE  60           H        ILE  60  18.568 -10.798  12.386
  862    HA   ILE  60           HA       ILE  60  20.782 -12.669  12.584
  863    HB   ILE  60           HB       ILE  60  20.376  -9.795  13.474
  864   1HG1  ILE  60          1HG1      ILE  60  20.110 -10.150  11.053
  865   2HG1  ILE  60          2HG1      ILE  60  21.612  -9.287  11.383
  866   1HG2  ILE  60          1HG2      ILE  60  22.657 -11.665  13.692
  867   2HG2  ILE  60          2HG2      ILE  60  23.051 -10.089  13.006
  868   3HG2  ILE  60          3HG2      ILE  60  22.314 -10.195  14.605
  869   1HD1  ILE  60          1HD1      ILE  60  22.562 -11.793  11.491
  870   2HD1  ILE  60          2HD1      ILE  60  21.203 -12.072  10.403
  871   3HD1  ILE  60          3HD1      ILE  60  22.451 -10.902   9.974
  872    H    ALA  61           H        ALA  61  18.566 -11.146  14.897
  873    HA   ALA  61           HA       ALA  61  19.960 -11.880  17.298
  874   1HB   ALA  61          1HB       ALA  61  18.256 -10.201  17.343
  875   2HB   ALA  61          3HB       ALA  61  17.084 -11.273  16.575
  876   3HB   ALA  61          2HB       ALA  61  17.590 -11.567  18.239
  877    H    ALA  62           H        ALA  62  17.982 -13.694  15.073
  878    HA   ALA  62           HA       ALA  62  17.893 -15.985  17.009
  879   1HB   ALA  62          1HB       ALA  62  16.213 -15.473  14.535
  880   2HB   ALA  62          3HB       ALA  62  15.913 -16.675  15.791
  881   3HB   ALA  62          2HB       ALA  62  15.746 -14.958  16.156
  882    H    SER  63           H        SER  63  17.998 -15.430  13.460
  883    HA   SER  63           HA       SER  63  19.164 -16.611  11.775
  884   1HB   SER  63          1HB       SER  63  20.899 -15.627  13.556
  885   2HB   SER  63          2HB       SER  63  21.207 -17.338  13.837
  886    HG   SER  63           HG       SER  63  22.175 -15.868  11.923

  No H/Q in entry =         886
  Start of MODEL    6
    1    H    LEU   8           H        LEU   8 -30.805  24.989 -27.011
    2    HA   LEU   8           HA       LEU   8 -28.955  24.316 -25.511
    3   1HB   LEU   8          1HB       LEU   8 -30.262  22.433 -27.369
    4   2HB   LEU   8          2HB       LEU   8 -28.791  21.804 -26.625
    5    HG   LEU   8           HG       LEU   8 -30.226  23.140 -24.577
    6   1HD1  LEU   8          1HD1      LEU   8 -31.948  21.759 -26.557
    7   2HD1  LEU   8          2HD1      LEU   8 -32.236  21.334 -24.869
    8   3HD1  LEU   8          3HD1      LEU   8 -32.359  23.015 -25.388
    9   1HD2  LEU   8          1HD2      LEU   8 -29.352  20.384 -25.280
   10   2HD2  LEU   8          2HD2      LEU   8 -29.042  21.323 -23.820
   11   3HD2  LEU   8          3HD2      LEU   8 -30.595  20.517 -24.037
   12    H    GLU   9           H        GLU   9 -26.722  24.177 -25.370
   13    HA   GLU   9           HA       GLU   9 -25.094  23.374 -27.688
   14   1HB   GLU   9          1HB       GLU   9 -23.950  25.601 -27.748
   15   2HB   GLU   9          2HB       GLU   9 -25.653  25.702 -28.199
   16   1HG   GLU   9          1HG       GLU   9 -26.237  26.831 -26.285
   17   2HG   GLU   9          2HG       GLU   9 -25.011  26.021 -25.309
   18    HA   PRO  10           HA       PRO  10 -23.337  23.010 -23.314
   19   1HB   PRO  10          1HB       PRO  10 -23.552  20.298 -23.019
   20   2HB   PRO  10          2HB       PRO  10 -24.826  21.427 -22.516
   21   1HG   PRO  10          2HG       PRO  10 -24.650  19.740 -24.959
   22   2HG   PRO  10          1HG       PRO  10 -26.057  20.140 -23.961
   23   1HD   PRO  10          1HD       PRO  10 -25.505  21.334 -26.356
   24   2HD   PRO  10          2HD       PRO  10 -26.432  22.112 -25.055
   25    H    ASP  11           H        ASP  11 -23.063  20.575 -25.927
   26    HA   ASP  11           HA       ASP  11 -21.169  19.694 -27.020
   27   1HB   ASP  11          1HB       ASP  11 -20.674  22.475 -26.352
   28   2HB   ASP  11          2HB       ASP  11 -19.167  21.558 -26.338
   29    H    ASN  12           H        ASN  12 -19.357  21.287 -24.422
   30    HA   ASN  12           HA       ASN  12 -19.027  18.757 -22.934
   31   1HB   ASN  12          1HB       ASN  12 -17.473  18.943 -25.037
   32   2HB   ASN  12          2HB       ASN  12 -16.571  20.095 -24.053
   33   2HD2  ASN  12          2HD2      ASN  12 -16.385  19.101 -21.588
   34   1HD2  ASN  12          1HD2      ASN  12 -15.784  17.514 -21.556
   35    H    VAL  13           H        VAL  13 -19.821  21.719 -22.582
   36    HA   VAL  13           HA       VAL  13 -17.751  22.779 -20.797
   37    HB   VAL  13           HB       VAL  13 -20.385  23.607 -21.952
   38   1HG1  VAL  13          1HG1      VAL  13 -19.333  24.523 -19.318
   39   2HG1  VAL  13          2HG1      VAL  13 -19.875  25.782 -20.430
   40   3HG1  VAL  13          3HG1      VAL  13 -20.990  24.513 -19.924
   41   1HG2  VAL  13          1HG2      VAL  13 -18.037  24.023 -22.906
   42   2HG2  VAL  13          2HG2      VAL  13 -19.113  25.417 -22.799
   43   3HG2  VAL  13          3HG2      VAL  13 -17.842  25.190 -21.598
   44    HA   PRO  14           HA       PRO  14 -20.973  21.862 -17.420
   45   1HB   PRO  14          1HB       PRO  14 -23.307  20.602 -18.078
   46   2HB   PRO  14          2HB       PRO  14 -23.118  22.366 -18.127
   47   1HG   PRO  14          2HG       PRO  14 -23.081  20.397 -20.352
   48   2HG   PRO  14          1HG       PRO  14 -23.738  22.040 -20.304
   49   1HD   PRO  14          1HD       PRO  14 -21.346  21.372 -21.463
   50   2HD   PRO  14          2HD       PRO  14 -21.748  22.985 -20.845
   51    H    MET  15           H        MET  15 -21.516  19.329 -19.899
   52    HA   MET  15           HA       MET  15 -21.119  17.006 -19.818
   53   1HB   MET  15          1HB       MET  15 -18.852  18.378 -19.217
   54   2HB   MET  15          2HB       MET  15 -19.020  17.403 -17.755
   55   1HG   MET  15          1HG       MET  15 -17.785  15.986 -19.153
   56   2HG   MET  15          2HG       MET  15 -19.436  15.433 -19.426
   57   1HE   MET  15          1HE       MET  15 -19.017  14.296 -21.429
   58   2HE   MET  15          2HE       MET  15 -18.425  14.926 -22.964
   59   3HE   MET  15          3HE       MET  15 -17.298  14.661 -21.636
   60    H    ASP  16           H        ASP  16 -20.298  15.363 -17.684
   61    HA   ASP  16           HA       ASP  16 -21.835  15.963 -15.270
   62   1HB   ASP  16          1HB       ASP  16 -22.925  14.405 -17.557
   63   2HB   ASP  16          2HB       ASP  16 -23.222  13.738 -15.951
   64    H    MET  17           H        MET  17 -19.415  15.404 -14.830
   65    HA   MET  17           HA       MET  17 -19.250  12.817 -13.596
   66   1HB   MET  17          1HB       MET  17 -17.520  11.880 -15.203
   67   2HB   MET  17          2HB       MET  17 -19.149  11.983 -15.865
   68   1HG   MET  17          1HG       MET  17 -18.497  14.240 -16.835
   69   2HG   MET  17          2HG       MET  17 -16.836  13.869 -16.370
   70   1HE   MET  17          1HE       MET  17 -15.659  13.866 -18.028
   71   2HE   MET  17          2HE       MET  17 -15.490  12.647 -19.289
   72   3HE   MET  17          3HE       MET  17 -16.511  14.056 -19.567
   73    H    SER  18           H        SER  18 -17.322  15.352 -15.211
   74    HA   SER  18           HA       SER  18 -15.982  16.160 -12.799
   75   1HB   SER  18          1HB       SER  18 -13.703  15.192 -13.720
   76   2HB   SER  18          2HB       SER  18 -14.779  14.152 -12.792
   77    HG   SER  18           HG       SER  18 -14.512  12.971 -14.553
   78    HA   PRO  19           HA       PRO  19 -15.308  19.297 -15.878
   79   1HB   PRO  19          1HB       PRO  19 -14.211  21.192 -14.245
   80   2HB   PRO  19          2HB       PRO  19 -15.948  20.833 -14.286
   81   1HG   PRO  19          1HG       PRO  19 -13.914  20.088 -12.283
   82   2HG   PRO  19          2HG       PRO  19 -15.644  20.386 -12.081
   83   1HD   PRO  19          1HD       PRO  19 -14.413  17.881 -12.183
   84   2HD   PRO  19          2HD       PRO  19 -16.151  18.200 -12.356
   85    H    LYS  20           H        LYS  20 -13.419  17.326 -16.125
   86    HA   LYS  20           HA       LYS  20 -11.233  16.984 -16.930
   87   1HB   LYS  20          1HB       LYS  20 -11.912  19.242 -17.966
   88   2HB   LYS  20          2HB       LYS  20 -10.916  19.981 -16.712
   89   1HG   LYS  20          1HG       LYS  20  -9.722  17.742 -18.286
   90   2HG   LYS  20          2HG       LYS  20  -9.892  19.305 -19.085
   91   1HD   LYS  20          1HD       LYS  20  -8.878  20.136 -16.730
   92   2HD   LYS  20          2HD       LYS  20  -8.157  18.528 -16.798
   93   1HE   LYS  20          1HE       LYS  20  -7.816  19.511 -19.391
   94   2HE   LYS  20          2HE       LYS  20  -7.474  20.906 -18.347
   95   1HZ   LYS  20          1HZ       LYS  20  -6.131  19.353 -16.947
   96   2HZ   LYS  20          2HZ       LYS  20  -6.292  18.189 -18.169
   97   3HZ   LYS  20          3HZ       LYS  20  -5.480  19.647 -18.489
   98    H    ALA  21           H        ALA  21 -10.810  19.822 -14.776
   99    HA   ALA  21           HA       ALA  21  -8.351  19.223 -13.658
  100   1HB   ALA  21          1HB       ALA  21  -9.445  21.263 -13.134
  101   2HB   ALA  21          3HB       ALA  21 -10.875  20.430 -12.524
  102   3HB   ALA  21          2HB       ALA  21  -9.375  20.398 -11.598
  103    H    LEU  22           H        LEU  22 -11.499  17.984 -12.492
  104    HA   LEU  22           HA       LEU  22 -10.246  16.348 -10.408
  105   1HB   LEU  22          1HB       LEU  22 -13.023  16.675 -11.568
  106   2HB   LEU  22          2HB       LEU  22 -12.676  15.510 -10.289
  107    HG   LEU  22           HG       LEU  22 -11.640  17.465  -8.996
  108   1HD1  LEU  22          1HD1      LEU  22 -12.805  18.823 -11.387
  109   2HD1  LEU  22          2HD1      LEU  22 -12.927  19.647  -9.832
  110   3HD1  LEU  22          3HD1      LEU  22 -11.345  19.213 -10.481
  111   1HD2  LEU  22          1HD2      LEU  22 -14.021  16.415  -8.768
  112   2HD2  LEU  22          2HD2      LEU  22 -13.715  17.976  -8.005
  113   3HD2  LEU  22          3HD2      LEU  22 -14.573  17.900  -9.545
  114    H    GLN  23           H        GLN  23 -11.809  15.778 -13.552
  115    HA   GLN  23           HA       GLN  23 -11.799  12.982 -13.672
  116   1HB   GLN  23          1HB       GLN  23 -12.617  14.784 -15.319
  117   2HB   GLN  23          2HB       GLN  23 -10.969  14.790 -15.949
  118   1HG   GLN  23          1HG       GLN  23 -11.113  12.406 -16.458
  119   2HG   GLN  23          2HG       GLN  23 -12.722  12.325 -15.739
  120   2HE2  GLN  23          2HE2      GLN  23 -11.453  14.942 -17.833
  121   1HE2  GLN  23          1HE2      GLN  23 -12.578  14.703 -19.081
  122    H    GLN  24           H        GLN  24  -9.090  15.196 -14.410
  123    HA   GLN  24           HA       GLN  24  -7.272  13.002 -15.079
  124   1HB   GLN  24          1HB       GLN  24  -7.417  15.561 -15.789
  125   2HB   GLN  24          2HB       GLN  24  -6.389  15.777 -14.372
  126   1HG   GLN  24          2HG       GLN  24  -5.010  15.455 -16.380
  127   2HG   GLN  24          1HG       GLN  24  -4.811  14.093 -15.275
  128   2HE2  GLN  24          2HE2      GLN  24  -4.995  12.084 -16.266
  129   1HE2  GLN  24          1HE2      GLN  24  -5.862  11.772 -17.691
  130    H    LYS  25           H        LYS  25  -7.662  15.243 -12.314
  131    HA   LYS  25           HA       LYS  25  -5.435  14.299 -10.789
  132   1HB   LYS  25          1HB       LYS  25  -7.874  15.922 -10.446
  133   2HB   LYS  25          2HB       LYS  25  -7.294  15.172  -8.960
  134   1HG   LYS  25          2HG       LYS  25  -6.199  17.311  -9.150
  135   2HG   LYS  25          1HG       LYS  25  -4.995  16.072  -9.509
  136   1HD   LYS  25          1HD       LYS  25  -5.943  16.464 -11.996
  137   2HD   LYS  25          2HD       LYS  25  -6.263  18.063 -11.323
  138   1HE   LYS  25          1HE       LYS  25  -4.063  18.605 -11.390
  139   2HE   LYS  25          2HE       LYS  25  -3.611  17.098 -10.569
  140   1HZ   LYS  25          1HZ       LYS  25  -4.085  15.944 -12.716
  141   2HZ   LYS  25          2HZ       LYS  25  -4.205  17.471 -13.453
  142   3HZ   LYS  25          3HZ       LYS  25  -2.737  16.977 -12.761
  143    H    ILE  26           H        ILE  26  -8.793  13.167 -11.017
  144    HA   ILE  26           HA       ILE  26  -8.584  11.305  -8.792
  145    HB   ILE  26           HB       ILE  26 -10.487  11.561 -11.142
  146   1HG1  ILE  26          1HG1      ILE  26 -10.876  12.396  -8.257
  147   2HG1  ILE  26          2HG1      ILE  26 -10.258  13.497  -9.490
  148   1HG2  ILE  26          1HG2      ILE  26 -10.196   9.414  -9.367
  149   2HG2  ILE  26          2HG2      ILE  26 -11.540  10.351  -8.714
  150   3HG2  ILE  26          3HG2      ILE  26 -11.604   9.756 -10.373
  151   1HD1  ILE  26          1HD1      ILE  26 -12.787  11.965 -10.016
  152   2HD1  ILE  26          2HD1      ILE  26 -12.843  13.411  -9.008
  153   3HD1  ILE  26          3HD1      ILE  26 -12.269  13.517 -10.673
  154    H    HIS  27           H        HIS  27  -8.664  10.863 -12.353
  155    HA   HIS  27           HA       HIS  27  -8.172   8.042 -12.313
  156   1HB   HIS  27          1HB       HIS  27  -8.023  10.313 -14.252
  157   2HB   HIS  27          2HB       HIS  27  -7.264   8.790 -14.718
  158    HD1  HIS  27           HD1      HIS  27  -8.805   6.738 -15.076
  159    HD2  HIS  27           HD2      HIS  27 -10.867  10.203 -14.016
  160    HE1  HIS  27           HE1      HIS  27 -11.260   6.265 -15.486
  161    H    GLU  28           H        GLU  28  -6.044  10.794 -11.962
  162    HA   GLU  28           HA       GLU  28  -3.591   9.340 -12.624
  163   1HB   GLU  28          1HB       GLU  28  -4.387  12.027 -11.542
  164   2HB   GLU  28          2HB       GLU  28  -2.700  11.523 -11.435
  165   1HG   GLU  28          1HG       GLU  28  -4.151  11.223 -14.045
  166   2HG   GLU  28          2HG       GLU  28  -3.551  12.814 -13.572
  167    H    LEU  29           H        LEU  29  -4.764  10.815  -9.567
  168    HA   LEU  29           HA       LEU  29  -2.886   9.645  -7.825
  169   1HB   LEU  29          1HB       LEU  29  -5.535  10.909  -7.724
  170   2HB   LEU  29          2HB       LEU  29  -5.249   9.795  -6.386
  171    HG   LEU  29           HG       LEU  29  -2.886  11.036  -6.341
  172   1HD1  LEU  29          1HD1      LEU  29  -3.904  12.430  -8.369
  173   2HD1  LEU  29          2HD1      LEU  29  -4.618  13.370  -7.058
  174   3HD1  LEU  29          3HD1      LEU  29  -2.865  13.199  -7.168
  175   1HD2  LEU  29          1HD2      LEU  29  -5.221  11.082  -4.826
  176   2HD2  LEU  29          2HD2      LEU  29  -3.673  11.781  -4.353
  177   3HD2  LEU  29          3HD2      LEU  29  -4.895  12.788  -5.131
  178    H    GLU  30           H        GLU  30  -5.795   8.246  -9.253
  179    HA   GLU  30           HA       GLU  30  -6.031   5.966  -7.520
  180   1HB   GLU  30          1HB       GLU  30  -7.627   7.027  -9.285
  181   2HB   GLU  30          2HB       GLU  30  -6.753   6.030 -10.448
  182   1HG   GLU  30          1HG       GLU  30  -7.535   4.559  -8.034
  183   2HG   GLU  30          2HG       GLU  30  -8.912   5.191  -8.938
  184    H    GLY  31           H        GLY  31  -4.662   6.184 -10.834
  185   1HA   GLY  31          2HA       GLY  31  -3.023   4.874 -11.884
  186   2HA   GLY  31          1HA       GLY  31  -3.576   3.552 -10.857
  187    H    LEU  32           H        LEU  32  -2.472   6.463  -9.319
  188    HA   LEU  32           HA       LEU  32   0.319   5.644  -9.056
  189   1HB   LEU  32          1HB       LEU  32  -1.089   7.970  -8.879
  190   2HB   LEU  32          2HB       LEU  32  -0.895   7.584  -7.168
  191    HG   LEU  32           HG       LEU  32   1.563   7.270  -7.586
  192   1HD1  LEU  32          1HD1      LEU  32   0.621   7.726 -10.326
  193   2HD1  LEU  32          2HD1      LEU  32   1.994   8.743  -9.889
  194   3HD1  LEU  32          3HD1      LEU  32   2.123   6.989  -9.763
  195   1HD2  LEU  32          1HD2      LEU  32   0.606   9.406  -6.720
  196   2HD2  LEU  32          2HD2      LEU  32   2.057   9.665  -7.687
  197   3HD2  LEU  32          3HD2      LEU  32   0.467   9.987  -8.380
  198    H    MET  33           H        MET  33  -2.642   5.137  -7.252
  199    HA   MET  33           HA       MET  33  -1.550   4.511  -4.687
  200   1HB   MET  33          1HB       MET  33  -4.043   4.307  -6.178
  201   2HB   MET  33          2HB       MET  33  -3.820   2.919  -5.113
  202   1HG   MET  33          1HG       MET  33  -3.880   4.202  -3.196
  203   2HG   MET  33          2HG       MET  33  -3.217   5.623  -4.003
  204   1HE   MET  33          1HE       MET  33  -5.755   3.069  -4.476
  205   2HE   MET  33          2HE       MET  33  -6.906   3.731  -3.309
  206   3HE   MET  33          3HE       MET  33  -7.227   3.860  -5.036
  207    H    MET  34           H        MET  34  -2.252   2.426  -7.507
  208    HA   MET  34           HA       MET  34  -1.272   0.015  -6.169
  209   1HB   MET  34          1HB       MET  34  -3.078   0.068  -7.872
  210   2HB   MET  34          2HB       MET  34  -1.917   0.638  -9.070
  211   1HG   MET  34          1HG       MET  34  -1.404  -1.507  -9.517
  212   2HG   MET  34          2HG       MET  34  -0.741  -1.639  -7.889
  213   1HE   MET  34          1HE       MET  34  -3.129  -0.973  -6.193
  214   2HE   MET  34          2HE       MET  34  -3.971  -2.479  -5.835
  215   3HE   MET  34          3HE       MET  34  -2.213  -2.416  -5.737
  216    H    GLN  35           H        GLN  35   0.034   2.419  -8.410
  217    HA   GLN  35           HA       GLN  35   2.284   1.106  -9.440
  218   1HB   GLN  35          1HB       GLN  35   1.567   3.348 -10.073
  219   2HB   GLN  35          2HB       GLN  35   1.922   3.953  -8.456
  220   1HG   GLN  35          2HG       GLN  35   3.990   4.450  -9.209
  221   2HG   GLN  35          1HG       GLN  35   4.294   2.714  -9.269
  222   2HE2  GLN  35          2HE2      GLN  35   3.188   5.476 -11.249
  223   1HE2  GLN  35          1HE2      GLN  35   3.514   4.743 -12.744
  224    H    HIS  36           H        HIS  36   2.757   3.442  -6.790
  225    HA   HIS  36           HA       HIS  36   5.195   2.373  -5.864
  226   1HB   HIS  36          1HB       HIS  36   2.973   4.025  -4.689
  227   2HB   HIS  36          2HB       HIS  36   4.360   3.584  -3.693
  228    HD1  HIS  36           HD1      HIS  36   3.605   6.515  -4.898
  229    HD2  HIS  36           HD2      HIS  36   6.592   3.937  -6.244
  230    HE1  HIS  36           HE1      HIS  36   5.294   7.953  -6.120
  231    H    ALA  37           H        ALA  37   1.909   1.782  -4.530
  232    HA   ALA  37           HA       ALA  37   2.492   0.024  -2.440
  233   1HB   ALA  37          1HB       ALA  37   0.274  -0.149  -4.512
  234   2HB   ALA  37          2HB       ALA  37   0.227  -0.861  -2.899
  235   3HB   ALA  37          3HB       ALA  37   0.263   0.892  -3.089
  236    H    GLN  38           H        GLN  38   2.342  -0.691  -5.930
  237    HA   GLN  38           HA       GLN  38   2.673  -3.548  -5.701
  238   1HB   GLN  38          1HB       GLN  38   2.815  -1.414  -7.774
  239   2HB   GLN  38          2HB       GLN  38   3.651  -2.921  -8.151
  240   1HG   GLN  38          1HG       GLN  38   1.603  -4.197  -7.712
  241   2HG   GLN  38          2HG       GLN  38   0.757  -2.713  -7.271
  242   2HE2  GLN  38          2HE2      GLN  38   1.471  -0.923  -9.243
  243   1HE2  GLN  38          1HE2      GLN  38   1.016  -1.499 -10.773
  244    H    ASN  39           H        ASN  39   4.900  -0.810  -5.860
  245    HA   ASN  39           HA       ASN  39   7.266  -2.596  -5.943
  246   1HB   ASN  39          1HB       ASN  39   6.836   0.409  -5.934
  247   2HB   ASN  39          2HB       ASN  39   8.428  -0.348  -6.018
  248   2HD2  ASN  39          2HD2      ASN  39   8.827   0.428  -8.208
  249   1HD2  ASN  39          1HD2      ASN  39   7.988  -0.204  -9.540
  250    H    LEU  40           H        LEU  40   5.259  -2.179  -3.584
  251    HA   LEU  40           HA       LEU  40   5.380  -2.085  -1.247
  252   1HB   LEU  40          1HB       LEU  40   8.116  -2.919  -2.186
  253   2HB   LEU  40          2HB       LEU  40   7.811  -2.697  -0.464
  254    HG   LEU  40           HG       LEU  40   5.695  -4.184  -0.939
  255   1HD1  LEU  40          1HD1      LEU  40   7.297  -4.378  -3.414
  256   2HD1  LEU  40          2HD1      LEU  40   6.796  -5.928  -2.738
  257   3HD1  LEU  40          3HD1      LEU  40   5.585  -4.713  -3.152
  258   1HD2  LEU  40          1HD2      LEU  40   8.004  -4.651   0.297
  259   2HD2  LEU  40          2HD2      LEU  40   6.876  -5.967  -0.033
  260   3HD2  LEU  40          3HD2      LEU  40   8.268  -5.714  -1.086
  261    H    GLU  41           H        GLU  41   6.040   0.391  -2.936
  262    HA   GLU  41           HA       GLU  41   8.007   1.936  -1.482
  263   1HB   GLU  41          1HB       GLU  41   5.860   2.339  -3.509
  264   2HB   GLU  41          2HB       GLU  41   6.368   3.771  -2.613
  265   1HG   GLU  41          1HG       GLU  41   8.281   1.891  -4.026
  266   2HG   GLU  41          2HG       GLU  41   7.678   3.394  -4.725
  267    H    PHE  42           H        PHE  42   4.457   1.731  -1.361
  268    HA   PHE  42           HA       PHE  42   2.922   2.468   0.267
  269   1HB   PHE  42          1HB       PHE  42   5.291   1.228   1.588
  270   2HB   PHE  42          2HB       PHE  42   4.130   2.041   2.636
  271    HD1  PHE  42           HD1      PHE  42   1.556   1.561   1.298
  272    HD2  PHE  42           HD2      PHE  42   4.923  -1.088   1.845
  273    HE1  PHE  42           HE1      PHE  42   0.034  -0.406   1.147
  274    HE2  PHE  42           HE2      PHE  42   3.397  -3.054   1.694
  275    HZ   PHE  42           HZ       PHE  42   0.952  -2.710   1.348
  276    H    GLU  43           H        GLU  43   2.936   3.818   2.479
  277    HA   GLU  43           HA       GLU  43   3.171   5.894   3.526
  278   1HB   GLU  43          1HB       GLU  43   5.547   5.321   3.649
  279   2HB   GLU  43          2HB       GLU  43   5.789   5.826   1.980
  280   1HG   GLU  43          1HG       GLU  43   4.941   8.117   2.663
  281   2HG   GLU  43          2HG       GLU  43   5.065   7.568   4.337
  282    H    GLU  44           H        GLU  44   4.583   6.226   0.302
  283    HA   GLU  44           HA       GLU  44   3.089   8.701  -0.218
  284   1HB   GLU  44          1HB       GLU  44   4.392   8.677  -2.288
  285   2HB   GLU  44          2HB       GLU  44   5.449   8.262  -0.939
  286   1HG   GLU  44          1HG       GLU  44   5.233   5.876  -1.470
  287   2HG   GLU  44          2HG       GLU  44   4.111   6.252  -2.777
  288    H    ALA  45           H        ALA  45   2.946   5.282  -1.140
  289    HA   ALA  45           HA       ALA  45   0.891   5.688  -3.187
  290   1HB   ALA  45          1HB       ALA  45   1.310   3.027  -1.969
  291   2HB   ALA  45          3HB       ALA  45   2.769   3.797  -2.591
  292   3HB   ALA  45          2HB       ALA  45   1.397   3.514  -3.662
  293    H    ALA  46           H        ALA  46   0.934   4.352   0.134
  294    HA   ALA  46           HA       ALA  46  -1.916   3.803   0.152
  295   1HB   ALA  46          1HB       ALA  46   0.009   2.733   1.474
  296   2HB   ALA  46          3HB       ALA  46  -0.084   4.145   2.530
  297   3HB   ALA  46          2HB       ALA  46  -1.473   3.069   2.369
  298    H    GLN  47           H        GLN  47  -0.013   6.654   0.778
  299    HA   GLN  47           HA       GLN  47  -1.965   7.957   2.517
  300   1HB   GLN  47          1HB       GLN  47   0.559   8.640   1.061
  301   2HB   GLN  47          2HB       GLN  47  -0.455   9.966   1.630
  302   1HG   GLN  47          1HG       GLN  47   0.236   7.700   3.484
  303   2HG   GLN  47          2HG       GLN  47   1.384   9.015   3.229
  304   2HE2  GLN  47          2HE2      GLN  47   0.822   9.351   5.668
  305   1HE2  GLN  47          1HE2      GLN  47  -0.507  10.350   6.010
  306    H    ILE  48           H        ILE  48  -1.601   7.528  -0.913
  307    HA   ILE  48           HA       ILE  48  -3.045   9.873  -1.791
  308    HB   ILE  48           HB       ILE  48  -2.521   7.149  -3.022
  309   1HG1  ILE  48          1HG1      ILE  48  -1.160   9.770  -3.650
  310   2HG1  ILE  48          2HG1      ILE  48  -0.589   8.732  -2.342
  311   1HG2  ILE  48          1HG2      ILE  48  -4.316   9.125  -3.887
  312   2HG2  ILE  48          2HG2      ILE  48  -2.872   9.361  -4.872
  313   3HG2  ILE  48          3HG2      ILE  48  -3.677   7.792  -4.848
  314   1HD1  ILE  48          1HD1      ILE  48  -0.854   6.900  -4.332
  315   2HD1  ILE  48          2HD1      ILE  48  -0.436   8.332  -5.274
  316   3HD1  ILE  48          3HD1      ILE  48   0.647   7.766  -4.001
  317    H    ARG  49           H        ARG  49  -4.028   6.662  -0.695
  318    HA   ARG  49           HA       ARG  49  -6.641   6.492  -1.736
  319   1HB   ARG  49          2HB       ARG  49  -7.035   5.026   0.185
  320   2HB   ARG  49          1HB       ARG  49  -5.391   4.780  -0.402
  321   1HG   ARG  49          2HG       ARG  49  -4.890   5.042   1.821
  322   2HG   ARG  49          1HG       ARG  49  -4.921   6.750   1.379
  323   1HD   ARG  49          1HD       ARG  49  -7.527   6.477   1.893
  324   2HD   ARG  49          2HD       ARG  49  -6.932   5.162   2.927
  325    HE   ARG  49           HE       ARG  49  -5.368   7.612   3.193
  326   1HH1  ARG  49          1HH1      ARG  49  -8.570   6.738   3.839
  327   2HH1  ARG  49          2HH1      ARG  49  -8.514   7.140   5.522
  328   1HH2  ARG  49          1HH2      ARG  49  -5.103   7.762   5.532
  329   2HH2  ARG  49          2HH2      ARG  49  -6.552   7.719   6.481
  330    H    ASP  50           H        ASP  50  -5.370   8.557   0.800
  331    HA   ASP  50           HA       ASP  50  -7.969   9.338   1.874
  332   1HB   ASP  50          1HB       ASP  50  -5.301   9.476   2.618
  333   2HB   ASP  50          2HB       ASP  50  -5.690  11.154   2.238
  334    H    GLN  51           H        GLN  51  -5.632  10.708  -0.441
  335    HA   GLN  51           HA       GLN  51  -7.122  13.167  -0.872
  336   1HB   GLN  51          2HB       GLN  51  -5.034  11.735  -2.550
  337   2HB   GLN  51          1HB       GLN  51  -5.484  13.435  -2.692
  338   1HG   GLN  51          1HG       GLN  51  -4.580  13.966  -0.561
  339   2HG   GLN  51          2HG       GLN  51  -4.487  12.269  -0.090
  340   2HE2  GLN  51          2HE2      GLN  51  -3.495  13.456  -3.293
  341   1HE2  GLN  51          1HE2      GLN  51  -1.841  13.135  -3.087
  342    H    LEU  52           H        LEU  52  -6.833  10.072  -2.630
  343    HA   LEU  52           HA       LEU  52  -8.513  10.771  -4.845
  344   1HB   LEU  52          1HB       LEU  52  -6.870   8.773  -4.330
  345   2HB   LEU  52          2HB       LEU  52  -8.320   8.002  -3.688
  346    HG   LEU  52           HG       LEU  52  -8.017   7.417  -6.057
  347   1HD1  LEU  52          1HD1      LEU  52 -10.323   7.974  -4.949
  348   2HD1  LEU  52          2HD1      LEU  52 -10.284   9.395  -5.994
  349   3HD1  LEU  52          3HD1      LEU  52 -10.242   7.780  -6.699
  350   1HD2  LEU  52          1HD2      LEU  52  -7.216  10.133  -6.241
  351   2HD2  LEU  52          2HD2      LEU  52  -7.273   8.942  -7.542
  352   3HD2  LEU  52          3HD2      LEU  52  -8.670   9.971  -7.227
  353    H    HIS  53           H        HIS  53  -9.216   9.361  -1.655
  354    HA   HIS  53           HA       HIS  53 -12.027   8.868  -2.203
  355   1HB   HIS  53          1HB       HIS  53 -10.148   8.870   0.131
  356   2HB   HIS  53          2HB       HIS  53 -11.881   8.867   0.461
  357    HD1  HIS  53           HD1      HIS  53 -10.250   7.120  -2.475
  358    HD2  HIS  53           HD2      HIS  53 -12.141   6.148   1.111
  359    HE1  HIS  53           HE1      HIS  53 -10.587   4.610  -2.500
  360    H    GLN  54           H        GLN  54 -10.170  11.539  -0.790
  361    HA   GLN  54           HA       GLN  54 -12.551  13.021   0.057
  362   1HB   GLN  54          1HB       GLN  54 -10.069  12.984   0.932
  363   2HB   GLN  54          2HB       GLN  54  -9.800  14.172  -0.345
  364   1HG   GLN  54          1HG       GLN  54 -11.191  15.753   0.644
  365   2HG   GLN  54          2HG       GLN  54 -12.129  14.536   1.510
  366   2HE2  GLN  54          2HE2      GLN  54  -9.011  16.275   1.522
  367   1HE2  GLN  54          1HE2      GLN  54  -8.647  15.947   3.147
  368    H    LEU  55           H        LEU  55 -10.403  12.959  -2.745
  369    HA   LEU  55           HA       LEU  55 -11.064  15.432  -3.954
  370   1HB   LEU  55          1HB       LEU  55  -9.977  12.793  -4.710
  371   2HB   LEU  55          2HB       LEU  55 -10.680  13.705  -6.046
  372    HG   LEU  55           HG       LEU  55  -8.954  15.261  -4.208
  373   1HD1  LEU  55          1HD1      LEU  55  -7.994  12.787  -4.898
  374   2HD1  LEU  55          2HD1      LEU  55  -7.420  13.773  -6.242
  375   3HD1  LEU  55          3HD1      LEU  55  -6.979  14.197  -4.588
  376   1HD2  LEU  55          1HD2      LEU  55  -9.372  15.012  -7.196
  377   2HD2  LEU  55          2HD2      LEU  55  -9.832  16.356  -6.149
  378   3HD2  LEU  55          3HD2      LEU  55  -8.131  16.050  -6.497
  379    H    ARG  56           H        ARG  56 -12.852  12.383  -3.887
  380    HA   ARG  56           HA       ARG  56 -14.681  12.862  -6.001
  381   1HB   ARG  56          1HB       ARG  56 -16.004  11.168  -4.869
  382   2HB   ARG  56          2HB       ARG  56 -14.300  10.763  -4.671
  383   1HG   ARG  56          2HG       ARG  56 -14.936  10.544  -2.477
  384   2HG   ARG  56          1HG       ARG  56 -14.628  12.282  -2.473
  385   1HD   ARG  56          1HD       ARG  56 -16.816  12.734  -2.086
  386   2HD   ARG  56          2HD       ARG  56 -17.324  11.680  -3.421
  387    HE   ARG  56           HE       ARG  56 -16.931  10.831  -0.609
  388   1HH1  ARG  56          1HH1      ARG  56 -16.184   9.315  -3.425
  389   2HH1  ARG  56          2HH1      ARG  56 -17.379   8.066  -3.316
  390   1HH2  ARG  56          1HH2      ARG  56 -19.059   9.538  -0.664
  391   2HH2  ARG  56          2HH2      ARG  56 -19.007   8.192  -1.754
  392    H    GLU  57           H        GLU  57 -14.443  14.326  -2.847
  393    HA   GLU  57           HA       GLU  57 -17.197  15.295  -2.735
  394   1HB   GLU  57          2HB       GLU  57 -14.684  16.199  -1.286
  395   2HB   GLU  57          1HB       GLU  57 -16.347  16.489  -0.772
  396   1HG   GLU  57          1HG       GLU  57 -16.719  14.089  -0.498
  397   2HG   GLU  57          2HG       GLU  57 -15.100  13.746  -1.107
  398    H    LEU  58           H        LEU  58 -14.049  16.622  -3.721
  399    HA   LEU  58           HA       LEU  58 -14.770  19.335  -4.091
  400   1HB   LEU  58          1HB       LEU  58 -12.701  17.436  -4.917
  401   2HB   LEU  58          2HB       LEU  58 -12.974  18.696  -6.120
  402    HG   LEU  58           HG       LEU  58 -12.666  19.370  -3.195
  403   1HD1  LEU  58          1HD1      LEU  58 -10.681  18.051  -4.012
  404   2HD1  LEU  58          2HD1      LEU  58 -10.440  19.282  -5.251
  405   3HD1  LEU  58          3HD1      LEU  58 -10.294  19.707  -3.545
  406   1HD2  LEU  58          1HD2      LEU  58 -12.804  20.796  -5.797
  407   2HD2  LEU  58          2HD2      LEU  58 -13.325  21.323  -4.198
  408   3HD2  LEU  58          3HD2      LEU  58 -11.622  21.415  -4.645
  409    H    PHE  59           H        PHE  59 -15.702  16.517  -5.901
  410    HA   PHE  59           HA       PHE  59 -16.181  17.462  -8.488
  411   1HB   PHE  59          1HB       PHE  59 -16.541  15.163  -7.728
  412   2HB   PHE  59          2HB       PHE  59 -17.876  15.687  -6.701
  413    HD1  PHE  59           HD1      PHE  59 -16.808  16.194 -10.285
  414    HD2  PHE  59           HD2      PHE  59 -20.003  15.238  -7.544
  415    HE1  PHE  59           HE1      PHE  59 -18.382  15.957 -12.203
  416    HE2  PHE  59           HE2      PHE  59 -21.578  15.002  -9.462
  417    HZ   PHE  59           HZ       PHE  59 -20.767  15.361 -11.792
  418    H    ILE  60           H        ILE  60 -18.309  17.823  -5.631
  419    HA   ILE  60           HA       ILE  60 -20.328  19.341  -7.067
  420    HB   ILE  60           HB       ILE  60 -19.692  19.028  -4.114
  421   1HG1  ILE  60          1HG1      ILE  60 -21.986  17.592  -5.246
  422   2HG1  ILE  60          2HG1      ILE  60 -20.449  17.091  -5.952
  423   1HG2  ILE  60          1HG2      ILE  60 -21.968  20.256  -5.634
  424   2HG2  ILE  60          2HG2      ILE  60 -22.303  19.440  -4.107
  425   3HG2  ILE  60          3HG2      ILE  60 -21.191  20.808  -4.150
  426   1HD1  ILE  60          1HD1      ILE  60 -20.768  17.368  -2.966
  427   2HD1  ILE  60          2HD1      ILE  60 -21.228  15.883  -3.798
  428   3HD1  ILE  60          3HD1      ILE  60 -19.558  16.448  -3.862
  429    H    ALA  61           H        ALA  61 -17.499  20.159  -5.091
  430    HA   ALA  61           HA       ALA  61 -18.067  22.991  -4.897
  431   1HB   ALA  61          1HB       ALA  61 -15.696  23.042  -4.140
  432   2HB   ALA  61          2HB       ALA  61 -16.603  21.748  -3.358
  433   3HB   ALA  61          3HB       ALA  61 -15.504  21.376  -4.686
  434    H    ALA  62           H        ALA  62 -16.681  20.956  -7.363
  435    HA   ALA  62           HA       ALA  62 -15.512  23.287  -8.798
  436   1HB   ALA  62          1HB       ALA  62 -15.476  20.288  -9.256
  437   2HB   ALA  62          3HB       ALA  62 -14.612  21.456 -10.254
  438   3HB   ALA  62          2HB       ALA  62 -14.177  21.255  -8.557
  439    H    SER  63           H        SER  63 -17.521  20.457  -9.717
  440    HA   SER  63           HA       SER  63 -18.865  22.186 -11.757
  441   1HB   SER  63          1HB       SER  63 -19.312  20.079 -12.881
  442   2HB   SER  63          2HB       SER  63 -17.617  20.088 -12.400
  443    HG   SER  63           HG       SER  63 -19.641  18.450 -11.631
  444    H    LEU   8           H        LEU   8  30.760 -33.410  15.409
  445    HA   LEU   8           HA       LEU   8  28.922 -31.765  15.240
  446   1HB   LEU   8          1HB       LEU   8  30.153 -33.012  12.867
  447   2HB   LEU   8          2HB       LEU   8  28.681 -32.106  12.520
  448    HG   LEU   8           HG       LEU   8  30.177 -30.542  14.350
  449   1HD1  LEU   8          1HD1      LEU   8  31.836 -32.054  12.411
  450   2HD1  LEU   8          2HD1      LEU   8  32.143 -30.319  12.487
  451   3HD1  LEU   8          3HD1      LEU   8  32.294 -31.305  13.941
  452   1HD2  LEU   8          1HD2      LEU   8  29.229 -30.415  11.532
  453   2HD2  LEU   8          2HD2      LEU   8  28.966 -29.284  12.859
  454   3HD2  LEU   8          3HD2      LEU   8  30.496 -29.275  11.982
  455    H    GLU   9           H        GLU   9  26.689 -31.569  15.211
  456    HA   GLU   9           HA       GLU   9  25.005 -33.543  13.819
  457   1HB   GLU   9          1HB       GLU   9  23.911 -34.230  15.966
  458   2HB   GLU   9          2HB       GLU   9  25.608 -34.706  15.886
  459   1HG   GLU   9          1HG       GLU   9  26.249 -33.205  17.501
  460   2HG   GLU   9          2HG       GLU   9  25.022 -32.025  17.040
  461    HA   PRO  10           HA       PRO  10  23.312 -29.233  14.774
  462   1HB   PRO  10          1HB       PRO  10  23.469 -28.172  12.257
  463   2HB   PRO  10          2HB       PRO  10  24.776 -28.027  13.449
  464   1HG   PRO  10          2HG       PRO  10  24.521 -29.879  11.135
  465   2HG   PRO  10          1HG       PRO  10  25.953 -29.052  11.767
  466   1HD   PRO  10          1HD       PRO  10  25.389 -31.685  12.236
  467   2HD   PRO  10          2HD       PRO  10  26.356 -30.670  13.330
  468    H    ASP  11           H        ASP  11  22.938 -31.032  11.699
  469    HA   ASP  11           HA       ASP  11  21.006 -31.808  10.593
  470   1HB   ASP  11          1HB       ASP  11  20.586 -31.965  13.461
  471   2HB   ASP  11          2HB       ASP  11  19.059 -31.673  12.627
  472    H    ASN  12           H        ASN  12  19.274 -29.762  12.913
  473    HA   ASN  12           HA       ASN  12  18.911 -27.606  10.926
  474   1HB   ASN  12          1HB       ASN  12  17.327 -29.660  10.543
  475   2HB   ASN  12          2HB       ASN  12  16.468 -29.040  11.952
  476   2HD2  ASN  12          2HD2      ASN  12  16.300 -26.392  11.714
  477   1HD2  ASN  12          1HD2      ASN  12  15.663 -25.900  10.218
  478    H    VAL  13           H        VAL  13  19.778 -28.128  13.843
  479    HA   VAL  13           HA       VAL  13  17.763 -26.705  15.426
  480    HB   VAL  13           HB       VAL  13  20.395 -28.073  15.816
  481   1HG1  VAL  13          1HG1      VAL  13  19.409 -25.806  17.479
  482   2HG1  VAL  13          2HG1      VAL  13  19.963 -27.236  18.349
  483   3HG1  VAL  13          3HG1      VAL  13  21.055 -26.395  17.249
  484   1HG2  VAL  13          1HG2      VAL  13  18.041 -29.083  16.005
  485   2HG2  VAL  13          2HG2      VAL  13  19.153 -29.393  17.339
  486   3HG2  VAL  13          3HG2      VAL  13  17.898 -28.165  17.504
  487    HA   PRO  14           HA       PRO  14  21.018 -23.235  15.430
  488   1HB   PRO  14          1HB       PRO  14  23.310 -23.525  13.971
  489   2HB   PRO  14          2HB       PRO  14  23.163 -24.078  15.651
  490   1HG   PRO  14          2HG       PRO  14  23.043 -25.641  13.129
  491   2HG   PRO  14          1HG       PRO  14  23.738 -26.076  14.697
  492   1HD   PRO  14          1HD       PRO  14  21.312 -26.969  13.789
  493   2HD   PRO  14          2HD       PRO  14  21.762 -26.845  15.501
  494    H    MET  15           H        MET  15  21.461 -24.887  12.278
  495    HA   MET  15           HA       MET  15  21.012 -24.137  10.088
  496   1HB   MET  15          1HB       MET  15  18.787 -23.934  11.636
  497   2HB   MET  15          2HB       MET  15  18.956 -22.256  11.118
  498   1HG   MET  15          1HG       MET  15  17.665 -23.177   9.394
  499   2HG   MET  15          2HG       MET  15  19.299 -23.292   8.740
  500   1HE   MET  15          1HE       MET  15  18.826 -24.882   7.088
  501   2HE   MET  15          2HE       MET  15  18.221 -26.526   7.265
  502   3HE   MET  15          3HE       MET  15  17.112 -25.166   7.422
  503    H    ASP  16           H        ASP  16  20.188 -21.612   9.151
  504    HA   ASP  16           HA       ASP  16  21.778 -19.488  10.378
  505   1HB   ASP  16          1HB       ASP  16  22.794 -21.240   8.199
  506   2HB   ASP  16          2HB       ASP  16  23.102 -19.513   8.014
  507    H    MET  17           H        MET  17  19.353 -18.884  10.033
  508    HA   MET  17           HA       MET  17  19.149 -16.956   7.915
  509   1HB   MET  17          1HB       MET  17  17.371 -18.210   6.604
  510   2HB   MET  17          2HB       MET  17  18.992 -18.888   6.467
  511   1HG   MET  17          1HG       MET  17  18.376 -20.461   8.366
  512   2HG   MET  17          2HG       MET  17  16.715 -19.894   8.190
  513   1HE   MET  17          1HE       MET  17  15.514 -21.473   7.746
  514   2HE   MET  17          2HE       MET  17  15.292 -22.323   6.219
  515   3HE   MET  17          3HE       MET  17  16.344 -23.009   7.456
  516    H    SER  18           H        SER  18  17.254 -19.213   9.930
  517    HA   SER  18           HA       SER  18  15.972 -17.123  11.431
  518   1HB   SER  18          1HB       SER  18  13.656 -17.711  10.302
  519   2HB   SER  18          2HB       SER  18  14.722 -16.531   9.544
  520    HG   SER  18           HG       SER  18  14.400 -17.876   7.915
  521    HA   PRO  19           HA       PRO  19  15.323 -20.968  13.570
  522   1HB   PRO  19          1HB       PRO  19  14.298 -19.940  15.884
  523   2HB   PRO  19          2HB       PRO  19  16.024 -19.891  15.481
  524   1HG   PRO  19          1HG       PRO  19  14.008 -17.741  15.398
  525   2HG   PRO  19          2HG       PRO  19  15.746 -17.647  15.695
  526   1HD   PRO  19          1HD       PRO  19  14.456 -17.015  13.300
  527   2HD   PRO  19          2HD       PRO  19  16.198 -17.288  13.510
  528    H    LYS  20           H        LYS  20  13.384 -20.622  11.664
  529    HA   LYS  20           HA       LYS  20  11.178 -21.274  11.164
  530   1HB   LYS  20          1HB       LYS  20  11.892 -22.921  13.011
  531   2HB   LYS  20          2HB       LYS  20  10.934 -21.923  14.105
  532   1HG   LYS  20          1HG       LYS  20   9.662 -22.776  11.541
  533   2HG   LYS  20          2HG       LYS  20   9.856 -23.992  12.804
  534   1HD   LYS  20          1HD       LYS  20   8.899 -21.967  14.303
  535   2HD   LYS  20          2HD       LYS  20   8.140 -21.564  12.763
  536   1HE   LYS  20          1HE       LYS  20   7.778 -24.325  12.966
  537   2HE   LYS  20          2HE       LYS  20   7.489 -23.726  14.612
  538   1HZ   LYS  20          1HZ       LYS  20   6.132 -21.926  13.569
  539   2HZ   LYS  20          2HZ       LYS  20   6.244 -22.758  12.097
  540   3HZ   LYS  20          3HZ       LYS  20   5.463 -23.480  13.422
  541    H    ALA  21           H        ALA  21  10.855 -20.023  14.511
  542    HA   ALA  21           HA       ALA  21   8.402 -18.756  14.325
  543   1HB   ALA  21          1HB       ALA  21  10.972 -18.040  15.738
  544   2HB   ALA  21          3HB       ALA  21   9.487 -17.131  16.014
  545   3HB   ALA  21          2HB       ALA  21   9.553 -18.852  16.398
  546    H    LEU  22           H        LEU  22  11.540 -17.313  13.389
  547    HA   LEU  22           HA       LEU  22  10.285 -14.834  12.453
  548   1HB   LEU  22          1HB       LEU  22  13.050 -16.065  12.360
  549   2HB   LEU  22          2HB       LEU  22  12.697 -14.502  11.622
  550    HG   LEU  22           HG       LEU  22  11.728 -13.818  13.893
  551   1HD1  LEU  22          1HD1      LEU  22  12.886 -16.507  14.474
  552   2HD1  LEU  22          2HD1      LEU  22  13.054 -15.258  15.707
  553   3HD1  LEU  22          3HD1      LEU  22  11.451 -15.739  15.148
  554   1HD2  LEU  22          1HD2      LEU  22  14.089 -13.319  12.888
  555   2HD2  LEU  22          2HD2      LEU  22  13.829 -13.030  14.609
  556   3HD2  LEU  22          3HD2      LEU  22  14.661 -14.492  14.076
  557    H    GLN  23           H        GLN  23  11.780 -17.699  10.965
  558    HA   GLN  23           HA       GLN  23  11.705 -17.009   8.253
  559   1HB   GLN  23          1HB       GLN  23  12.536 -19.113   9.483
  560   2HB   GLN  23          2HB       GLN  23  10.879 -19.703   9.351
  561   1HG   GLN  23          1HG       GLN  23  10.960 -19.504   6.919
  562   2HG   GLN  23          2HG       GLN  23  12.578 -18.807   7.005
  563   2HE2  GLN  23          2HE2      GLN  23  11.336 -21.554   8.944
  564   1HE2  GLN  23          1HE2      GLN  23  12.435 -22.690   8.327
  565    H    GLN  24           H        GLN  24   9.036 -18.327  10.233
  566    HA   GLN  24           HA       GLN  24   7.157 -18.320   7.990
  567   1HB   GLN  24          1HB       GLN  24   7.349 -19.738  10.231
  568   2HB   GLN  24          2HB       GLN  24   6.351 -18.433  10.874
  569   1HG   GLN  24          2HG       GLN  24   4.930 -20.249  10.025
  570   2HG   GLN  24          1HG       GLN  24   4.718 -18.798   9.044
  571   2HE2  GLN  24          2HE2      GLN  24   4.843 -19.167   6.830
  572   1HE2  GLN  24          1HE2      GLN  24   5.677 -20.453   6.099
  573    H    LYS  25           H        LYS  25   7.645 -16.319  10.918
  574    HA   LYS  25           HA       LYS  25   5.422 -14.566  10.513
  575   1HB   LYS  25          1HB       LYS  25   7.903 -14.727  12.100
  576   2HB   LYS  25          2HB       LYS  25   7.329 -13.083  11.823
  577   1HG   LYS  25          2HG       LYS  25   6.283 -13.871  13.846
  578   2HG   LYS  25          1HG       LYS  25   5.045 -13.847  12.591
  579   1HD   LYS  25          1HD       LYS  25   5.958 -16.350  12.224
  580   2HD   LYS  25          2HD       LYS  25   6.329 -16.169  13.940
  581   1HE   LYS  25          1HE       LYS  25   4.141 -16.369  14.500
  582   2HE   LYS  25          2HE       LYS  25   3.667 -15.143  13.306
  583   1HZ   LYS  25          1HZ       LYS  25   4.079 -16.874  11.571
  584   2HZ   LYS  25          2HZ       LYS  25   4.218 -18.019  12.819
  585   3HZ   LYS  25          3HZ       LYS  25   2.753 -17.198  12.583
  586    H    ILE  26           H        ILE  26   8.749 -14.491   9.274
  587    HA   ILE  26           HA       ILE  26   8.534 -11.822   8.135
  588    HB   ILE  26           HB       ILE  26  10.403 -14.165   7.652
  589   1HG1  ILE  26          1HG1      ILE  26  10.860 -11.647   9.272
  590   2HG1  ILE  26          2HG1      ILE  26  10.247 -13.139   9.987
  591   1HG2  ILE  26          1HG2      ILE  26  10.092 -11.846   6.115
  592   2HG2  ILE  26          2HG2      ILE  26  11.466 -11.499   7.165
  593   3HG2  ILE  26          3HG2      ILE  26  11.492 -12.918   6.118
  594   1HD1  ILE  26          1HD1      ILE  26  12.730 -13.227   8.301
  595   2HD1  ILE  26          2HD1      ILE  26  12.837 -12.676   9.973
  596   3HD1  ILE  26          3HD1      ILE  26  12.238 -14.296   9.614
  597    H    HIS  27           H        HIS  27   8.546 -15.107   6.686
  598    HA   HIS  27           HA       HIS  27   7.988 -14.254   4.011
  599   1HB   HIS  27          1HB       HIS  27   7.861 -16.761   5.633
  600   2HB   HIS  27          2HB       HIS  27   7.058 -16.764   4.063
  601    HD1  HIS  27           HD1      HIS  27   8.542 -16.532   1.951
  602    HD2  HIS  27           HD2      HIS  27  10.705 -16.530   5.516
  603    HE1  HIS  27           HE1      HIS  27  10.978 -16.810   1.312
  604    H    GLU  28           H        GLU  28   5.930 -14.689   6.804
  605    HA   GLU  28           HA       GLU  28   3.434 -14.882   5.286
  606   1HB   GLU  28          1HB       GLU  28   4.309 -14.625   8.150
  607   2HB   GLU  28          2HB       GLU  28   2.613 -14.365   7.742
  608   1HG   GLU  28          1HG       GLU  28   4.016 -16.790   6.668
  609   2HG   GLU  28          2HG       GLU  28   3.462 -16.789   8.343
  610    H    LEU  29           H        LEU  29   4.691 -12.390   7.547
  611    HA   LEU  29           HA       LEU  29   2.815 -10.367   6.976
  612   1HB   LEU  29          1HB       LEU  29   5.494 -10.657   8.144
  613   2HB   LEU  29          2HB       LEU  29   5.205  -9.054   7.468
  614    HG   LEU  29           HG       LEU  29   2.873  -9.346   8.734
  615   1HD1  LEU  29          1HD1      LEU  29   3.888 -11.698   9.459
  616   2HD1  LEU  29          2HD1      LEU  29   4.647 -10.719  10.714
  617   3HD1  LEU  29          3HD1      LEU  29   2.890 -10.758  10.570
  618   1HD2  LEU  29          1HD2      LEU  29   5.233  -7.928   9.148
  619   2HD2  LEU  29          2HD2      LEU  29   3.710  -7.662   9.997
  620   3HD2  LEU  29          3HD2      LEU  29   4.941  -8.708  10.703
  621    H    GLU  30           H        GLU  30   5.668 -11.360   5.148
  622    HA   GLU  30           HA       GLU  30   5.878  -9.048   3.455
  623   1HB   GLU  30          1HB       GLU  30   7.468 -11.058   3.922
  624   2HB   GLU  30          2HB       GLU  30   6.553 -11.877   2.656
  625   1HG   GLU  30          1HG       GLU  30   7.341  -9.150   1.920
  626   2HG   GLU  30          2HG       GLU  30   8.717 -10.209   2.229
  627    H    GLY  31           H        GLY  31   4.460 -12.271   2.750
  628   1HA   GLY  31          2HA       GLY  31   2.773 -12.885   1.240
  629   2HA   GLY  31          1HA       GLY  31   3.313 -11.528   0.252
  630    H    LEU  32           H        LEU  32   2.304 -10.880   3.511
  631    HA   LEU  32           HA       LEU  32  -0.501 -10.366   2.878
  632   1HB   LEU  32          1HB       LEU  32   0.963 -10.879   5.118
  633   2HB   LEU  32          2HB       LEU  32   0.789  -9.128   5.244
  634    HG   LEU  32           HG       LEU  32  -1.683  -9.414   4.890
  635   1HD1  LEU  32          1HD1      LEU  32  -0.776 -12.180   4.516
  636   2HD1  LEU  32          2HD1      LEU  32  -2.117 -12.040   5.652
  637   3HD1  LEU  32          3HD1      LEU  32  -2.284 -11.415   4.012
  638   1HD2  LEU  32          1HD2      LEU  32  -0.665  -9.204   7.158
  639   2HD2  LEU  32          2HD2      LEU  32  -2.122 -10.197   7.169
  640   3HD2  LEU  32          3HD2      LEU  32  -0.535 -10.962   7.235
  641    H    MET  33           H        MET  33   2.478  -8.522   2.831
  642    HA   MET  33           HA       MET  33   1.414  -5.874   2.998
  643   1HB   MET  33          1HB       MET  33   3.876  -7.266   2.306
  644   2HB   MET  33          2HB       MET  33   3.640  -5.843   1.292
  645   1HG   MET  33          1HG       MET  33   3.762  -4.381   3.072
  646   2HG   MET  33          2HG       MET  33   3.116  -5.557   4.216
  647   1HE   MET  33          1HE       MET  33   5.587  -5.302   1.568
  648   2HE   MET  33          2HE       MET  33   6.769  -4.379   2.506
  649   3HE   MET  33          3HE       MET  33   7.070  -6.073   2.127
  650    H    MET  34           H        MET  34   2.022  -7.981   0.172
  651    HA   MET  34           HA       MET  34   1.009  -5.998  -1.725
  652   1HB   MET  34          1HB       MET  34   2.787  -7.660  -2.212
  653   2HB   MET  34          2HB       MET  34   1.618  -8.960  -1.980
  654   1HG   MET  34          2HG       MET  34   1.048  -8.767  -4.148
  655   2HG   MET  34          1HG       MET  34   0.409  -7.164  -3.788
  656   1HE   MET  34          1HE       MET  34   2.837  -5.752  -2.729
  657   2HE   MET  34          2HE       MET  34   3.652  -4.984  -4.089
  658   3HE   MET  34          3HE       MET  34   1.897  -4.892  -3.956
  659    H    GLN  35           H        GLN  35  -0.280  -8.823  -0.032
  660    HA   GLN  35           HA       GLN  35  -2.576  -9.411  -1.525
  661   1HB   GLN  35          1HB       GLN  35  -1.819 -10.668   0.421
  662   2HB   GLN  35          2HB       GLN  35  -2.132  -9.290   1.475
  663   1HG   GLN  35          1HG       GLN  35  -4.200 -10.135   1.789
  664   2HG   GLN  35          2HG       GLN  35  -4.546  -9.689   0.118
  665   2HE2  GLN  35          2HE2      GLN  35  -3.414 -12.392   2.165
  666   1HE2  GLN  35          1HE2      GLN  35  -3.780 -13.609   1.040
  667    H    HIS  36           H        HIS  36  -2.949  -7.540   1.486
  668    HA   HIS  36           HA       HIS  36  -5.396  -6.323   0.793
  669   1HB   HIS  36          1HB       HIS  36  -3.118  -5.692   2.653
  670   2HB   HIS  36          2HB       HIS  36  -4.500  -4.600   2.554
  671    HD1  HIS  36           HD1      HIS  36  -3.694  -6.604   4.993
  672    HD2  HIS  36           HD2      HIS  36  -6.764  -7.123   2.221
  673    HE1  HIS  36           HE1      HIS  36  -5.370  -8.173   6.064
  674    H    ALA  37           H        ALA  37  -2.105  -4.905   0.521
  675    HA   ALA  37           HA       ALA  37  -2.692  -2.394  -0.546
  676   1HB   ALA  37          1HB       ALA  37  -0.455  -3.285   0.039
  677   2HB   ALA  37          3HB       ALA  37  -0.515  -4.350  -1.366
  678   3HB   ALA  37          2HB       ALA  37  -0.456  -2.601  -1.587
  679    H    GLN  38           H        GLN  38  -2.619  -5.532  -2.236
  680    HA   GLN  38           HA       GLN  38  -3.010  -4.489  -4.897
  681   1HB   GLN  38          1HB       GLN  38  -3.138  -7.086  -3.445
  682   2HB   GLN  38          2HB       GLN  38  -4.016  -7.006  -4.974
  683   1HG   GLN  38          1HG       GLN  38  -1.991  -6.239  -6.126
  684   2HG   GLN  38          2HG       GLN  38  -1.103  -6.251  -4.602
  685   2HE2  GLN  38          2HE2      GLN  38  -1.810  -8.646  -3.433
  686   1HE2  GLN  38          1HE2      GLN  38  -1.394  -9.951  -4.436
  687    H    ASN  39           H        ASN  39  -5.176  -5.406  -2.262
  688    HA   ASN  39           HA       ASN  39  -7.584  -4.949  -3.933
  689   1HB   ASN  39          1HB       ASN  39  -7.085  -5.808  -1.065
  690   2HB   ASN  39          2HB       ASN  39  -8.695  -5.656  -1.770
  691   2HD2  ASN  39          2HD2      ASN  39  -9.112  -7.973  -1.644
  692   1HD2  ASN  39          1HD2      ASN  39  -8.311  -9.075  -2.655
  693    H    LEU  40           H        LEU  40  -5.529  -2.828  -2.911
  694    HA   LEU  40           HA       LEU  40  -5.608  -0.617  -2.147
  695   1HB   LEU  40          1HB       LEU  40  -8.379  -1.252  -3.139
  696   2HB   LEU  40          2HB       LEU  40  -8.040   0.331  -2.439
  697    HG   LEU  40           HG       LEU  40  -5.967   0.287  -4.059
  698   1HD1  LEU  40          1HD1      LEU  40  -7.613  -2.014  -4.910
  699   2HD1  LEU  40          2HD1      LEU  40  -7.139  -0.925  -6.215
  700   3HD1  LEU  40          3HD1      LEU  40  -5.907  -1.681  -5.204
  701   1HD2  LEU  40          1HD2      LEU  40  -8.269   1.624  -4.087
  702   2HD2  LEU  40          2HD2      LEU  40  -7.176   1.678  -5.471
  703   3HD2  LEU  40          3HD2      LEU  40  -8.578   0.607  -5.495
  704    H    GLU  41           H        GLU  41  -6.241  -2.940  -0.242
  705    HA   GLU  41           HA       GLU  41  -8.144  -1.973   1.707
  706   1HB   GLU  41          1HB       GLU  41  -6.023  -4.050   1.454
  707   2HB   GLU  41          2HB       GLU  41  -6.484  -3.599   3.095
  708   1HG   GLU  41          1HG       GLU  41  -8.462  -4.393   0.942
  709   2HG   GLU  41          2HG       GLU  41  -7.836  -5.500   2.164
  710    H    PHE  42           H        PHE  42  -4.599  -1.831   1.450
  711    HA   PHE  42           HA       PHE  42  -3.021  -0.497   2.582
  712   1HB   PHE  42          1HB       PHE  42  -5.396   1.146   1.839
  713   2HB   PHE  42          2HB       PHE  42  -4.199   1.906   2.887
  714    HD1  PHE  42           HD1      PHE  42  -1.659   0.740   1.972
  715    HD2  PHE  42           HD2      PHE  42  -5.078   2.053  -0.316
  716    HE1  PHE  42           HE1      PHE  42  -0.187   1.147   0.003
  717    HE2  PHE  42           HE2      PHE  42  -3.603   2.459  -2.285
  718    HZ   PHE  42           HZ       PHE  42  -1.156   2.007  -2.120
  719    H    GLU  43           H        GLU  43  -2.968   1.232   4.510
  720    HA   GLU  43           HA       GLU  43  -3.136   1.639   6.806
  721   1HB   GLU  43          1HB       GLU  43  -5.522   1.944   6.357
  722   2HB   GLU  43          2HB       GLU  43  -5.781   0.203   6.366
  723   1HG   GLU  43          1HG       GLU  43  -4.871   0.191   8.734
  724   2HG   GLU  43          2HG       GLU  43  -4.977   1.952   8.693
  725    H    GLU  44           H        GLU  44  -4.594  -1.530   6.236
  726    HA   GLU  44           HA       GLU  44  -3.052  -2.753   8.416
  727   1HB   GLU  44          2HB       GLU  44  -4.390  -4.717   7.835
  728   2HB   GLU  44          1HB       GLU  44  -5.433  -3.296   7.853
  729   1HG   GLU  44          1HG       GLU  44  -5.284  -3.122   5.411
  730   2HG   GLU  44          2HG       GLU  44  -4.173  -4.491   5.365
  731    H    ALA  45           H        ALA  45  -3.003  -2.655   4.874
  732    HA   ALA  45           HA       ALA  45  -0.975  -4.753   4.619
  733   1HB   ALA  45          1HB       ALA  45  -2.886  -3.619   3.031
  734   2HB   ALA  45          3HB       ALA  45  -1.539  -4.577   2.414
  735   3HB   ALA  45          2HB       ALA  45  -1.435  -2.815   2.432
  736    H    ALA  46           H        ALA  46  -0.993  -1.188   4.297
  737    HA   ALA  46           HA       ALA  46   1.843  -1.039   3.697
  738   1HB   ALA  46          1HB       ALA  46   1.417   1.299   3.643
  739   2HB   ALA  46          3HB       ALA  46  -0.087   0.551   3.107
  740   3HB   ALA  46          2HB       ALA  46   0.058   1.156   4.760
  741    H    GLN  47           H        GLN  47   0.018  -1.240   6.658
  742    HA   GLN  47           HA       GLN  47   2.028   0.033   8.353
  743   1HB   GLN  47          1HB       GLN  47  -0.503  -1.535   8.658
  744   2HB   GLN  47          2HB       GLN  47   0.550  -1.381  10.063
  745   1HG   GLN  47          1HG       GLN  47  -0.163   1.054   8.447
  746   2HG   GLN  47          2HG       GLN  47  -1.284   0.439   9.662
  747   2HE2  GLN  47          2HE2      GLN  47  -0.674   2.675  10.670
  748   1HE2  GLN  47          1HE2      GLN  47   0.682   2.703  11.689
  749    H    ILE  48           H        ILE  48   1.597  -3.126   6.969
  750    HA   ILE  48           HA       ILE  48   3.079  -4.653   8.923
  751    HB   ILE  48           HB       ILE  48   2.473  -5.046   5.975
  752   1HG1  ILE  48          1HG1      ILE  48   1.162  -6.388   8.341
  753   2HG1  ILE  48          2HG1      ILE  48   0.588  -4.832   7.739
  754   1HG2  ILE  48          1HG2      ILE  48   4.298  -6.458   7.572
  755   2HG2  ILE  48          2HG2      ILE  48   2.844  -7.456   7.555
  756   3HG2  ILE  48          3HG2      ILE  48   3.611  -6.992   6.037
  757   1HD1  ILE  48          1HD1      ILE  48   0.779  -6.215   5.407
  758   2HD1  ILE  48          2HD1      ILE  48   0.377  -7.524   6.519
  759   3HD1  ILE  48          3HD1      ILE  48  -0.696  -6.132   6.370
  760    H    ARG  49           H        ARG  49   4.006  -2.692   6.137
  761    HA   ARG  49           HA       ARG  49   6.596  -3.663   5.605
  762   1HB   ARG  49          2HB       ARG  49   6.987  -1.405   4.740
  763   2HB   ARG  49          1HB       ARG  49   5.327  -1.883   4.384
  764   1HG   ARG  49          2HG       ARG  49   4.872   0.176   5.285
  765   2HG   ARG  49          1HG       ARG  49   4.934  -0.738   6.792
  766   1HD   ARG  49          1HD       ARG  49   7.541  -0.191   6.607
  767   2HD   ARG  49          2HD       ARG  49   6.933   1.183   5.662
  768    HE   ARG  49           HE       ARG  49   5.432   0.747   8.127
  769   1HH1  ARG  49          1HH1      ARG  49   8.622   1.587   7.389
  770   2HH1  ARG  49          2HH1      ARG  49   8.603   3.086   8.258
  771   1HH2  ARG  49          1HH2      ARG  49   5.207   2.948   8.947
  772   2HH2  ARG  49          2HH2      ARG  49   6.670   3.856   9.141
  773    H    ASP  50           H        ASP  50   5.417  -1.816   8.344
  774    HA   ASP  50           HA       ASP  50   8.053  -1.037   9.330
  775   1HB   ASP  50          1HB       ASP  50   5.403  -0.337   9.748
  776   2HB   ASP  50          2HB       ASP  50   5.820  -1.189  11.235
  777    H    GLN  51           H        GLN  51   5.709  -3.627  10.040
  778    HA   GLN  51           HA       GLN  51   7.247  -4.760  12.231
  779   1HB   GLN  51          2HB       GLN  51   5.098  -5.936  10.435
  780   2HB   GLN  51          1HB       GLN  51   5.584  -6.564  12.010
  781   1HG   GLN  51          1HG       GLN  51   4.729  -4.666  13.154
  782   2HG   GLN  51          2HG       GLN  51   4.605  -3.728  11.665
  783   2HE2  GLN  51          2HE2      GLN  51   3.587  -7.128  11.908
  784   1HE2  GLN  51          1HE2      GLN  51   1.929  -6.823  11.705
  785    H    LEU  52           H        LEU  52   6.859  -5.550   8.771
  786    HA   LEU  52           HA       LEU  52   8.516  -7.889   8.759
  787   1HB   LEU  52          1HB       LEU  52   6.837  -6.807   7.037
  788   2HB   LEU  52          2HB       LEU  52   8.280  -5.983   6.444
  789    HG   LEU  52           HG       LEU  52   7.924  -8.082   5.213
  790   1HD1  LEU  52          1HD1      LEU  52  10.260  -7.201   6.006
  791   2HD1  LEU  52          2HD1      LEU  52  10.237  -8.612   7.063
  792   3HD1  LEU  52          3HD1      LEU  52  10.146  -8.820   5.314
  793   1HD2  LEU  52          1HD2      LEU  52   7.185  -9.031   7.784
  794   2HD2  LEU  52          2HD2      LEU  52   7.187  -9.933   6.268
  795   3HD2  LEU  52          3HD2      LEU  52   8.615  -9.944   7.302
  796    H    HIS  53           H        HIS  53   9.239  -4.435   8.305
  797    HA   HIS  53           HA       HIS  53  12.029  -4.843   7.600
  798   1HB   HIS  53          1HB       HIS  53  10.189  -2.592   8.321
  799   2HB   HIS  53          2HB       HIS  53  11.926  -2.290   8.369
  800    HD1  HIS  53           HD1      HIS  53  10.207  -4.583   5.895
  801    HD2  HIS  53           HD2      HIS  53  12.138  -0.890   5.945
  802    HE1  HIS  53           HE1      HIS  53  10.489  -3.889   3.476
  803    H    GLN  54           H        GLN  54  10.257  -4.242  10.613
  804    HA   GLN  54           HA       GLN  54  12.684  -3.879  12.212
  805   1HB   GLN  54          1HB       GLN  54  10.217  -3.007  12.495
  806   2HB   GLN  54          2HB       GLN  54   9.955  -4.568  13.272
  807   1HG   GLN  54          1HG       GLN  54  11.398  -4.091  15.033
  808   2HG   GLN  54          2HG       GLN  54  12.321  -2.920  14.091
  809   2HE2  GLN  54          2HE2      GLN  54   9.247  -3.379  15.844
  810   1HE2  GLN  54          1HE2      GLN  54   8.902  -1.724  16.006
  811    H    LEU  55           H        LEU  55  10.491  -6.525  11.405
  812    HA   LEU  55           HA       LEU  55  11.189  -8.400  13.408
  813   1HB   LEU  55          1HB       LEU  55  10.030  -8.354  10.693
  814   2HB   LEU  55          2HB       LEU  55  10.730  -9.903  11.163
  815    HG   LEU  55           HG       LEU  55   9.072  -8.574  13.228
  816   1HD1  LEU  55          1HD1      LEU  55   8.042  -8.514  10.687
  817   2HD1  LEU  55          2HD1      LEU  55   7.469 -10.080  11.260
  818   3HD1  LEU  55          3HD1      LEU  55   7.067  -8.613  12.153
  819   1HD2  LEU  55          1HD2      LEU  55   9.431 -11.369  12.120
  820   2HD2  LEU  55          2HD2      LEU  55   9.942 -10.757  13.693
  821   3HD2  LEU  55          3HD2      LEU  55   8.227 -10.984  13.350
  822    H    ARG  56           H        ARG  56  12.905  -7.475  10.460
  823    HA   ARG  56           HA       ARG  56  14.711  -9.654  10.263
  824   1HB   ARG  56          2HB       ARG  56  16.012  -8.095   8.930
  825   2HB   ARG  56          1HB       ARG  56  14.303  -7.774   8.645
  826   1HG   ARG  56          1HG       ARG  56  14.971  -5.614   9.050
  827   2HG   ARG  56          2HG       ARG  56  14.701  -6.108  10.722
  828   1HD   ARG  56          1HD       ARG  56  16.906  -5.886  11.207
  829   2HD   ARG  56          2HD       ARG  56  17.368  -6.867   9.802
  830    HE   ARG  56           HE       ARG  56  17.002  -3.926   9.807
  831   1HH1  ARG  56          1HH1      ARG  56  16.175  -6.181   7.567
  832   2HH1  ARG  56          2HH1      ARG  56  17.343  -5.730   6.371
  833   1HH2  ARG  56          1HH2      ARG  56  19.100  -3.627   8.495
  834   2HH2  ARG  56          2HH2      ARG  56  18.998  -4.284   6.896
  835    H    GLU  57           H        GLU  57  14.560  -7.052  12.577
  836    HA   GLU  57           HA       GLU  57  17.335  -7.249  13.463
  837   1HB   GLU  57          2HB       GLU  57  14.869  -6.098  14.811
  838   2HB   GLU  57          1HB       GLU  57  16.546  -5.705  15.192
  839   1HG   GLU  57          1HG       GLU  57  16.867  -4.755  12.964
  840   2HG   GLU  57          2HG       GLU  57  15.230  -5.225  12.503
  841    H    LEU  58           H        LEU  58  14.203  -8.546  14.535
  842    HA   LEU  58           HA       LEU  58  14.980  -9.687  17.008
  843   1HB   LEU  58          1HB       LEU  58  12.854  -9.914  15.007
  844   2HB   LEU  58          2HB       LEU  58  13.137 -11.431  15.862
  845    HG   LEU  58           HG       LEU  58  12.892  -8.820  17.352
  846   1HD1  LEU  58          1HD1      LEU  58  10.863  -9.203  15.910
  847   2HD1  LEU  58          2HD1      LEU  58  10.632 -10.744  16.736
  848   3HD1  LEU  58          3HD1      LEU  58  10.522  -9.233  17.640
  849   1HD2  LEU  58          1HD2      LEU  58  13.016 -11.723  17.970
  850   2HD2  LEU  58          2HD2      LEU  58  13.583 -10.347  18.915
  851   3HD2  LEU  58          3HD2      LEU  58  11.874 -10.780  18.928
  852    H    PHE  59           H        PHE  59  15.818 -10.618  13.764
  853    HA   PHE  59           HA       PHE  59  16.275 -13.373  13.913
  854   1HB   PHE  59          1HB       PHE  59  16.594 -11.989  11.919
  855   2HB   PHE  59          2HB       PHE  59  17.957 -11.166  12.681
  856    HD1  PHE  59           HD1      PHE  59  16.842 -14.735  12.166
  857    HD2  PHE  59           HD2      PHE  59  20.060 -11.863  11.952
  858    HE1  PHE  59           HE1      PHE  59  18.379 -16.518  11.347
  859    HE2  PHE  59           HE2      PHE  59  21.597 -13.646  11.133
  860    HZ   PHE  59           HZ       PHE  59  20.757 -15.974  10.830
  861    H    ILE  60           H        ILE  60  18.459 -10.760  15.021
  862    HA   ILE  60           HA       ILE  60  20.488 -12.590  16.009
  863    HB   ILE  60           HB       ILE  60  19.893  -9.666  16.574
  864   1HG1  ILE  60          1HG1      ILE  60  22.133 -10.359  14.812
  865   2HG1  ILE  60          2HG1      ILE  60  20.573 -10.875  14.171
  866   1HG2  ILE  60          1HG2      ILE  60  22.175 -11.493  17.250
  867   2HG2  ILE  60          2HG2      ILE  60  22.511  -9.797  16.901
  868   3HG2  ILE  60          3HG2      ILE  60  21.432 -10.227  18.227
  869   1HD1  ILE  60          1HD1      ILE  60  20.951  -8.100  15.288
  870   2HD1  ILE  60          2HD1      ILE  60  21.364  -8.472  13.614
  871   3HD1  ILE  60          3HD1      ILE  60  19.707  -8.679  14.180
  872    H    ALA  61           H        ALA  61  17.712 -10.905  17.435
  873    HA   ALA  61           HA       ALA  61  18.349 -11.539  20.188
  874   1HB   ALA  61          1HB       ALA  61  16.882  -9.694  19.481
  875   2HB   ALA  61          3HB       ALA  61  15.754 -10.848  18.770
  876   3HB   ALA  61          2HB       ALA  61  15.989 -10.809  20.517
  877    H    ALA  62           H        ALA  62  16.874 -13.303  17.568
  878    HA   ALA  62           HA       ALA  62  15.738 -15.338  19.420
  879   1HB   ALA  62          1HB       ALA  62  14.774 -16.199  17.269
  880   2HB   ALA  62          2HB       ALA  62  14.357 -14.513  17.579
  881   3HB   ALA  62          3HB       ALA  62  15.623 -14.909  16.417
  882    H    SER  63           H        SER  63  17.664 -15.424  16.391
  883    HA   SER  63           HA       SER  63  19.015 -17.884  17.425
  884   1HB   SER  63          1HB       SER  63  19.393 -18.360  15.074
  885   2HB   SER  63          2HB       SER  63  17.708 -17.887  15.267
  886    HG   SER  63           HG       SER  63  19.700 -16.702  13.857

  No H/Q in entry =         886
  Start of MODEL    7
    1    H    LEU   8           H        LEU   8  -6.941  -6.185 -19.606
    2    HA   LEU   8           HA       LEU   8  -9.704  -5.747 -18.646
    3   1HB   LEU   8          1HB       LEU   8  -8.695  -7.737 -20.002
    4   2HB   LEU   8          2HB       LEU   8  -8.073  -8.276 -18.441
    5    HG   LEU   8           HG       LEU   8 -10.814  -7.518 -18.104
    6   1HD1  LEU   8          1HD1      LEU   8 -10.235  -9.364 -20.434
    7   2HD1  LEU   8          2HD1      LEU   8 -11.791  -9.315 -19.605
    8   3HD1  LEU   8          3HD1      LEU   8 -11.196  -7.887 -20.451
    9   1HD2  LEU   8          1HD2      LEU   8  -9.021  -9.826 -17.692
   10   2HD2  LEU   8          2HD2      LEU   8 -10.255  -9.156 -16.624
   11   3HD2  LEU   8          3HD2      LEU   8 -10.716 -10.258 -17.922
   12    H    GLU   9           H        GLU   9  -7.263  -4.584 -17.248
   13    HA   GLU   9           HA       GLU   9  -6.949  -6.071 -14.762
   14   1HB   GLU   9          1HB       GLU   9  -5.904  -3.708 -16.117
   15   2HB   GLU   9          2HB       GLU   9  -6.128  -3.425 -14.390
   16   1HG   GLU   9          1HG       GLU   9  -5.026  -5.962 -14.452
   17   2HG   GLU   9          2HG       GLU   9  -4.179  -5.136 -15.760
   18    HA   PRO  10           HA       PRO  10  -9.701  -2.630 -12.934
   19   1HB   PRO  10          1HB       PRO  10 -10.863  -0.819 -14.623
   20   2HB   PRO  10          2HB       PRO  10  -9.258  -0.580 -13.905
   21   1HG   PRO  10          2HG       PRO  10  -9.991  -1.478 -16.642
   22   2HG   PRO  10          1HG       PRO  10  -8.665  -0.432 -16.113
   23   1HD   PRO  10          1HD       PRO  10  -8.362  -3.069 -16.774
   24   2HD   PRO  10          2HD       PRO  10  -7.286  -2.192 -15.667
   25    H    ASP  11           H        ASP  11 -10.966  -3.117 -16.259
   26    HA   ASP  11           HA       ASP  11 -12.946  -4.153 -17.014
   27   1HB   ASP  11          1HB       ASP  11 -11.949  -5.589 -14.709
   28   2HB   ASP  11          2HB       ASP  11 -13.712  -5.650 -14.735
   29    H    ASN  12           H        ASN  12 -13.832  -4.094 -13.577
   30    HA   ASN  12           HA       ASN  12 -15.646  -1.783 -14.034
   31   1HB   ASN  12          1HB       ASN  12 -16.630  -4.146 -14.621
   32   2HB   ASN  12          2HB       ASN  12 -16.725  -4.342 -12.871
   33   2HD2  ASN  12          2HD2      ASN  12 -17.593  -1.999 -11.869
   34   1HD2  ASN  12          1HD2      ASN  12 -19.041  -1.485 -12.591
   35    H    VAL  13           H        VAL  13 -13.250  -2.662 -12.279
   36    HA   VAL  13           HA       VAL  13 -14.322  -2.770  -9.568
   37    HB   VAL  13           HB       VAL  13 -11.684  -2.758 -10.971
   38   1HG1  VAL  13          1HG1      VAL  13 -12.096  -1.824  -8.141
   39   2HG1  VAL  13          2HG1      VAL  13 -10.663  -2.770  -8.546
   40   3HG1  VAL  13          3HG1      VAL  13 -10.959  -1.229  -9.353
   41   1HG2  VAL  13          1HG2      VAL  13 -13.110  -4.775 -10.264
   42   2HG2  VAL  13          2HG2      VAL  13 -11.401  -4.813  -9.831
   43   3HG2  VAL  13          3HG2      VAL  13 -12.610  -4.398  -8.616
   44    HA   PRO  14           HA       PRO  14 -12.773   1.728  -9.325
   45   1HB   PRO  14          1HB       PRO  14 -11.813   2.941 -11.580
   46   2HB   PRO  14          2HB       PRO  14 -10.783   2.011 -10.473
   47   1HG   PRO  14          2HG       PRO  14 -11.927   1.227 -13.100
   48   2HG   PRO  14          1HG       PRO  14 -10.360   0.827 -12.382
   49   1HD   PRO  14          1HD       PRO  14 -12.500  -0.886 -12.458
   50   2HD   PRO  14          2HD       PRO  14 -11.184  -0.970 -11.271
   51    H    MET  15           H        MET  15 -13.828   1.327 -12.729
   52    HA   MET  15           HA       MET  15 -15.647   2.286 -13.884
   53   1HB   MET  15          1HB       MET  15 -16.471   0.901 -11.667
   54   2HB   MET  15          2HB       MET  15 -17.223   2.473 -11.388
   55   1HG   MET  15          1HG       MET  15 -18.038   2.339 -13.817
   56   2HG   MET  15          2HG       MET  15 -17.571   0.639 -13.765
   57   1HE   MET  15          1HE       MET  15 -19.820   0.825 -14.677
   58   2HE   MET  15          2HE       MET  15 -20.455  -0.545 -13.757
   59   3HE   MET  15          3HE       MET  15 -21.333   0.981 -13.787
   60    H    ASP  16           H        ASP  16 -17.653   4.049 -12.548
   61    HA   ASP  16           HA       ASP  16 -17.969   6.356 -12.171
   62   1HB   ASP  16          1HB       ASP  16 -15.869   5.360 -10.504
   63   2HB   ASP  16          2HB       ASP  16 -15.413   6.980 -11.032
   64    H    MET  17           H        MET  17 -17.594   6.257 -14.683
   65    HA   MET  17           HA       MET  17 -15.241   6.971 -16.006
   66   1HB   MET  17          1HB       MET  17 -16.780   7.932 -17.686
   67   2HB   MET  17          2HB       MET  17 -17.427   6.426 -17.034
   68   1HG   MET  17          1HG       MET  17 -18.764   7.791 -15.397
   69   2HG   MET  17          2HG       MET  17 -18.223   9.240 -16.242
   70   1HE   MET  17          1HE       MET  17 -20.635   9.303 -15.797
   71   2HE   MET  17          2HE       MET  17 -21.488   9.590 -17.312
   72   3HE   MET  17          3HE       MET  17 -21.822   8.130 -16.384
   73    H    SER  18           H        SER  18 -17.277   8.988 -13.968
   74    HA   SER  18           HA       SER  18 -16.998  11.206 -13.206
   75   1HB   SER  18          1HB       SER  18 -14.370   9.984 -13.648
   76   2HB   SER  18          2HB       SER  18 -14.323  11.742 -13.737
   77    HG   SER  18           HG       SER  18 -14.860  10.062 -11.603
   78    HA   PRO  19           HA       PRO  19 -17.197  13.828 -16.728
   79   1HB   PRO  19          1HB       PRO  19 -16.561  16.269 -15.685
   80   2HB   PRO  19          2HB       PRO  19 -18.091  15.440 -15.347
   81   1HG   PRO  19          2HG       PRO  19 -15.693  15.742 -13.647
   82   2HG   PRO  19          1HG       PRO  19 -17.395  15.620 -13.189
   83   1HD   PRO  19          1HD       PRO  19 -15.520  13.568 -13.035
   84   2HD   PRO  19          2HD       PRO  19 -17.283  13.369 -12.989
   85    H    LYS  20           H        LYS  20 -14.757  12.466 -16.839
   86    HA   LYS  20           HA       LYS  20 -12.651  12.576 -17.871
   87   1HB   LYS  20          1HB       LYS  20 -14.093  13.865 -19.457
   88   2HB   LYS  20          2HB       LYS  20 -13.625  15.346 -18.624
   89   1HG   LYS  20          1HG       LYS  20 -11.398  13.575 -19.462
   90   2HG   LYS  20          2HG       LYS  20 -12.283  14.371 -20.764
   91   1HD   LYS  20          1HD       LYS  20 -12.002  16.453 -19.050
   92   2HD   LYS  20          2HD       LYS  20 -10.538  15.546 -18.671
   93   1HE   LYS  20          1HE       LYS  20 -11.010  15.693 -21.556
   94   2HE   LYS  20          2HE       LYS  20 -10.829  17.296 -20.815
   95   1HZ   LYS  20          1HZ       LYS  20  -9.031  15.005 -20.237
   96   2HZ   LYS  20          2HZ       LYS  20  -8.683  16.194 -21.400
   97   3HZ   LYS  20          3HZ       LYS  20  -8.822  16.620 -19.762
   98    H    ALA  21           H        ALA  21 -12.988  16.020 -16.939
   99    HA   ALA  21           HA       ALA  21 -10.386  16.557 -16.183
  100   1HB   ALA  21          1HB       ALA  21 -11.895  18.339 -16.172
  101   2HB   ALA  21          3HB       ALA  21 -13.083  17.454 -15.214
  102   3HB   ALA  21          2HB       ALA  21 -11.631  18.096 -14.446
  103    H    LEU  22           H        LEU  22 -12.900  15.280 -13.975
  104    HA   LEU  22           HA       LEU  22 -10.966  14.899 -11.801
  105   1HB   LEU  22          1HB       LEU  22 -13.878  14.268 -12.308
  106   2HB   LEU  22          2HB       LEU  22 -13.069  13.723 -10.838
  107    HG   LEU  22           HG       LEU  22 -12.352  16.132 -10.472
  108   1HD1  LEU  22          1HD1      LEU  22 -14.035  16.372 -12.928
  109   2HD1  LEU  22          2HD1      LEU  22 -14.127  17.669 -11.736
  110   3HD1  LEU  22          3HD1      LEU  22 -12.580  17.260 -12.477
  111   1HD2  LEU  22          1HD2      LEU  22 -15.208  15.184 -10.431
  112   2HD2  LEU  22          2HD2      LEU  22 -14.111  15.461  -9.078
  113   3HD2  LEU  22          3HD2      LEU  22 -14.828  16.830  -9.926
  114    H    GLN  23           H        GLN  23 -12.643  12.912 -14.190
  115    HA   GLN  23           HA       GLN  23 -12.048  10.313 -13.312
  116   1HB   GLN  23          1HB       GLN  23 -13.401  11.031 -15.299
  117   2HB   GLN  23          2HB       GLN  23 -11.896  11.382 -16.148
  118   1HG   GLN  23          1HG       GLN  23 -11.237   8.945 -15.571
  119   2HG   GLN  23          2HG       GLN  23 -12.951   8.710 -15.228
  120   2HE2  GLN  23          2HE2      GLN  23 -11.709   7.333 -17.396
  121   1HE2  GLN  23          1HE2      GLN  23 -12.333   7.941 -18.853
  122    H    GLN  24           H        GLN  24  -9.963  12.490 -15.241
  123    HA   GLN  24           HA       GLN  24  -7.757  10.592 -15.362
  124   1HB   GLN  24          1HB       GLN  24  -8.360  12.475 -16.974
  125   2HB   GLN  24          2HB       GLN  24  -7.727  13.594 -15.767
  126   1HG   GLN  24          1HG       GLN  24  -5.931  11.337 -16.348
  127   2HG   GLN  24          2HG       GLN  24  -6.216  12.397 -17.728
  128   2HE2  GLN  24          2HE2      GLN  24  -3.713  12.161 -16.106
  129   1HE2  GLN  24          1HE2      GLN  24  -3.421  13.713 -15.482
  130    H    LYS  25           H        LYS  25  -8.274  13.663 -13.579
  131    HA   LYS  25           HA       LYS  25  -5.880  13.721 -12.101
  132   1HB   LYS  25          1HB       LYS  25  -8.631  14.777 -11.922
  133   2HB   LYS  25          2HB       LYS  25  -7.780  14.711 -10.378
  134   1HG   LYS  25          1HG       LYS  25  -6.451  16.441 -10.946
  135   2HG   LYS  25          2HG       LYS  25  -6.048  15.700 -12.495
  136   1HD   LYS  25          1HD       LYS  25  -7.581  16.939 -13.618
  137   2HD   LYS  25          2HD       LYS  25  -8.801  16.725 -12.362
  138   1HE   LYS  25          1HE       LYS  25  -7.865  18.505 -11.031
  139   2HE   LYS  25          2HE       LYS  25  -6.433  18.604 -12.074
  140   1HZ   LYS  25          1HZ       LYS  25  -7.925  19.095 -13.949
  141   2HZ   LYS  25          2HZ       LYS  25  -9.245  19.131 -12.880
  142   3HZ   LYS  25          3HZ       LYS  25  -8.009  20.283 -12.737
  143    H    ILE  26           H        ILE  26  -8.863  11.893 -11.471
  144    HA   ILE  26           HA       ILE  26  -7.955  10.906  -8.872
  145    HB   ILE  26           HB       ILE  26 -10.185  10.104 -10.769
  146   1HG1  ILE  26          1HG1      ILE  26 -10.300  11.742  -8.222
  147   2HG1  ILE  26          2HG1      ILE  26 -10.180  12.462  -9.828
  148   1HG2  ILE  26          1HG2      ILE  26  -9.188   8.672  -8.595
  149   2HG2  ILE  26          2HG2      ILE  26 -10.557   9.559  -7.924
  150   3HG2  ILE  26          3HG2      ILE  26 -10.790   8.490  -9.308
  151   1HD1  ILE  26          1HD1      ILE  26 -12.238  10.923 -10.369
  152   2HD1  ILE  26          2HD1      ILE  26 -12.447  10.904  -8.618
  153   3HD1  ILE  26          3HD1      ILE  26 -12.492  12.433  -9.495
  154    H    HIS  27           H        HIS  27  -8.322   9.484 -12.139
  155    HA   HIS  27           HA       HIS  27  -7.371   6.871 -11.499
  156   1HB   HIS  27          1HB       HIS  27  -8.574   7.692 -13.570
  157   2HB   HIS  27          2HB       HIS  27  -7.051   8.410 -14.092
  158    HD1  HIS  27           HD1      HIS  27  -5.932   5.552 -12.424
  159    HD2  HIS  27           HD2      HIS  27  -7.871   6.086 -16.076
  160    HE1  HIS  27           HE1      HIS  27  -5.473   3.470 -13.789
  161    H    GLU  28           H        GLU  28  -5.685   9.893 -11.935
  162    HA   GLU  28           HA       GLU  28  -3.075   8.711 -12.512
  163   1HB   GLU  28          1HB       GLU  28  -4.358  11.250 -12.507
  164   2HB   GLU  28          2HB       GLU  28  -2.972  11.372 -11.422
  165   1HG   GLU  28          2HG       GLU  28  -2.214  11.919 -13.654
  166   2HG   GLU  28          1HG       GLU  28  -1.560  10.336 -13.232
  167    H    LEU  29           H        LEU  29  -4.469  10.385  -9.659
  168    HA   LEU  29           HA       LEU  29  -2.221   9.688  -7.945
  169   1HB   LEU  29          1HB       LEU  29  -5.031  10.704  -7.401
  170   2HB   LEU  29          2HB       LEU  29  -3.726  10.676  -6.214
  171    HG   LEU  29           HG       LEU  29  -3.173  11.985  -8.839
  172   1HD1  LEU  29          1HD1      LEU  29  -5.490  12.674  -7.531
  173   2HD1  LEU  29          2HD1      LEU  29  -4.323  13.777  -6.802
  174   3HD1  LEU  29          3HD1      LEU  29  -4.554  13.767  -8.551
  175   1HD2  LEU  29          1HD2      LEU  29  -1.581  11.659  -6.818
  176   2HD2  LEU  29          2HD2      LEU  29  -1.660  13.264  -7.547
  177   3HD2  LEU  29          3HD2      LEU  29  -2.526  12.933  -6.047
  178    H    GLU  30           H        GLU  30  -5.460   8.357  -8.531
  179    HA   GLU  30           HA       GLU  30  -5.475   6.496  -6.335
  180   1HB   GLU  30          1HB       GLU  30  -7.425   7.317  -7.692
  181   2HB   GLU  30          2HB       GLU  30  -6.843   6.337  -9.039
  182   1HG   GLU  30          1HG       GLU  30  -6.845   4.426  -7.180
  183   2HG   GLU  30          2HG       GLU  30  -8.069   5.470  -6.455
  184    H    GLY  31           H        GLY  31  -4.354   6.270  -9.705
  185   1HA   GLY  31          2HA       GLY  31  -3.270   4.495 -10.827
  186   2HA   GLY  31          1HA       GLY  31  -3.727   3.430  -9.497
  187    H    LEU  32           H        LEU  32  -2.019   6.454  -8.971
  188    HA   LEU  32           HA       LEU  32   0.667   5.482  -9.023
  189   1HB   LEU  32          1HB       LEU  32  -0.441   7.872  -8.845
  190   2HB   LEU  32          2HB       LEU  32  -0.294   7.590  -7.110
  191    HG   LEU  32           HG       LEU  32   2.179   6.823  -7.933
  192   1HD1  LEU  32          1HD1      LEU  32   1.045   8.150 -10.173
  193   2HD1  LEU  32          2HD1      LEU  32   2.234   9.251  -9.476
  194   3HD1  LEU  32          3HD1      LEU  32   2.716   7.627  -9.966
  195   1HD2  LEU  32          1HD2      LEU  32   1.079   9.510  -7.107
  196   2HD2  LEU  32          2HD2      LEU  32   1.964   8.338  -6.131
  197   3HD2  LEU  32          3HD2      LEU  32   2.808   9.277  -7.362
  198    H    MET  33           H        MET  33  -1.817   5.437  -6.494
  199    HA   MET  33           HA       MET  33  -0.241   4.777  -4.242
  200   1HB   MET  33          1HB       MET  33  -3.038   4.389  -5.188
  201   2HB   MET  33          2HB       MET  33  -2.532   3.409  -3.810
  202   1HG   MET  33          1HG       MET  33  -2.491   5.193  -2.418
  203   2HG   MET  33          2HG       MET  33  -1.674   6.206  -3.608
  204   1HE   MET  33          1HE       MET  33  -4.843   4.095  -3.827
  205   2HE   MET  33          2HE       MET  33  -5.112   4.861  -2.263
  206   3HE   MET  33          3HE       MET  33  -6.169   5.239  -3.631
  207    H    MET  34           H        MET  34  -1.302   2.768  -6.946
  208    HA   MET  34           HA       MET  34  -0.613   0.226  -5.712
  209   1HB   MET  34          1HB       MET  34  -2.185   0.906  -7.717
  210   2HB   MET  34          2HB       MET  34  -0.709   0.746  -8.672
  211   1HG   MET  34          1HG       MET  34  -0.667  -1.520  -8.459
  212   2HG   MET  34          2HG       MET  34  -1.196  -1.467  -6.777
  213   1HE   MET  34          1HE       MET  34  -3.215  -1.005  -5.949
  214   2HE   MET  34          2HE       MET  34  -4.253   0.045  -6.909
  215   3HE   MET  34          3HE       MET  34  -4.738  -1.625  -6.582
  216    H    GLN  35           H        GLN  35   1.090   2.590  -7.720
  217    HA   GLN  35           HA       GLN  35   3.307   1.044  -8.561
  218   1HB   GLN  35          1HB       GLN  35   2.805   3.291  -9.360
  219   2HB   GLN  35          2HB       GLN  35   3.046   3.957  -7.746
  220   1HG   GLN  35          2HG       GLN  35   5.200   4.293  -8.324
  221   2HG   GLN  35          1HG       GLN  35   5.401   2.542  -8.266
  222   2HE2  GLN  35          2HE2      GLN  35   3.578   4.550 -10.636
  223   1HE2  GLN  35          1HE2      GLN  35   4.448   4.009 -11.989
  224    H    HIS  36           H        HIS  36   3.669   3.473  -5.977
  225    HA   HIS  36           HA       HIS  36   5.949   2.341  -4.775
  226   1HB   HIS  36          1HB       HIS  36   3.694   4.122  -3.899
  227   2HB   HIS  36          2HB       HIS  36   4.916   3.635  -2.725
  228    HD1  HIS  36           HD1      HIS  36   4.426   6.544  -4.217
  229    HD2  HIS  36           HD2      HIS  36   7.533   3.832  -4.819
  230    HE1  HIS  36           HE1      HIS  36   6.351   7.867  -5.196
  231    H    ALA  37           H        ALA  37   2.519   1.890  -3.809
  232    HA   ALA  37           HA       ALA  37   2.809   0.190  -1.608
  233   1HB   ALA  37          1HB       ALA  37   0.833   0.085  -3.914
  234   2HB   ALA  37          2HB       ALA  37   0.586  -0.683  -2.346
  235   3HB   ALA  37          3HB       ALA  37   0.686   1.074  -2.461
  236    H    GLN  38           H        GLN  38   3.044  -0.630  -5.068
  237    HA   GLN  38           HA       GLN  38   3.207  -3.484  -4.762
  238   1HB   GLN  38          1HB       GLN  38   3.570  -1.412  -6.798
  239   2HB   GLN  38          2HB       GLN  38   4.688  -2.758  -7.013
  240   1HG   GLN  38          1HG       GLN  38   2.311  -4.036  -6.414
  241   2HG   GLN  38          2HG       GLN  38   1.783  -2.672  -7.400
  242   2HE2  GLN  38          2HE2      GLN  38   2.039  -2.889  -9.639
  243   1HE2  GLN  38          1HE2      GLN  38   2.982  -4.086 -10.388
  244    H    ASN  39           H        ASN  39   5.617  -0.884  -4.687
  245    HA   ASN  39           HA       ASN  39   7.831  -2.823  -4.317
  246   1HB   ASN  39          1HB       ASN  39   7.670   0.206  -4.479
  247   2HB   ASN  39          2HB       ASN  39   9.175  -0.710  -4.393
  248   2HD2  ASN  39          2HD2      ASN  39   8.563   0.937  -6.662
  249   1HD2  ASN  39          1HD2      ASN  39   8.328  -0.074  -8.005
  250    H    LEU  40           H        LEU  40   5.550  -2.156  -2.302
  251    HA   LEU  40           HA       LEU  40   5.344  -1.916   0.020
  252   1HB   LEU  40          1HB       LEU  40   8.174  -2.890  -0.403
  253   2HB   LEU  40          2HB       LEU  40   7.507  -2.670   1.215
  254    HG   LEU  40           HG       LEU  40   5.502  -4.086   0.284
  255   1HD1  LEU  40          1HD1      LEU  40   7.569  -4.293  -1.816
  256   2HD1  LEU  40          2HD1      LEU  40   6.902  -5.839  -1.289
  257   3HD1  LEU  40          3HD1      LEU  40   5.833  -4.582  -1.914
  258   1HD2  LEU  40          1HD2      LEU  40   7.410  -4.664   1.992
  259   2HD2  LEU  40          2HD2      LEU  40   6.449  -5.972   1.305
  260   3HD2  LEU  40          3HD2      LEU  40   8.057  -5.631   0.667
  261    H    GLU  41           H        GLU  41   6.363   0.418  -1.675
  262    HA   GLU  41           HA       GLU  41   8.236   1.938  -0.092
  263   1HB   GLU  41          1HB       GLU  41   6.652   2.170  -2.484
  264   2HB   GLU  41          2HB       GLU  41   6.446   3.633  -1.520
  265   1HG   GLU  41          2HG       GLU  41   8.363   3.952  -2.968
  266   2HG   GLU  41          1HG       GLU  41   8.948   3.771  -1.314
  267    H    PHE  42           H        PHE  42   4.681   1.988  -0.343
  268    HA   PHE  42           HA       PHE  42   3.048   2.880   1.107
  269   1HB   PHE  42          1HB       PHE  42   5.201   1.594   2.748
  270   2HB   PHE  42          2HB       PHE  42   3.897   2.433   3.586
  271    HD1  PHE  42           HD1      PHE  42   1.551   1.939   1.905
  272    HD2  PHE  42           HD2      PHE  42   4.792  -0.715   2.953
  273    HE1  PHE  42           HE1      PHE  42   0.057  -0.025   1.554
  274    HE2  PHE  42           HE2      PHE  42   3.296  -2.678   2.603
  275    HZ   PHE  42           HZ       PHE  42   0.928  -2.330   1.905
  276    H    GLU  43           H        GLU  43   2.933   4.313   3.250
  277    HA   GLU  43           HA       GLU  43   3.219   6.399   4.260
  278   1HB   GLU  43          1HB       GLU  43   5.506   5.637   4.673
  279   2HB   GLU  43          2HB       GLU  43   5.980   6.061   3.032
  280   1HG   GLU  43          1HG       GLU  43   5.267   8.438   3.553
  281   2HG   GLU  43          2HG       GLU  43   5.140   7.940   5.242
  282    H    GLU  44           H        GLU  44   5.005   6.503   1.209
  283    HA   GLU  44           HA       GLU  44   3.810   9.082   0.476
  284   1HB   GLU  44          1HB       GLU  44   5.319   8.877  -1.440
  285   2HB   GLU  44          2HB       GLU  44   6.181   8.418   0.028
  286   1HG   GLU  44          1HG       GLU  44   5.852   6.052  -0.463
  287   2HG   GLU  44          2HG       GLU  44   4.860   6.452  -1.865
  288    H    ALA  45           H        ALA  45   3.427   5.663  -0.377
  289    HA   ALA  45           HA       ALA  45   1.671   6.208  -2.659
  290   1HB   ALA  45          1HB       ALA  45   1.690   3.562  -1.323
  291   2HB   ALA  45          3HB       ALA  45   3.266   4.162  -1.842
  292   3HB   ALA  45          2HB       ALA  45   1.965   3.967  -3.017
  293    H    ALA  46           H        ALA  46   1.198   5.005   0.678
  294    HA   ALA  46           HA       ALA  46  -1.679   4.753   0.369
  295   1HB   ALA  46          1HB       ALA  46  -0.058   3.536   1.935
  296   2HB   ALA  46          3HB       ALA  46  -0.093   4.993   2.930
  297   3HB   ALA  46          2HB       ALA  46  -1.576   4.079   2.650
  298    H    GLN  47           H        GLN  47   0.473   7.296   1.617
  299    HA   GLN  47           HA       GLN  47  -1.410   8.924   2.951
  300   1HB   GLN  47          1HB       GLN  47   1.154   9.287   1.469
  301   2HB   GLN  47          2HB       GLN  47   0.228  10.744   1.829
  302   1HG   GLN  47          1HG       GLN  47   0.137  10.077   4.219
  303   2HG   GLN  47          2HG       GLN  47   1.123   8.662   3.846
  304   2HE2  GLN  47          2HE2      GLN  47   2.041  10.675   5.672
  305   1HE2  GLN  47          1HE2      GLN  47   3.370  11.464   4.971
  306    H    ILE  48           H        ILE  48  -0.981   8.321  -0.473
  307    HA   ILE  48           HA       ILE  48  -2.311  10.616  -1.540
  308    HB   ILE  48           HB       ILE  48  -2.112   7.742  -2.499
  309   1HG1  ILE  48          1HG1      ILE  48  -0.415  10.196  -3.062
  310   2HG1  ILE  48          2HG1      ILE  48   0.066   8.819  -2.069
  311   1HG2  ILE  48          1HG2      ILE  48  -3.877   9.280  -3.583
  312   2HG2  ILE  48          2HG2      ILE  48  -2.508  10.204  -4.204
  313   3HG2  ILE  48          3HG2      ILE  48  -2.711   8.512  -4.661
  314   1HD1  ILE  48          1HD1      ILE  48  -0.821   7.714  -4.501
  315   2HD1  ILE  48          2HD1      ILE  48   0.161   9.107  -4.950
  316   3HD1  ILE  48          3HD1      ILE  48   0.846   7.835  -3.939
  317    H    ARG  49           H        ARG  49  -3.535   7.689  -0.020
  318    HA   ARG  49           HA       ARG  49  -6.175   7.583  -0.992
  319   1HB   ARG  49          2HB       ARG  49  -6.639   6.445   1.120
  320   2HB   ARG  49          1HB       ARG  49  -5.023   5.998   0.576
  321   1HG   ARG  49          2HG       ARG  49  -4.443   6.562   2.714
  322   2HG   ARG  49          1HG       ARG  49  -4.434   8.198   2.055
  323   1HD   ARG  49          1HD       ARG  49  -7.067   7.988   2.642
  324   2HD   ARG  49          2HD       ARG  49  -6.396   6.919   3.890
  325    HE   ARG  49           HE       ARG  49  -4.777   9.261   3.755
  326   1HH1  ARG  49          1HH1      ARG  49  -8.040   9.563   3.716
  327   2HH1  ARG  49          2HH1      ARG  49  -8.216  10.197   5.319
  328   1HH2  ARG  49          1HH2      ARG  49  -4.946   9.503   6.239
  329   2HH2  ARG  49          2HH2      ARG  49  -6.465  10.163   6.747
  330    H    ASP  50           H        ASP  50  -4.680   9.907   1.159
  331    HA   ASP  50           HA       ASP  50  -7.179  11.047   2.153
  332   1HB   ASP  50          1HB       ASP  50  -4.609  11.038   2.970
  333   2HB   ASP  50          2HB       ASP  50  -4.619  12.576   2.108
  334    H    GLN  51           H        GLN  51  -4.804  11.878  -0.376
  335    HA   GLN  51           HA       GLN  51  -5.988  14.367  -1.169
  336   1HB   GLN  51          1HB       GLN  51  -4.374  12.300  -2.702
  337   2HB   GLN  51          2HB       GLN  51  -4.616  13.972  -3.207
  338   1HG   GLN  51          1HG       GLN  51  -3.476  14.792  -1.223
  339   2HG   GLN  51          2HG       GLN  51  -3.345  13.155  -0.580
  340   2HE2  GLN  51          2HE2      GLN  51  -2.830  14.078  -3.995
  341   1HE2  GLN  51          1HE2      GLN  51  -1.187  13.658  -4.030
  342    H    LEU  52           H        LEU  52  -6.554  11.005  -2.171
  343    HA   LEU  52           HA       LEU  52  -8.347  11.624  -4.352
  344   1HB   LEU  52          1HB       LEU  52  -7.197   9.358  -2.988
  345   2HB   LEU  52          2HB       LEU  52  -8.923   9.082  -3.221
  346    HG   LEU  52           HG       LEU  52  -7.628   8.278  -5.164
  347   1HD1  LEU  52          1HD1      LEU  52  -9.765  10.226  -5.217
  348   2HD1  LEU  52          2HD1      LEU  52  -8.763  10.386  -6.659
  349   3HD1  LEU  52          3HD1      LEU  52  -9.508   8.835  -6.272
  350   1HD2  LEU  52          1HD2      LEU  52  -6.097  10.567  -4.689
  351   2HD2  LEU  52          2HD2      LEU  52  -5.941   9.481  -6.070
  352   3HD2  LEU  52          3HD2      LEU  52  -6.947  10.923  -6.193
  353    H    HIS  53           H        HIS  53  -8.851  10.792  -0.915
  354    HA   HIS  53           HA       HIS  53 -11.664  10.610  -0.868
  355   1HB   HIS  53          1HB       HIS  53  -9.432  11.080   0.957
  356   2HB   HIS  53          2HB       HIS  53 -10.897  11.906   1.488
  357    HD1  HIS  53           HD1      HIS  53 -11.581  10.308   3.352
  358    HD2  HIS  53           HD2      HIS  53 -10.963   8.364  -0.284
  359    HE1  HIS  53           HE1      HIS  53 -12.413   7.935   3.657
  360    H    GLN  54           H        GLN  54  -9.587  13.503  -0.679
  361    HA   GLN  54           HA       GLN  54 -11.861  15.332  -0.422
  362   1HB   GLN  54          1HB       GLN  54  -8.912  15.731  -1.032
  363   2HB   GLN  54          2HB       GLN  54 -10.040  17.018  -0.600
  364   1HG   GLN  54          1HG       GLN  54 -10.111  16.403   1.606
  365   2HG   GLN  54          2HG       GLN  54  -9.948  14.685   1.238
  366   2HE2  GLN  54          2HE2      GLN  54  -8.356  15.799   3.288
  367   1HE2  GLN  54          1HE2      GLN  54  -6.738  15.849   2.777
  368    H    LEU  55           H        LEU  55  -9.825  14.080  -3.017
  369    HA   LEU  55           HA       LEU  55 -10.580  15.991  -5.038
  370   1HB   LEU  55          1HB       LEU  55  -9.114  13.466  -4.750
  371   2HB   LEU  55          2HB       LEU  55  -9.911  13.627  -6.316
  372    HG   LEU  55           HG       LEU  55  -8.642  16.119  -5.513
  373   1HD1  LEU  55          1HD1      LEU  55  -7.186  13.670  -4.985
  374   2HD1  LEU  55          2HD1      LEU  55  -6.391  14.600  -6.254
  375   3HD1  LEU  55          3HD1      LEU  55  -6.700  15.337  -4.681
  376   1HD2  LEU  55          1HD2      LEU  55  -8.544  14.212  -7.854
  377   2HD2  LEU  55          2HD2      LEU  55  -9.248  15.828  -7.785
  378   3HD2  LEU  55          3HD2      LEU  55  -7.496  15.629  -7.783
  379    H    ARG  56           H        ARG  56 -11.884  12.825  -4.078
  380    HA   ARG  56           HA       ARG  56 -13.733  12.466  -6.201
  381   1HB   ARG  56          2HB       ARG  56 -14.773  10.904  -4.644
  382   2HB   ARG  56          1HB       ARG  56 -13.022  10.834  -4.438
  383   1HG   ARG  56          2HG       ARG  56 -13.344  11.250  -2.249
  384   2HG   ARG  56          1HG       ARG  56 -13.874  12.869  -2.703
  385   1HD   ARG  56          1HD       ARG  56 -16.201  11.925  -3.040
  386   2HD   ARG  56          2HD       ARG  56 -15.615  10.413  -2.318
  387    HE   ARG  56           HE       ARG  56 -14.783  12.400  -0.551
  388   1HH1  ARG  56          1HH1      ARG  56 -17.449  10.465  -1.205
  389   2HH1  ARG  56          2HH1      ARG  56 -18.546  11.326  -0.178
  390   1HH2  ARG  56          1HH2      ARG  56 -16.330  13.913   0.470
  391   2HH2  ARG  56          2HH2      ARG  56 -17.913  13.278   0.770
  392    H    GLU  57           H        GLU  57 -13.794  14.653  -3.486
  393    HA   GLU  57           HA       GLU  57 -16.625  15.127  -3.331
  394   1HB   GLU  57          2HB       GLU  57 -14.289  16.987  -2.779
  395   2HB   GLU  57          1HB       GLU  57 -15.909  17.114  -2.092
  396   1HG   GLU  57          1HG       GLU  57 -15.520  14.731  -1.190
  397   2HG   GLU  57          2HG       GLU  57 -13.819  15.000  -1.571
  398    H    LEU  58           H        LEU  58 -14.025  16.599  -5.264
  399    HA   LEU  58           HA       LEU  58 -15.399  18.777  -6.405
  400   1HB   LEU  58          1HB       LEU  58 -13.164  16.947  -7.132
  401   2HB   LEU  58          2HB       LEU  58 -13.819  17.942  -8.432
  402    HG   LEU  58           HG       LEU  58 -13.383  19.378  -5.891
  403   1HD1  LEU  58          1HD1      LEU  58 -11.426  17.672  -6.215
  404   2HD1  LEU  58          2HD1      LEU  58 -10.943  18.740  -7.533
  405   3HD1  LEU  58          3HD1      LEU  58 -11.039  19.360  -5.884
  406   1HD2  LEU  58          1HD2      LEU  58 -13.959  20.149  -8.375
  407   2HD2  LEU  58          2HD2      LEU  58 -12.955  21.149  -7.325
  408   3HD2  LEU  58          3HD2      LEU  58 -12.203  20.117  -8.542
  409    H    PHE  59           H        PHE  59 -15.827  15.357  -6.957
  410    HA   PHE  59           HA       PHE  59 -16.935  15.249  -9.536
  411   1HB   PHE  59          1HB       PHE  59 -16.475  13.313  -8.105
  412   2HB   PHE  59          2HB       PHE  59 -17.733  13.822  -6.978
  413    HD1  PHE  59           HD1      PHE  59 -20.128  13.693  -7.596
  414    HD2  PHE  59           HD2      PHE  59 -17.023  12.294 -10.251
  415    HE1  PHE  59           HE1      PHE  59 -21.832  12.477  -8.948
  416    HE2  PHE  59           HE2      PHE  59 -18.729  11.078 -11.604
  417    HZ   PHE  59           HZ       PHE  59 -21.133  11.169 -10.952
  418    H    ILE  60           H        ILE  60 -18.449  16.295  -6.495
  419    HA   ILE  60           HA       ILE  60 -21.119  16.566  -7.608
  420    HB   ILE  60           HB       ILE  60 -19.766  17.754  -5.162
  421   1HG1  ILE  60          1HG1      ILE  60 -21.679  15.550  -4.836
  422   2HG1  ILE  60          2HG1      ILE  60 -20.248  15.094  -5.761
  423   1HG2  ILE  60          1HG2      ILE  60 -21.939  18.835  -5.968
  424   2HG2  ILE  60          2HG2      ILE  60 -22.721  17.292  -5.620
  425   3HG2  ILE  60          3HG2      ILE  60 -21.956  18.207  -4.321
  426   1HD1  ILE  60          1HD1      ILE  60 -18.833  16.098  -3.944
  427   2HD1  ILE  60          2HD1      ILE  60 -20.303  16.346  -3.001
  428   3HD1  ILE  60          3HD1      ILE  60 -19.782  14.712  -3.412
  429    H    ALA  61           H        ALA  61 -18.439  18.834  -6.953
  430    HA   ALA  61           HA       ALA  61 -19.835  21.211  -7.783
  431   1HB   ALA  61          1HB       ALA  61 -17.632  20.795  -6.428
  432   2HB   ALA  61          3HB       ALA  61 -16.863  20.772  -8.014
  433   3HB   ALA  61          2HB       ALA  61 -17.727  22.212  -7.475
  434    H    ALA  62           H        ALA  62 -18.283  18.627  -9.537
  435    HA   ALA  62           HA       ALA  62 -18.268  20.235 -12.053
  436   1HB   ALA  62          1HB       ALA  62 -17.113  17.539 -11.268
  437   2HB   ALA  62          3HB       ALA  62 -16.922  18.277 -12.858
  438   3HB   ALA  62          2HB       ALA  62 -16.221  19.051 -11.437
  439    H    SER  63           H        SER  63 -19.136  16.886 -11.082
  440    HA   SER  63           HA       SER  63 -21.057  16.705 -13.311
  441   1HB   SER  63          1HB       SER  63 -19.391  14.949 -12.181
  442   2HB   SER  63          2HB       SER  63 -20.784  14.659 -11.143
  443    HG   SER  63           HG       SER  63 -20.375  13.679 -13.514
  444    H    LEU   8           H        LEU   8   6.333 -17.276 -11.582
  445    HA   LEU   8           HA       LEU   8   9.130 -16.581 -10.922
  446   1HB   LEU   8          1HB       LEU   8   8.069 -17.281 -13.202
  447   2HB   LEU   8          2HB       LEU   8   7.510 -15.610 -13.272
  448    HG   LEU   8           HG       LEU   8  10.262 -15.605 -12.479
  449   1HD1  LEU   8          1HD1      LEU   8   9.591 -17.295 -14.902
  450   2HD1  LEU   8          2HD1      LEU   8  11.179 -16.573 -14.638
  451   3HD1  LEU   8          3HD1      LEU   8  10.551 -17.764 -13.499
  452   1HD2  LEU   8          1HD2      LEU   8   8.487 -14.491 -14.557
  453   2HD2  LEU   8          2HD2      LEU   8   9.761 -13.702 -13.627
  454   3HD2  LEU   8          3HD2      LEU   8  10.172 -14.652 -15.055
  455    H    GLU   9           H        GLU   9   6.746 -15.479  -9.385
  456    HA   GLU   9           HA       GLU   9   6.531 -12.663 -10.106
  457   1HB   GLU   9          1HB       GLU   9   5.432 -14.590  -8.210
  458   2HB   GLU   9          2HB       GLU   9   5.723 -13.024  -7.454
  459   1HG   GLU   9          1HG       GLU   9   4.620 -12.325  -9.892
  460   2HG   GLU   9          2HG       GLU   9   3.722 -13.781  -9.460
  461    HA   PRO  10           HA       PRO  10   9.350 -11.986  -6.318
  462   1HB   PRO  10          1HB       PRO  10  10.446 -14.161  -5.072
  463   2HB   PRO  10          2HB       PRO  10   8.869 -13.480  -4.621
  464   1HG   PRO  10          2HG       PRO  10   9.496 -15.877  -6.264
  465   2HG   PRO  10          1HG       PRO  10   8.192 -15.616  -5.097
  466   1HD   PRO  10          1HD       PRO  10   7.862 -15.494  -7.810
  467   2HD   PRO  10          2HD       PRO  10   6.830 -14.640  -6.644
  468    H    ASP  11           H        ASP  11  10.484 -15.084  -7.738
  469    HA   ASP  11           HA       ASP  11  12.433 -15.589  -8.966
  470   1HB   ASP  11          1HB       ASP  11  11.528 -12.937  -9.684
  471   2HB   ASP  11          2HB       ASP  11  13.288 -13.011  -9.768
  472    H    ASN  12           H        ASN  12  13.454 -12.343  -7.950
  473    HA   ASN  12           HA       ASN  12  15.248 -13.502  -5.882
  474   1HB   ASN  12          1HB       ASN  12  16.210 -13.435  -8.326
  475   2HB   ASN  12          2HB       ASN  12  16.373 -11.707  -8.020
  476   2HD2  ASN  12          2HD2      ASN  12  17.279 -11.440  -5.499
  477   1HD2  ASN  12          1HD2      ASN  12  18.696 -12.332  -5.226
  478    H    VAL  13           H        VAL  13  12.923 -11.484  -6.205
  479    HA   VAL  13           HA       VAL  13  14.100  -8.893  -5.554
  480    HB   VAL  13           HB       VAL  13  11.409 -10.143  -5.911
  481   1HG1  VAL  13          1HG1      VAL  13  11.930  -7.710  -4.219
  482   2HG1  VAL  13          2HG1      VAL  13  10.484  -7.777  -5.226
  483   3HG1  VAL  13          3HG1      VAL  13  10.746  -8.996  -3.979
  484   1HG2  VAL  13          1HG2      VAL  13  12.861  -8.948  -7.661
  485   2HG2  VAL  13          2HG2      VAL  13  11.170  -8.459  -7.556
  486   3HG2  VAL  13          3HG2      VAL  13  12.425  -7.456  -6.829
  487    HA   PRO  14           HA       PRO  14  12.562  -9.874  -1.153
  488   1HB   PRO  14          1HB       PRO  14  11.515 -12.342  -0.617
  489   2HB   PRO  14          2HB       PRO  14  10.529 -10.979  -1.183
  490   1HG   PRO  14          2HG       PRO  14  11.568 -13.318  -2.690
  491   2HG   PRO  14          1HG       PRO  14  10.029 -12.459  -2.853
  492   1HD   PRO  14          1HD       PRO  14  12.166 -12.127  -4.542
  493   2HD   PRO  14          2HD       PRO  14  10.896 -10.917  -4.273
  494    H    MET  15           H        MET  15  13.483 -13.061  -2.512
  495    HA   MET  15           HA       MET  15  15.254 -14.508  -1.936
  496   1HB   MET  15          1HB       MET  15  16.165 -12.025  -2.649
  497   2HB   MET  15          2HB       MET  15  16.926 -12.228  -1.071
  498   1HG   MET  15          1HG       MET  15  17.648 -14.549  -1.893
  499   2HG   MET  15          2HG       MET  15  17.182 -14.003  -3.504
  500   1HE   MET  15          1HE       MET  15  19.393 -15.014  -3.606
  501   2HE   MET  15          2HE       MET  15  20.065 -13.770  -4.669
  502   3HE   MET  15          3HE       MET  15  20.940 -14.262  -3.222
  503    H    ASP  16           H        ASP  16  17.311 -13.802   0.110
  504    HA   ASP  16           HA       ASP  16  17.642 -14.104   2.426
  505   1HB   ASP  16          1HB       ASP  16  15.608 -12.146   1.964
  506   2HB   ASP  16          2HB       ASP  16  15.132 -13.093   3.374
  507    H    MET  17           H        MET  17  17.169 -16.470   1.627
  508    HA   MET  17           HA       MET  17  14.767 -17.852   1.964
  509   1HB   MET  17          1HB       MET  17  16.238 -19.791   2.393
  510   2HB   MET  17          2HB       MET  17  16.910 -18.764   1.126
  511   1HG   MET  17          1HG       MET  17  18.310 -17.632   2.883
  512   2HG   MET  17          2HG       MET  17  17.736 -18.831   4.042
  513   1HE   MET  17          1HE       MET  17  20.164 -18.513   4.200
  514   2HE   MET  17          2HE       MET  17  20.957 -20.078   4.039
  515   3HE   MET  17          3HE       MET  17  21.328 -18.789   2.896
  516    H    SER  18           H        SER  18  16.881 -16.545   4.451
  517    HA   SER  18           HA       SER  18  16.631 -16.430   6.797
  518   1HB   SER  18          1HB       SER  18  13.988 -16.410   5.529
  519   2HB   SER  18          2HB       SER  18  13.938 -16.990   7.191
  520    HG   SER  18           HG       SER  18  14.558 -14.491   6.175
  521    HA   PRO  19           HA       PRO  19  16.692 -20.554   8.316
  522   1HB   PRO  19          1HB       PRO  19  16.096 -20.220  10.959
  523   2HB   PRO  19          2HB       PRO  19  17.639 -19.719  10.241
  524   1HG   PRO  19          1HG       PRO  19  15.310 -18.086  11.038
  525   2HG   PRO  19          2HG       PRO  19  17.029 -17.676  11.032
  526   1HD   PRO  19          1HD       PRO  19  15.161 -16.878   9.128
  527   2HD   PRO  19          2HD       PRO  19  16.924 -16.843   8.930
  528    H    LYS  20           H        LYS  20  14.249 -20.184   7.005
  529    HA   LYS  20           HA       LYS  20  12.105 -21.124   6.842
  530   1HB   LYS  20          1HB       LYS  20  13.483 -23.063   7.614
  531   2HB   LYS  20          2HB       LYS  20  13.049 -22.667   9.276
  532   1HG   LYS  20          1HG       LYS  20  10.789 -22.886   7.365
  533   2HG   LYS  20          2HG       LYS  20  11.622 -24.392   7.752
  534   1HD   LYS  20          1HD       LYS  20  11.410 -23.326  10.235
  535   2HD   LYS  20          2HD       LYS  20   9.962 -22.652   9.488
  536   1HE   LYS  20          1HE       LYS  20  10.321 -25.477   8.811
  537   2HE   LYS  20          2HE       LYS  20  10.168 -25.213  10.559
  538   1HZ   LYS  20          1HZ       LYS  20   8.395 -23.944   8.545
  539   2HZ   LYS  20          2HZ       LYS  20   8.002 -25.381   9.360
  540   3HZ   LYS  20          3HZ       LYS  20   8.205 -23.936  10.230
  541    H    ALA  21           H        ALA  21  12.477 -21.217  10.405
  542    HA   ALA  21           HA       ALA  21   9.907 -20.547  11.162
  543   1HB   ALA  21          1HB       ALA  21  12.640 -19.974  12.267
  544   2HB   ALA  21          3HB       ALA  21  11.220 -19.363  13.116
  545   3HB   ALA  21          2HB       ALA  21  11.417 -21.097  12.858
  546    H    LEU  22           H        LEU  22  12.506 -18.164  10.533
  547    HA   LEU  22           HA       LEU  22  10.659 -15.901  10.803
  548   1HB   LEU  22          1HB       LEU  22  13.550 -16.316  10.022
  549   2HB   LEU  22          2HB       LEU  22  12.796 -14.724   9.923
  550    HG   LEU  22           HG       LEU  22  12.095 -15.027  12.345
  551   1HD1  LEU  22          1HD1      LEU  22  13.681 -17.511  11.864
  552   2HD1  LEU  22          2HD1      LEU  22  13.821 -16.738  13.443
  553   3HD1  LEU  22          3HD1      LEU  22  12.245 -17.275  12.858
  554   1HD2  LEU  22          1HD2      LEU  22  14.950 -14.826  11.416
  555   2HD2  LEU  22          2HD2      LEU  22  13.908 -13.566  12.074
  556   3HD2  LEU  22          3HD2      LEU  22  14.591 -14.793  13.142
  557    H    GLN  23           H        GLN  23  12.240 -17.691   8.203
  558    HA   GLN  23           HA       GLN  23  11.680 -16.092   5.964
  559   1HB   GLN  23          1HB       GLN  23  12.955 -18.251   6.078
  560   2HB   GLN  23          2HB       GLN  23  11.417 -19.107   6.191
  561   1HG   GLN  23          1HG       GLN  23  10.782 -17.842   4.023
  562   2HG   GLN  23          2HG       GLN  23  12.508 -17.511   3.876
  563   2HE2  GLN  23          2HE2      GLN  23  11.183 -19.154   1.957
  564   1HE2  GLN  23          1HE2      GLN  23  11.748 -20.746   2.122
  565    H    GLN  24           H        GLN  24   9.521 -18.479   7.531
  566    HA   GLN  24           HA       GLN  24   7.312 -17.976   5.701
  567   1HB   GLN  24          1HB       GLN  24   7.851 -20.075   7.044
  568   2HB   GLN  24          2HB       GLN  24   7.267 -19.211   8.467
  569   1HG   GLN  24          1HG       GLN  24   5.450 -19.062   6.157
  570   2HG   GLN  24          2HG       GLN  24   5.681 -20.695   6.781
  571   2HE2  GLN  24          2HE2      GLN  24   3.243 -18.980   7.040
  572   1HE2  GLN  24          1HE2      GLN  24   2.975 -18.810   8.708
  573    H    LYS  25           H        LYS  25   7.898 -17.152   9.143
  574    HA   LYS  25           HA       LYS  25   5.564 -15.662   9.644
  575   1HB   LYS  25          1HB       LYS  25   8.320 -15.893  10.676
  576   2HB   LYS  25          2HB       LYS  25   7.531 -14.363  11.058
  577   1HG   LYS  25          1HG       LYS  25   6.181 -15.346  12.572
  578   2HG   LYS  25          2HG       LYS  25   5.717 -16.606  11.428
  579   1HD   LYS  25          1HD       LYS  25   7.204 -18.090  12.283
  580   2HD   LYS  25          2HD       LYS  25   8.473 -16.872  12.419
  581   1HE   LYS  25          1HE       LYS  25   7.590 -16.063  14.512
  582   2HE   LYS  25          2HE       LYS  25   6.117 -17.037  14.329
  583   1HZ   LYS  25          1HZ       LYS  25   7.535 -19.029  14.254
  584   2HZ   LYS  25          2HZ       LYS  25   8.896 -18.064  14.575
  585   3HZ   LYS  25          3HZ       LYS  25   7.666 -18.207  15.735
  586    H    ILE  26           H        ILE  26   8.569 -14.654   8.035
  587    HA   ILE  26           HA       ILE  26   7.764 -11.850   7.832
  588    HB   ILE  26           HB       ILE  26   9.918 -13.526   6.501
  589   1HG1  ILE  26          1HG1      ILE  26  10.132 -11.551   8.792
  590   2HG1  ILE  26          2HG1      ILE  26   9.950 -13.290   9.030
  591   1HG2  ILE  26          1HG2      ILE  26   9.008 -11.000   5.753
  592   2HG2  ILE  26          2HG2      ILE  26  10.402 -10.660   6.778
  593   3HG2  ILE  26          3HG2      ILE  26  10.581 -11.692   5.359
  594   1HD1  ILE  26          1HD1      ILE  26  11.984 -13.452   7.378
  595   2HD1  ILE  26          2HD1      ILE  26  12.262 -11.776   7.851
  596   3HD1  ILE  26          3HD1      ILE  26  12.273 -13.051   9.071
  597    H    HIS  27           H        HIS  27   8.004 -14.592   5.540
  598    HA   HIS  27           HA       HIS  27   7.078 -13.205   3.225
  599   1HB   HIS  27          1HB       HIS  27   8.199 -15.467   3.415
  600   2HB   HIS  27          2HB       HIS  27   6.657 -16.113   3.974
  601    HD1  HIS  27           HD1      HIS  27   5.604 -13.666   1.714
  602    HD2  HIS  27           HD2      HIS  27   7.399 -17.391   1.176
  603    HE1  HIS  27           HE1      HIS  27   5.093 -14.371  -0.664
  604    H    GLU  28           H        GLU  28   5.377 -14.413   6.019
  605    HA   GLU  28           HA       GLU  28   2.747 -14.535   4.752
  606   1HB   GLU  28          1HB       GLU  28   4.028 -15.295   7.176
  607   2HB   GLU  28          2HB       GLU  28   2.685 -14.237   7.614
  608   1HG   GLU  28          2HG       GLU  28   1.840 -16.502   7.516
  609   2HG   GLU  28          1HG       GLU  28   1.205 -15.627   6.123
  610    H    LEU  29           H        LEU  29   4.252 -12.324   7.146
  611    HA   LEU  29           HA       LEU  29   2.072 -10.401   6.986
  612   1HB   LEU  29          1HB       LEU  29   4.900 -10.273   8.084
  613   2HB   LEU  29          2HB       LEU  29   3.643  -9.078   8.406
  614    HG   LEU  29           HG       LEU  29   2.988 -11.944   8.927
  615   1HD1  LEU  29          1HD1      LEU  29   5.354 -10.973   9.932
  616   2HD1  LEU  29          2HD1      LEU  29   4.217 -10.542  11.209
  617   3HD1  LEU  29          3HD1      LEU  29   4.378 -12.223  10.703
  618   1HD2  LEU  29          1HD2      LEU  29   1.475  -9.855   9.204
  619   2HD2  LEU  29          2HD2      LEU  29   1.526 -11.010  10.535
  620   3HD2  LEU  29          3HD2      LEU  29   2.450  -9.512  10.633
  621    H    GLU  30           H        GLU  30   5.286 -10.707   5.508
  622    HA   GLU  30           HA       GLU  30   5.388  -8.076   4.343
  623   1HB   GLU  30          1HB       GLU  30   7.282  -9.683   4.725
  624   2HB   GLU  30          2HB       GLU  30   6.647 -10.676   3.413
  625   1HG   GLU  30          1HG       GLU  30   6.723  -8.356   2.104
  626   2HG   GLU  30          2HG       GLU  30   7.976  -8.001   3.295
  627    H    GLY  31           H        GLY  31   4.136 -11.199   3.187
  628   1HA   GLY  31          2HA       GLY  31   3.011 -11.732   1.178
  629   2HA   GLY  31          1HA       GLY  31   3.519 -10.172   0.529
  630    H    LEU  32           H        LEU  32   1.832 -10.464   3.596
  631    HA   LEU  32           HA       LEU  32  -0.853 -10.140   2.679
  632   1HB   LEU  32          1HB       LEU  32   0.260 -10.685   5.010
  633   2HB   LEU  32          2HB       LEU  32   0.180  -8.936   5.232
  634    HG   LEU  32           HG       LEU  32  -2.323  -9.417   4.289
  635   1HD1  LEU  32          1HD1      LEU  32  -1.278 -11.982   4.918
  636   2HD1  LEU  32          2HD1      LEU  32  -2.438 -11.579   6.184
  637   3HD1  LEU  32          3HD1      LEU  32  -2.939 -11.572   4.493
  638   1HD2  LEU  32          1HD2      LEU  32  -1.193  -9.426   7.089
  639   2HD2  LEU  32          2HD2      LEU  32  -2.039  -8.126   6.249
  640   3HD2  LEU  32          3HD2      LEU  32  -2.931  -9.539   6.812
  641    H    MET  33           H        MET  33   1.726  -7.795   3.322
  642    HA   MET  33           HA       MET  33   0.239  -5.390   3.341
  643   1HB   MET  33          1HB       MET  33   2.997  -6.292   2.673
  644   2HB   MET  33          2HB       MET  33   2.545  -4.676   2.127
  645   1HG   MET  33          1HG       MET  33   2.559  -3.845   4.232
  646   2HG   MET  33          2HG       MET  33   1.694  -5.241   4.876
  647   1HE   MET  33          1HE       MET  33   4.854  -4.975   2.755
  648   2HE   MET  33          2HE       MET  33   5.184  -3.702   3.928
  649   3HE   MET  33          3HE       MET  33   6.186  -5.160   3.894
  650    H    MET  34           H        MET  34   1.191  -7.454   0.640
  651    HA   MET  34           HA       MET  34   0.552  -5.528  -1.444
  652   1HB   MET  34          1HB       MET  34   2.044  -7.701  -1.373
  653   2HB   MET  34          2HB       MET  34   0.534  -8.516  -1.779
  654   1HG   MET  34          1HG       MET  34   0.500  -7.672  -3.893
  655   2HG   MET  34          2HG       MET  34   1.095  -6.095  -3.375
  656   1HE   MET  34          1HE       MET  34   3.142  -5.508  -2.718
  657   2HE   MET  34          2HE       MET  34   4.144  -6.763  -1.992
  658   3HE   MET  34          3HE       MET  34   4.640  -5.997  -3.508
  659    H    GLN  35           H        GLN  35  -1.225  -8.057   0.278
  660    HA   GLN  35           HA       GLN  35  -3.474  -8.344  -1.418
  661   1HB   GLN  35          1HB       GLN  35  -3.004  -9.764   0.507
  662   2HB   GLN  35          2HB       GLN  35  -3.182  -8.396   1.604
  663   1HG   GLN  35          2HG       GLN  35  -5.359  -8.963   1.786
  664   2HG   GLN  35          1HG       GLN  35  -5.555  -8.407   0.124
  665   2HE2  GLN  35          2HE2      GLN  35  -3.828 -11.314   1.362
  666   1HE2  GLN  35          1HE2      GLN  35  -4.751 -12.424   0.472
  667    H    HIS  36           H        HIS  36  -3.736  -6.541   1.646
  668    HA   HIS  36           HA       HIS  36  -5.966  -4.984   0.923
  669   1HB   HIS  36          1HB       HIS  36  -3.681  -4.731   2.856
  670   2HB   HIS  36          2HB       HIS  36  -4.856  -3.422   2.733
  671    HD1  HIS  36           HD1      HIS  36  -4.424  -5.693   5.097
  672    HD2  HIS  36           HD2      HIS  36  -7.552  -5.389   2.358
  673    HE1  HIS  36           HE1      HIS  36  -6.385  -6.932   6.111
  674    H    ALA  37           H        ALA  37  -2.501  -4.063   0.726
  675    HA   ALA  37           HA       ALA  37  -2.704  -1.462  -0.280
  676   1HB   ALA  37          1HB       ALA  37  -0.615  -2.609   0.305
  677   2HB   ALA  37          3HB       ALA  37  -0.818  -3.717  -1.052
  678   3HB   ALA  37          2HB       ALA  37  -0.510  -2.006  -1.349
  679    H    GLN  38           H        GLN  38  -3.078  -4.537  -2.040
  680    HA   GLN  38           HA       GLN  38  -3.228  -3.429  -4.689
  681   1HB   GLN  38          1HB       GLN  38  -3.670  -5.954  -3.274
  682   2HB   GLN  38          2HB       GLN  38  -4.796  -5.737  -4.614
  683   1HG   GLN  38          1HG       GLN  38  -2.398  -4.889  -5.696
  684   2HG   GLN  38          2HG       GLN  38  -1.907  -6.240  -4.671
  685   2HE2  GLN  38          2HE2      GLN  38  -2.250  -8.314  -5.510
  686   1HE2  GLN  38          1HE2      GLN  38  -3.220  -8.661  -6.859
  687    H    ASN  39           H        ASN  39  -5.634  -4.002  -2.149
  688    HA   ASN  39           HA       ASN  39  -7.832  -3.017  -3.879
  689   1HB   ASN  39          1HB       ASN  39  -7.677  -4.035  -1.021
  690   2HB   ASN  39          2HB       ASN  39  -9.177  -3.637  -1.859
  691   2HD2  ASN  39          2HD2      ASN  39  -8.654  -6.299  -0.927
  692   1HD2  ASN  39          1HD2      ASN  39  -8.472  -7.310  -2.278
  693    H    LEU  40           H        LEU  40  -5.474  -1.360  -2.695
  694    HA   LEU  40           HA       LEU  40  -5.179   0.792  -1.811
  695   1HB   LEU  40          1HB       LEU  40  -8.024   0.766  -2.833
  696   2HB   LEU  40          2HB       LEU  40  -7.295   2.230  -2.173
  697    HG   LEU  40           HG       LEU  40  -5.328   1.666  -3.816
  698   1HD1  LEU  40          1HD1      LEU  40  -7.473  -0.213  -4.587
  699   2HD1  LEU  40          2HD1      LEU  40  -6.784   0.705  -5.926
  700   3HD1  LEU  40          3HD1      LEU  40  -5.740  -0.288  -4.908
  701   1HD2  LEU  40          1HD2      LEU  40  -7.169   3.536  -3.868
  702   2HD2  LEU  40          2HD2      LEU  40  -6.234   3.210  -5.328
  703   3HD2  LEU  40          3HD2      LEU  40  -7.867   2.562  -5.162
  704    H    GLU  41           H        GLU  41  -6.263  -1.456  -0.040
  705    HA   GLU  41           HA       GLU  41  -8.072  -0.298   1.888
  706   1HB   GLU  41          1HB       GLU  41  -6.584  -2.716   1.416
  707   2HB   GLU  41          2HB       GLU  41  -6.339  -2.214   3.090
  708   1HG   GLU  41          2HG       GLU  41  -8.313  -3.619   3.008
  709   2HG   GLU  41          1HG       GLU  41  -8.831  -1.959   3.306
  710    H    PHE  42           H        PHE  42  -4.530  -0.691   1.826
  711    HA   PHE  42           HA       PHE  42  -2.841   0.387   3.071
  712   1HB   PHE  42          1HB       PHE  42  -4.929   2.402   2.321
  713   2HB   PHE  42          2HB       PHE  42  -3.593   2.921   3.346
  714    HD1  PHE  42           HD1      PHE  42  -1.317   1.354   2.375
  715    HD2  PHE  42           HD2      PHE  42  -4.512   3.236   0.159
  716    HE1  PHE  42           HE1      PHE  42   0.162   1.518   0.376
  717    HE2  PHE  42           HE2      PHE  42  -3.028   3.397  -1.839
  718    HZ   PHE  42           HZ       PHE  42  -0.691   2.540  -1.724
  719    H    GLU  43           H        GLU  43  -2.642   2.035   5.045
  720    HA   GLU  43           HA       GLU  43  -2.887   2.428   7.337
  721   1HB   GLU  43          1HB       GLU  43  -5.156   3.126   6.749
  722   2HB   GLU  43          2HB       GLU  43  -5.694   1.450   6.698
  723   1HG   GLU  43          1HG       GLU  43  -4.959   1.252   9.116
  724   2HG   GLU  43          2HG       GLU  43  -4.767   3.006   9.114
  725    H    GLU  44           H        GLU  44  -4.791  -0.459   6.596
  726    HA   GLU  44           HA       GLU  44  -3.625  -1.935   8.852
  727   1HB   GLU  44          2HB       GLU  44  -5.208  -3.658   8.128
  728   2HB   GLU  44          1HB       GLU  44  -6.012  -2.090   8.114
  729   1HG   GLU  44          1HG       GLU  44  -5.701  -1.903   5.702
  730   2HG   GLU  44          2HG       GLU  44  -4.765  -3.398   5.678
  731    H    ALA  45           H        ALA  45  -3.275  -1.800   5.326
  732    HA   ALA  45           HA       ALA  45  -1.610  -4.206   5.184
  733   1HB   ALA  45          1HB       ALA  45  -3.173  -2.786   3.471
  734   2HB   ALA  45          2HB       ALA  45  -1.920  -3.906   2.937
  735   3HB   ALA  45          3HB       ALA  45  -1.579  -2.177   3.024
  736    H    ALA  46           H        ALA  46  -1.002  -0.683   4.957
  737    HA   ALA  46           HA       ALA  46   1.860  -1.024   4.598
  738   1HB   ALA  46          1HB       ALA  46   1.855   1.357   4.587
  739   2HB   ALA  46          3HB       ALA  46   0.304   0.892   3.890
  740   3HB   ALA  46          2HB       ALA  46   0.390   1.433   5.567
  741    H    GLN  47           H        GLN  47  -0.243  -0.461   7.413
  742    HA   GLN  47           HA       GLN  47   1.690   0.288   9.332
  743   1HB   GLN  47          1HB       GLN  47  -0.930  -1.138   9.290
  744   2HB   GLN  47          2HB       GLN  47   0.010  -1.241  10.779
  745   1HG   GLN  47          1HG       GLN  47   0.194   1.234  10.817
  746   2HG   GLN  47          2HG       GLN  47  -0.805   1.315   9.365
  747   2HE2  GLN  47          2HE2      GLN  47  -1.653   2.529  11.822
  748   1HE2  GLN  47          1HE2      GLN  47  -3.008   1.684  12.395
  749    H    ILE  48           H        ILE  48   1.124  -2.809   7.799
  750    HA   ILE  48           HA       ILE  48   2.413  -4.529   9.683
  751    HB   ILE  48           HB       ILE  48   2.176  -4.630   6.658
  752   1HG1  ILE  48          1HG1      ILE  48   0.458  -5.798   8.873
  753   2HG1  ILE  48          2HG1      ILE  48   0.016  -4.440   7.837
  754   1HG2  ILE  48          1HG2      ILE  48   3.897  -6.169   7.809
  755   2HG2  ILE  48          2HG2      ILE  48   2.505  -6.974   8.535
  756   3HG2  ILE  48          3HG2      ILE  48   2.690  -6.942   6.781
  757   1HD1  ILE  48          1HD1      ILE  48   0.808  -6.492   6.081
  758   2HD1  ILE  48          2HD1      ILE  48  -0.191  -7.279   7.302
  759   3HD1  ILE  48          3HD1      ILE  48  -0.836  -5.925   6.374
  760    H    ARG  49           H        ARG  49   3.695  -2.292   7.291
  761    HA   ARG  49           HA       ARG  49   6.296  -3.292   6.886
  762   1HB   ARG  49          1HB       ARG  49   6.841  -0.963   6.385
  763   2HB   ARG  49          2HB       ARG  49   5.205  -1.298   5.821
  764   1HG   ARG  49          2HG       ARG  49   4.711   0.614   6.973
  765   2HG   ARG  49          1HG       ARG  49   4.675  -0.480   8.356
  766   1HD   ARG  49          1HD       ARG  49   7.329   0.042   8.291
  767   2HD   ARG  49          2HD       ARG  49   6.708   1.565   7.624
  768    HE   ARG  49           HE       ARG  49   5.084   0.836   9.851
  769   1HH1  ARG  49          1HH1      ARG  49   8.342   0.591  10.096
  770   2HH1  ARG  49          2HH1      ARG  49   8.582   1.942  11.153
  771   1HH2  ARG  49          1HH2      ARG  49   5.350   3.142  10.782
  772   2HH2  ARG  49          2HH2      ARG  49   6.887   3.386  11.543
  773    H    ASP  50           H        ASP  50   4.885  -1.831   9.740
  774    HA   ASP  50           HA       ASP  50   7.421  -1.294  11.085
  775   1HB   ASP  50          1HB       ASP  50   4.884  -0.411  11.336
  776   2HB   ASP  50          2HB       ASP  50   4.861  -1.673  12.569
  777    H    GLN  51           H        GLN  51   4.948  -3.863  11.196
  778    HA   GLN  51           HA       GLN  51   6.101  -5.371  13.347
  779   1HB   GLN  51          1HB       GLN  51   4.429  -6.196  10.949
  780   2HB   GLN  51          2HB       GLN  51   4.650  -7.162  12.409
  781   1HG   GLN  51          1HG       GLN  51   3.589  -5.449  13.768
  782   2HG   GLN  51          2HG       GLN  51   3.483  -4.365  12.379
  783   2HE2  GLN  51          2HE2      GLN  51   2.835  -7.880  12.307
  784   1HE2  GLN  51          1HE2      GLN  51   1.190  -7.732  11.912
  785    H    LEU  52           H        LEU  52   6.627  -5.404   9.832
  786    HA   LEU  52           HA       LEU  52   8.334  -7.735   9.792
  787   1HB   LEU  52          1HB       LEU  52   7.237  -5.745   8.015
  788   2HB   LEU  52          2HB       LEU  52   8.954  -5.956   7.666
  789    HG   LEU  52           HG       LEU  52   7.584  -7.543   6.360
  790   1HD1  LEU  52          1HD1      LEU  52   9.717  -8.223   8.190
  791   2HD1  LEU  52          2HD1      LEU  52   8.659  -9.613   7.949
  792   3HD1  LEU  52          3HD1      LEU  52   9.419  -8.832   6.563
  793   1HD2  LEU  52          1HD2      LEU  52   6.072  -7.676   8.706
  794   2HD2  LEU  52          2HD2      LEU  52   5.861  -8.686   7.277
  795   3HD2  LEU  52          3HD2      LEU  52   6.862  -9.250   8.615
  796    H    HIS  53           H        HIS  53   8.972  -4.225   9.958
  797    HA   HIS  53           HA       HIS  53  11.784  -4.236   9.766
  798   1HB   HIS  53          1HB       HIS  53   9.625  -2.535  10.756
  799   2HB   HIS  53          2HB       HIS  53  11.110  -2.314  11.682
  800    HD1  HIS  53           HD1      HIS  53  11.866  -0.102  10.667
  801    HD2  HIS  53           HD2      HIS  53  11.107  -3.015   7.784
  802    HE1  HIS  53           HE1      HIS  53  12.710   0.829   8.468
  803    H    GLN  54           H        GLN  54   9.716  -4.794  12.617
  804    HA   GLN  54           HA       GLN  54  11.998  -5.149  14.419
  805   1HB   GLN  54          1HB       GLN  54   9.028  -5.735  14.663
  806   2HB   GLN  54          2HB       GLN  54  10.172  -5.726  16.007
  807   1HG   GLN  54          1HG       GLN  54  10.329  -3.442  16.039
  808   2HG   GLN  54          2HG       GLN  54  10.151  -3.302  14.288
  809   2HE2  GLN  54          2HE2      GLN  54   8.641  -1.592  15.952
  810   1HE2  GLN  54          1HE2      GLN  54   7.004  -2.036  15.874
  811    H    LEU  55           H        LEU  55   9.863  -7.207  12.508
  812    HA   LEU  55           HA       LEU  55  10.538  -9.712  13.764
  813   1HB   LEU  55          1HB       LEU  55   9.085  -8.668  11.439
  814   2HB   LEU  55          2HB       LEU  55   9.820 -10.244  11.143
  815    HG   LEU  55           HG       LEU  55   8.582 -10.130  13.773
  816   1HD1  LEU  55          1HD1      LEU  55   7.149  -8.876  11.587
  817   2HD1  LEU  55          2HD1      LEU  55   6.305 -10.326  12.131
  818   3HD1  LEU  55          3HD1      LEU  55   6.674  -9.039  13.278
  819   1HD2  LEU  55          1HD2      LEU  55   8.394 -11.832  11.285
  820   2HD2  LEU  55          2HD2      LEU  55   9.099 -12.249  12.847
  821   3HD2  LEU  55          3HD2      LEU  55   7.348 -12.124  12.675
  822    H    ARG  56           H        ARG  56  11.879  -7.947  10.982
  823    HA   ARG  56           HA       ARG  56  13.644  -9.949  10.020
  824   1HB   ARG  56          1HB       ARG  56  14.743  -8.055   8.949
  825   2HB   ARG  56          2HB       ARG  56  13.003  -7.773   8.959
  826   1HG   ARG  56          2HG       ARG  56  13.408  -5.803   9.972
  827   2HG   ARG  56          1HG       ARG  56  13.921  -6.717  11.392
  828   1HD   ARG  56          1HD       ARG  56  16.233  -6.859  10.364
  829   2HD   ARG  56          2HD       ARG  56  15.676  -5.718   9.125
  830    HE   ARG  56           HE       ARG  56  14.913  -4.554  11.538
  831   1HH1  ARG  56          1HH1      ARG  56  17.551  -4.734   9.469
  832   2HH1  ARG  56          2HH1      ARG  56  18.688  -4.034  10.572
  833   1HH2  ARG  56          1HH2      ARG  56  16.499  -4.061  13.261
  834   2HH2  ARG  56          2HH2      ARG  56  18.092  -3.653  12.719
  835    H    GLU  57           H        GLU  57  13.810  -7.968  12.883
  836    HA   GLU  57           HA       GLU  57  16.646  -8.059  13.349
  837   1HB   GLU  57          2HB       GLU  57  14.333  -7.966  15.317
  838   2HB   GLU  57          1HB       GLU  57  15.978  -7.405  15.614
  839   1HG   GLU  57          1HG       GLU  57  15.625  -5.853  13.586
  840   2HG   GLU  57          2HG       GLU  57  13.909  -6.230  13.755
  841    H    LEU  58           H        LEU  58  13.973 -10.230  14.246
  842    HA   LEU  58           HA       LEU  58  15.300 -11.989  15.998
  843   1HB   LEU  58          1HB       LEU  58  13.039 -12.086  14.061
  844   2HB   LEU  58          2HB       LEU  58  13.643 -13.638  14.643
  845    HG   LEU  58           HG       LEU  58  13.306 -11.590  16.742
  846   1HD1  LEU  58          1HD1      LEU  58  11.338 -11.346  15.033
  847   2HD1  LEU  58          2HD1      LEU  58  10.804 -12.892  15.691
  848   3HD1  LEU  58          3HD1      LEU  58  10.963 -11.491  16.751
  849   1HD2  LEU  58          1HD2      LEU  58  13.782 -14.210  16.773
  850   2HD2  LEU  58          2HD2      LEU  58  12.821 -13.450  18.040
  851   3HD2  LEU  58          3HD2      LEU  58  12.021 -14.295  16.715
  852    H    PHE  59           H        PHE  59  15.707 -11.570  12.556
  853    HA   PHE  59           HA       PHE  59  16.713 -14.053  11.714
  854   1HB   PHE  59          1HB       PHE  59  16.309 -12.117  10.266
  855   2HB   PHE  59          2HB       PHE  59  17.610 -11.228  11.057
  856    HD1  PHE  59           HD1      PHE  59  19.979 -11.873  10.732
  857    HD2  PHE  59           HD2      PHE  59  16.772 -13.907   8.677
  858    HE1  PHE  59           HE1      PHE  59  21.628 -12.889   9.165
  859    HE2  PHE  59           HE2      PHE  59  18.422 -14.923   7.108
  860    HZ   PHE  59           HZ       PHE  59  20.850 -14.414   7.352
  861    H    ILE  60           H        ILE  60  18.345 -11.491  13.559
  862    HA   ILE  60           HA       ILE  60  20.969 -12.734  13.475
  863    HB   ILE  60           HB       ILE  60  19.712 -10.674  15.319
  864   1HG1  ILE  60          1HG1      ILE  60  21.636  -9.810  13.275
  865   2HG1  ILE  60          2HG1      ILE  60  20.171 -10.514  12.593
  866   1HG2  ILE  60          1HG2      ILE  60  21.853 -11.833  16.104
  867   2HG2  ILE  60          2HG2      ILE  60  22.647 -11.092  14.715
  868   3HG2  ILE  60          3HG2      ILE  60  21.933 -10.076  15.967
  869   1HD1  ILE  60          1HD1      ILE  60  18.827  -9.003  14.085
  870   2HD1  ILE  60          2HD1      ILE  60  20.332  -8.224  14.572
  871   3HD1  ILE  60          3HD1      ILE  60  19.797  -8.137  12.894
  872    H    ALA  61           H        ALA  61  18.317 -12.646  15.865
  873    HA   ALA  61           HA       ALA  61  19.679 -14.165  17.895
  874   1HB   ALA  61          1HB       ALA  61  17.531 -12.666  17.903
  875   2HB   ALA  61          3HB       ALA  61  16.700 -14.151  17.441
  876   3HB   ALA  61          2HB       ALA  61  17.584 -14.072  18.966
  877    H    ALA  62           H        ALA  62  18.059 -15.057  14.940
  878    HA   ALA  62           HA       ALA  62  17.946 -17.924  15.770
  879   1HB   ALA  62          1HB       ALA  62  16.569 -18.091  13.680
  880   2HB   ALA  62          3HB       ALA  62  15.923 -16.921  14.832
  881   3HB   ALA  62          2HB       ALA  62  16.822 -16.365  13.419
  882    H    SER  63           H        SER  63  18.851 -16.079  12.823
  883    HA   SER  63           HA       SER  63  20.684 -18.237  11.998
  884   1HB   SER  63          1HB       SER  63  19.062 -16.595  10.651
  885   2HB   SER  63          2HB       SER  63  20.495 -15.571  10.651
  886    HG   SER  63           HG       SER  63  19.993 -17.551   9.046

  No H/Q in entry =         886
  Start of MODEL    8
    1    H    LEU   8           H        LEU   8 -12.630  26.044 -30.335
    2    HA   LEU   8           HA       LEU   8 -11.800  23.431 -29.946
    3   1HB   LEU   8          1HB       LEU   8 -10.283  25.442 -28.312
    4   2HB   LEU   8          2HB       LEU   8 -10.609  23.854 -27.616
    5    HG   LEU   8           HG       LEU   8  -9.709  22.942 -29.891
    6   1HD1  LEU   8          1HD1      LEU   8  -9.334  25.795 -30.171
    7   2HD1  LEU   8          2HD1      LEU   8  -7.777  24.971 -30.234
    8   3HD1  LEU   8          3HD1      LEU   8  -9.058  24.521 -31.359
    9   1HD2  LEU   8          1HD2      LEU   8  -8.254  24.009 -27.521
   10   2HD2  LEU   8          2HD2      LEU   8  -8.322  22.362 -28.151
   11   3HD2  LEU   8          3HD2      LEU   8  -7.269  23.555 -28.912
   12    H    GLU   9           H        GLU   9 -13.779  22.714 -29.252
   13    HA   GLU   9           HA       GLU   9 -14.846  23.654 -26.672
   14   1HB   GLU   9          1HB       GLU   9 -15.524  25.110 -28.834
   15   2HB   GLU   9          2HB       GLU   9 -16.750  23.847 -28.959
   16   1HG   GLU   9          1HG       GLU   9 -17.234  24.279 -26.481
   17   2HG   GLU   9          2HG       GLU   9 -16.262  25.742 -26.655
   18    HA   PRO  10           HA       PRO  10 -15.795  19.275 -28.014
   19   1HB   PRO  10          1HB       PRO  10 -14.556  18.021 -25.920
   20   2HB   PRO  10          2HB       PRO  10 -13.718  18.437 -27.428
   21   1HG   PRO  10          2HG       PRO  10 -13.678  19.824 -24.797
   22   2HG   PRO  10          1HG       PRO  10 -12.368  19.567 -25.959
   23   1HD   PRO  10          1HD       PRO  10 -13.715  21.929 -25.690
   24   2HD   PRO  10          2HD       PRO  10 -12.931  21.404 -27.196
   25    H    ASP  11           H        ASP  11 -15.556  20.374 -24.607
   26    HA   ASP  11           HA       ASP  11 -17.148  20.357 -22.868
   27   1HB   ASP  11          1HB       ASP  11 -18.493  20.892 -25.379
   28   2HB   ASP  11          2HB       ASP  11 -19.563  20.005 -24.293
   29    H    ASN  12           H        ASN  12 -19.014  18.319 -25.095
   30    HA   ASN  12           HA       ASN  12 -18.210  15.843 -23.717
   31   1HB   ASN  12          1HB       ASN  12 -19.792  16.866 -22.150
   32   2HB   ASN  12          2HB       ASN  12 -20.971  17.081 -23.445
   33   2HD2  ASN  12          2HD2      ASN  12 -18.955  14.163 -23.124
   34   1HD2  ASN  12          1HD2      ASN  12 -20.236  13.118 -22.742
   35    H    VAL  13           H        VAL  13 -17.908  16.357 -26.393
   36    HA   VAL  13           HA       VAL  13 -20.270  15.373 -27.862
   37    HB   VAL  13           HB       VAL  13 -17.614  16.617 -28.442
   38   1HG1  VAL  13          1HG1      VAL  13 -19.051  14.749 -30.322
   39   2HG1  VAL  13          2HG1      VAL  13 -18.152  16.130 -30.951
   40   3HG1  VAL  13          3HG1      VAL  13 -17.321  14.888 -30.014
   41   1HG2  VAL  13          1HG2      VAL  13 -20.499  17.076 -28.945
   42   2HG2  VAL  13          2HG2      VAL  13 -19.224  18.229 -28.555
   43   3HG2  VAL  13          3HG2      VAL  13 -19.395  17.628 -30.204
   44    HA   PRO  14           HA       PRO  14 -17.366  11.689 -28.496
   45   1HB   PRO  14          1HB       PRO  14 -14.959  11.608 -27.199
   46   2HB   PRO  14          2HB       PRO  14 -15.180  12.369 -28.785
   47   1HG   PRO  14          2HG       PRO  14 -14.803  13.610 -26.147
   48   2HG   PRO  14          1HG       PRO  14 -14.449  14.242 -27.757
   49   1HD   PRO  14          1HD       PRO  14 -16.667  14.885 -26.132
   50   2HD   PRO  14          2HD       PRO  14 -16.401  15.347 -27.821
   51    H    MET  15           H        MET  15 -16.067  12.488 -25.257
   52    HA   MET  15           HA       MET  15 -18.106  11.129 -23.764
   53   1HB   MET  15          1HB       MET  15 -16.521   9.432 -25.250
   54   2HB   MET  15          2HB       MET  15 -15.697   9.428 -23.689
   55   1HG   MET  15          1HG       MET  15 -17.419   8.367 -22.631
   56   2HG   MET  15          2HG       MET  15 -18.649   9.214 -23.569
   57   1HE   MET  15          1HE       MET  15 -19.156   6.419 -22.837
   58   2HE   MET  15          2HE       MET  15 -20.188   7.204 -24.030
   59   3HE   MET  15          3HE       MET  15 -19.568   5.574 -24.327
   60    H    ASP  16           H        ASP  16 -17.754  12.872 -22.297
   61    HA   ASP  16           HA       ASP  16 -15.424  12.531 -20.507
   62   1HB   ASP  16          1HB       ASP  16 -15.385  14.322 -22.668
   63   2HB   ASP  16          2HB       ASP  16 -15.720  15.328 -21.258
   64    H    MET  17           H        MET  17 -17.866  11.965 -19.622
   65    HA   MET  17           HA       MET  17 -19.637  14.005 -18.805
   66   1HB   MET  17          1HB       MET  17 -20.269  12.343 -17.065
   67   2HB   MET  17          2HB       MET  17 -20.038  11.580 -18.638
   68   1HG   MET  17          1HG       MET  17 -17.580  11.229 -17.833
   69   2HG   MET  17          2HG       MET  17 -18.245  11.500 -16.222
   70   1HE   MET  17          1HE       MET  17 -19.903  10.160 -15.048
   71   2HE   MET  17          2HE       MET  17 -21.122  10.366 -16.304
   72   3HE   MET  17          3HE       MET  17 -20.786   8.758 -15.668
   73    H    SER  18           H        SER  18 -16.623  12.877 -17.289
   74    HA   SER  18           HA       SER  18 -16.896  14.474 -14.887
   75   1HB   SER  18          1HB       SER  18 -14.362  13.447 -16.187
   76   2HB   SER  18          2HB       SER  18 -14.667  13.694 -14.470
   77    HG   SER  18           HG       SER  18 -14.974  11.552 -14.812
   78    HA   PRO  19           HA       PRO  19 -15.283  18.270 -16.426
   79   1HB   PRO  19          1HB       PRO  19 -14.036  19.282 -14.220
   80   2HB   PRO  19          2HB       PRO  19 -15.798  19.154 -14.368
   81   1HG   PRO  19          1HG       PRO  19 -13.943  17.573 -12.750
   82   2HG   PRO  19          2HG       PRO  19 -15.676  17.827 -12.549
   83   1HD   PRO  19          1HD       PRO  19 -14.360  15.546 -13.642
   84   2HD   PRO  19          2HD       PRO  19 -16.107  15.835 -13.508
   85    H    LYS  20           H        LYS  20 -13.353  15.805 -16.467
   86    HA   LYS  20           HA       LYS  20 -11.171  15.427 -17.264
   87   1HB   LYS  20          1HB       LYS  20 -11.996  17.412 -18.675
   88   2HB   LYS  20          2HB       LYS  20 -11.024  18.426 -17.609
   89   1HG   LYS  20          1HG       LYS  20  -9.835  16.001 -18.950
   90   2HG   LYS  20          2HG       LYS  20  -9.914  17.554 -19.784
   91   1HD   LYS  20          1HD       LYS  20  -8.941  18.184 -17.239
   92   2HD   LYS  20          2HD       LYS  20  -8.105  16.692 -17.673
   93   1HE   LYS  20          1HE       LYS  20  -7.816  17.945 -20.013
   94   2HE   LYS  20          2HE       LYS  20  -7.971  19.381 -18.980
   95   1HZ   LYS  20          1HZ       LYS  20  -6.168  17.092 -18.400
   96   2HZ   LYS  20          2HZ       LYS  20  -5.661  18.537 -19.134
   97   3HZ   LYS  20          3HZ       LYS  20  -6.262  18.554 -17.545
   98    H    ALA  21           H        ALA  21 -10.820  18.638 -15.695
   99    HA   ALA  21           HA       ALA  21  -8.308  18.325 -14.559
  100   1HB   ALA  21          1HB       ALA  21  -9.494  20.401 -14.448
  101   2HB   ALA  21          3HB       ALA  21 -10.828  19.667 -13.558
  102   3HB   ALA  21          2HB       ALA  21  -9.265  19.893 -12.774
  103    H    LEU  22           H        LEU  22 -11.399  17.357 -13.036
  104    HA   LEU  22           HA       LEU  22 -10.044  16.120 -10.747
  105   1HB   LEU  22          1HB       LEU  22 -12.872  16.320 -11.802
  106   2HB   LEU  22          2HB       LEU  22 -12.490  15.348 -10.382
  107    HG   LEU  22           HG       LEU  22 -11.383  17.403  -9.394
  108   1HD1  LEU  22          1HD1      LEU  22 -12.469  18.501 -11.958
  109   2HD1  LEU  22          2HD1      LEU  22 -12.480  19.538 -10.531
  110   3HD1  LEU  22          3HD1      LEU  22 -10.959  18.878 -11.132
  111   1HD2  LEU  22          1HD2      LEU  22 -14.337  17.365 -10.056
  112   2HD2  LEU  22          2HD2      LEU  22 -13.553  16.819  -8.573
  113   3HD2  LEU  22          3HD2      LEU  22 -13.633  18.541  -8.946
  114    H    GLN  23           H        GLN  23 -11.741  15.046 -13.668
  115    HA   GLN  23           HA       GLN  23 -11.789  12.264 -13.291
  116   1HB   GLN  23          1HB       GLN  23 -12.704  13.691 -15.183
  117   2HB   GLN  23          2HB       GLN  23 -11.076  13.709 -15.858
  118   1HG   GLN  23          1HG       GLN  23 -11.167  11.142 -15.705
  119   2HG   GLN  23          2HG       GLN  23 -12.902  11.338 -15.456
  120   2HE2  GLN  23          2HE2      GLN  23 -13.119  10.194 -17.613
  121   1HE2  GLN  23          1HE2      GLN  23 -12.941  11.100 -19.037
  122    H    GLN  24           H        GLN  24  -9.152  14.156 -14.826
  123    HA   GLN  24           HA       GLN  24  -7.360  11.930 -15.126
  124   1HB   GLN  24          1HB       GLN  24  -7.197  14.013 -16.396
  125   2HB   GLN  24          2HB       GLN  24  -6.923  14.926 -14.912
  126   1HG   GLN  24          2HG       GLN  24  -4.781  14.527 -16.007
  127   2HG   GLN  24          1HG       GLN  24  -4.853  13.584 -14.518
  128   2HE2  GLN  24          2HE2      GLN  24  -3.436  11.883 -15.262
  129   1HE2  GLN  24          1HE2      GLN  24  -3.880  10.815 -16.506
  130    H    LYS  25           H        LYS  25  -7.363  14.596 -12.719
  131    HA   LYS  25           HA       LYS  25  -5.223  13.737 -11.113
  132   1HB   LYS  25          1HB       LYS  25  -7.563  15.471 -10.953
  133   2HB   LYS  25          2HB       LYS  25  -7.161  14.777  -9.382
  134   1HG   LYS  25          2HG       LYS  25  -5.748  16.599  -9.343
  135   2HG   LYS  25          1HG       LYS  25  -4.687  15.442 -10.145
  136   1HD   LYS  25          1HD       LYS  25  -6.097  16.434 -12.271
  137   2HD   LYS  25          2HD       LYS  25  -5.999  17.854 -11.228
  138   1HE   LYS  25          1HE       LYS  25  -3.482  17.299 -11.005
  139   2HE   LYS  25          2HE       LYS  25  -3.729  16.244 -12.411
  140   1HZ   LYS  25          1HZ       LYS  25  -4.528  19.104 -12.267
  141   2HZ   LYS  25          2HZ       LYS  25  -3.146  18.524 -13.067
  142   3HZ   LYS  25          3HZ       LYS  25  -4.690  18.082 -13.614
  143    H    ILE  26           H        ILE  26  -8.637  12.707 -11.013
  144    HA   ILE  26           HA       ILE  26  -8.291  10.989  -8.691
  145    HB   ILE  26           HB       ILE  26 -10.395  11.192 -10.869
  146   1HG1  ILE  26          1HG1      ILE  26 -10.471  12.200  -8.014
  147   2HG1  ILE  26          2HG1      ILE  26  -9.945  13.202  -9.367
  148   1HG2  ILE  26          1HG2      ILE  26 -10.057   9.347  -8.610
  149   2HG2  ILE  26          2HG2      ILE  26 -11.604  10.192  -8.592
  150   3HG2  ILE  26          3HG2      ILE  26 -11.139   9.236  -9.999
  151   1HD1  ILE  26          1HD1      ILE  26 -12.225  12.358 -10.437
  152   2HD1  ILE  26          2HD1      ILE  26 -12.672  12.136  -8.744
  153   3HD1  ILE  26          3HD1      ILE  26 -12.200  13.732  -9.330
  154    H    HIS  27           H        HIS  27  -8.818  10.278 -12.172
  155    HA   HIS  27           HA       HIS  27  -8.375   7.461 -11.973
  156   1HB   HIS  27          1HB       HIS  27  -9.356   9.030 -13.836
  157   2HB   HIS  27          2HB       HIS  27  -7.684   9.111 -14.393
  158    HD1  HIS  27           HD1      HIS  27  -9.394   7.756 -16.357
  159    HD2  HIS  27           HD2      HIS  27  -7.825   5.660 -13.113
  160    HE1  HIS  27           HE1      HIS  27  -9.435   5.306 -16.999
  161    H    GLU  28           H        GLU  28  -6.154  10.182 -12.294
  162    HA   GLU  28           HA       GLU  28  -3.838   8.552 -12.997
  163   1HB   GLU  28          1HB       GLU  28  -4.084  10.909 -13.640
  164   2HB   GLU  28          2HB       GLU  28  -4.166  11.380 -11.942
  165   1HG   GLU  28          1HG       GLU  28  -1.903  11.762 -12.752
  166   2HG   GLU  28          2HG       GLU  28  -1.880  10.414 -11.615
  167    H    LEU  29           H        LEU  29  -4.909  10.241 -10.022
  168    HA   LEU  29           HA       LEU  29  -2.747   9.364  -8.361
  169   1HB   LEU  29          1HB       LEU  29  -5.557  10.373  -7.975
  170   2HB   LEU  29          2HB       LEU  29  -4.614   9.851  -6.578
  171    HG   LEU  29           HG       LEU  29  -3.588  11.851  -8.605
  172   1HD1  LEU  29          1HD1      LEU  29  -5.245  12.203  -6.123
  173   2HD1  LEU  29          2HD1      LEU  29  -4.060  13.433  -6.562
  174   3HD1  LEU  29          3HD1      LEU  29  -5.373  13.037  -7.671
  175   1HD2  LEU  29          1HD2      LEU  29  -2.286  10.372  -6.661
  176   2HD2  LEU  29          2HD2      LEU  29  -1.706  11.894  -7.338
  177   3HD2  LEU  29          3HD2      LEU  29  -2.622  11.892  -5.831
  178    H    GLU  30           H        GLU  30  -5.988   7.984  -8.959
  179    HA   GLU  30           HA       GLU  30  -5.956   5.881  -7.077
  180   1HB   GLU  30          1HB       GLU  30  -7.725   6.765  -8.795
  181   2HB   GLU  30          2HB       GLU  30  -7.017   5.567  -9.879
  182   1HG   GLU  30          1HG       GLU  30  -7.340   4.173  -7.494
  183   2HG   GLU  30          2HG       GLU  30  -8.790   5.172  -7.589
  184    H    GLY  31           H        GLY  31  -4.776   5.841 -10.463
  185   1HA   GLY  31          2HA       GLY  31  -3.343   4.327 -11.548
  186   2HA   GLY  31          1HA       GLY  31  -3.792   3.138 -10.325
  187    H    LEU  32           H        LEU  32  -2.487   6.230  -9.368
  188    HA   LEU  32           HA       LEU  32   0.300   5.464  -9.273
  189   1HB   LEU  32          1HB       LEU  32  -0.989   7.774  -9.201
  190   2HB   LEU  32          2HB       LEU  32  -0.960   7.500  -7.458
  191    HG   LEU  32           HG       LEU  32   1.583   6.987  -7.857
  192   1HD1  LEU  32          1HD1      LEU  32   0.809   8.610 -10.298
  193   2HD1  LEU  32          2HD1      LEU  32   2.468   8.434  -9.724
  194   3HD1  LEU  32          3HD1      LEU  32   1.570   7.019 -10.277
  195   1HD2  LEU  32          1HD2      LEU  32   0.069   9.358  -7.264
  196   2HD2  LEU  32          2HD2      LEU  32   1.667   8.902  -6.673
  197   3HD2  LEU  32          3HD2      LEU  32   1.510   9.814  -8.174
  198    H    MET  33           H        MET  33  -2.426   5.075  -7.082
  199    HA   MET  33           HA       MET  33  -1.061   4.608  -4.636
  200   1HB   MET  33          1HB       MET  33  -3.667   3.941  -5.905
  201   2HB   MET  33          2HB       MET  33  -3.224   2.982  -4.493
  202   1HG   MET  33          1HG       MET  33  -3.411   4.755  -3.065
  203   2HG   MET  33          2HG       MET  33  -2.772   5.900  -4.244
  204   1HE   MET  33          1HE       MET  33  -5.592   4.459  -2.437
  205   2HE   MET  33          2HE       MET  33  -7.057   4.689  -3.389
  206   3HE   MET  33          3HE       MET  33  -5.892   3.434  -3.838
  207    H    MET  34           H        MET  34  -2.335   2.095  -6.865
  208    HA   MET  34           HA       MET  34  -1.084  -0.135  -5.690
  209   1HB   MET  34          1HB       MET  34  -2.810   0.093  -7.598
  210   2HB   MET  34          2HB       MET  34  -1.418   0.274  -8.667
  211   1HG   MET  34          1HG       MET  34  -2.071  -2.072  -8.617
  212   2HG   MET  34          2HG       MET  34  -0.521  -1.891  -7.795
  213   1HE   MET  34          1HE       MET  34  -4.198  -1.643  -7.499
  214   2HE   MET  34          2HE       MET  34  -4.669  -2.379  -5.970
  215   3HE   MET  34          3HE       MET  34  -4.016  -0.736  -5.999
  216    H    GLN  35           H        GLN  35   0.204   2.132  -8.118
  217    HA   GLN  35           HA       GLN  35   2.612   0.845  -8.801
  218   1HB   GLN  35          1HB       GLN  35   1.780   2.881  -9.855
  219   2HB   GLN  35          2HB       GLN  35   1.945   3.772  -8.343
  220   1HG   GLN  35          2HG       GLN  35   4.005   4.351  -9.065
  221   2HG   GLN  35          1HG       GLN  35   4.476   2.684  -8.738
  222   2HE2  GLN  35          2HE2      GLN  35   2.873   4.596 -11.353
  223   1HE2  GLN  35          1HE2      GLN  35   3.589   3.727 -12.622
  224    H    HIS  36           H        HIS  36   2.601   3.587  -6.520
  225    HA   HIS  36           HA       HIS  36   5.056   3.033  -5.274
  226   1HB   HIS  36          1HB       HIS  36   2.495   4.306  -4.272
  227   2HB   HIS  36          2HB       HIS  36   4.035   4.426  -3.420
  228    HD1  HIS  36           HD1      HIS  36   5.386   4.468  -6.526
  229    HD2  HIS  36           HD2      HIS  36   2.850   7.213  -4.677
  230    HE1  HIS  36           HE1      HIS  36   5.704   6.667  -7.740
  231    H    ALA  37           H        ALA  37   1.790   1.950  -4.250
  232    HA   ALA  37           HA       ALA  37   2.492   0.544  -1.894
  233   1HB   ALA  37          1HB       ALA  37   0.450  -0.160  -4.040
  234   2HB   ALA  37          2HB       ALA  37   0.399  -0.679  -2.356
  235   3HB   ALA  37          3HB       ALA  37   0.199   1.026  -2.759
  236    H    GLN  38           H        GLN  38   2.473  -0.549  -5.305
  237    HA   GLN  38           HA       GLN  38   3.257  -3.255  -4.870
  238   1HB   GLN  38          1HB       GLN  38   3.309  -1.238  -7.067
  239   2HB   GLN  38          2HB       GLN  38   4.331  -2.659  -7.278
  240   1HG   GLN  38          1HG       GLN  38   1.951  -3.726  -6.330
  241   2HG   GLN  38          2HG       GLN  38   1.416  -2.434  -7.404
  242   2HE2  GLN  38          2HE2      GLN  38   2.305  -5.673  -7.400
  243   1HE2  GLN  38          1HE2      GLN  38   2.747  -5.828  -9.031
  244    H    ASN  39           H        ASN  39   5.088  -0.245  -5.000
  245    HA   ASN  39           HA       ASN  39   7.688  -1.654  -4.834
  246   1HB   ASN  39          1HB       ASN  39   6.786   1.241  -4.928
  247   2HB   ASN  39          2HB       ASN  39   8.480   0.768  -4.798
  248   2HD2  ASN  39          2HD2      ASN  39   8.643   1.887  -7.001
  249   1HD2  ASN  39          1HD2      ASN  39   8.249   0.984  -8.383
  250    H    LEU  40           H        LEU  40   5.386  -1.422  -2.664
  251    HA   LEU  40           HA       LEU  40   5.273  -1.317  -0.342
  252   1HB   LEU  40          1HB       LEU  40   8.189  -1.838  -0.930
  253   2HB   LEU  40          2HB       LEU  40   7.588  -1.764   0.727
  254    HG   LEU  40           HG       LEU  40   5.770  -3.438  -0.122
  255   1HD1  LEU  40          1HD1      LEU  40   7.920  -3.610  -2.242
  256   2HD1  LEU  40          2HD1      LEU  40   6.820  -4.947  -1.906
  257   3HD1  LEU  40          3HD1      LEU  40   6.184  -3.403  -2.470
  258   1HD2  LEU  40          1HD2      LEU  40   7.885  -3.783   1.401
  259   2HD2  LEU  40          2HD2      LEU  40   7.058  -5.193   0.740
  260   3HD2  LEU  40          3HD2      LEU  40   8.539  -4.607  -0.014
  261    H    GLU  41           H        GLU  41   5.967   1.209  -2.010
  262    HA   GLU  41           HA       GLU  41   7.566   2.931  -0.332
  263   1HB   GLU  41          1HB       GLU  41   5.303   3.484  -2.288
  264   2HB   GLU  41          2HB       GLU  41   6.423   4.702  -1.680
  265   1HG   GLU  41          1HG       GLU  41   7.899   2.432  -2.681
  266   2HG   GLU  41          2HG       GLU  41   6.785   3.016  -3.919
  267    H    PHE  42           H        PHE  42   4.057   2.533  -0.724
  268    HA   PHE  42           HA       PHE  42   2.263   2.845   0.730
  269   1HB   PHE  42          1HB       PHE  42   4.611   2.145   2.418
  270   2HB   PHE  42          2HB       PHE  42   3.184   2.751   3.256
  271    HD1  PHE  42           HD1      PHE  42   0.942   1.758   1.706
  272    HD2  PHE  42           HD2      PHE  42   4.674  -0.191   2.660
  273    HE1  PHE  42           HE1      PHE  42  -0.156  -0.467   1.459
  274    HE2  PHE  42           HE2      PHE  42   3.574  -2.415   2.415
  275    HZ   PHE  42           HZ       PHE  42   1.157  -2.547   1.821
  276    H    GLU  43           H        GLU  43   4.980   4.721   2.188
  277    HA   GLU  43           HA       GLU  43   3.495   6.753   3.395
  278   1HB   GLU  43          1HB       GLU  43   5.913   6.560   3.561
  279   2HB   GLU  43          2HB       GLU  43   6.095   6.851   1.830
  280   1HG   GLU  43          1HG       GLU  43   4.940   9.100   2.240
  281   2HG   GLU  43          2HG       GLU  43   5.199   8.801   3.960
  282    H    GLU  44           H        GLU  44   4.847   6.944   0.100
  283    HA   GLU  44           HA       GLU  44   3.067   9.157  -0.617
  284   1HB   GLU  44          2HB       GLU  44   4.310   9.055  -2.719
  285   2HB   GLU  44          1HB       GLU  44   5.439   8.892  -1.376
  286   1HG   GLU  44          1HG       GLU  44   5.396   6.427  -1.652
  287   2HG   GLU  44          2HG       GLU  44   4.298   6.610  -3.018
  288    H    ALA  45           H        ALA  45   2.982   5.675  -0.803
  289    HA   ALA  45           HA       ALA  45   1.109   5.556  -3.050
  290   1HB   ALA  45          1HB       ALA  45   1.447   3.306  -1.140
  291   2HB   ALA  45          3HB       ALA  45   2.910   3.877  -1.942
  292   3HB   ALA  45          2HB       ALA  45   1.544   3.309  -2.899
  293    H    ALA  46           H        ALA  46   0.831   4.867   0.457
  294    HA   ALA  46           HA       ALA  46  -2.060   4.538   0.240
  295   1HB   ALA  46          1HB       ALA  46  -0.270   3.457   1.807
  296   2HB   ALA  46          3HB       ALA  46  -0.524   4.896   2.796
  297   3HB   ALA  46          2HB       ALA  46  -1.873   3.811   2.451
  298    H    GLN  47           H        GLN  47   0.054   7.254   0.851
  299    HA   GLN  47           HA       GLN  47  -1.822   8.841   2.370
  300   1HB   GLN  47          2HB       GLN  47  -0.309  10.672   1.804
  301   2HB   GLN  47          1HB       GLN  47   0.643   9.236   2.172
  302   1HG   GLN  47          1HG       GLN  47   1.145   8.844  -0.104
  303   2HG   GLN  47          2HG       GLN  47  -0.150   9.899  -0.665
  304   2HE2  GLN  47          2HE2      GLN  47   1.077  11.484  -1.783
  305   1HE2  GLN  47          1HE2      GLN  47   2.260  12.446  -1.039
  306    H    ILE  48           H        ILE  48  -1.439   8.116  -1.044
  307    HA   ILE  48           HA       ILE  48  -2.882  10.265  -2.214
  308    HB   ILE  48           HB       ILE  48  -2.744   7.305  -2.891
  309   1HG1  ILE  48          2HG1      ILE  48  -0.553   8.432  -2.772
  310   2HG1  ILE  48          1HG1      ILE  48  -0.959   8.037  -4.443
  311   1HG2  ILE  48          1HG2      ILE  48  -3.751   9.702  -4.427
  312   2HG2  ILE  48          2HG2      ILE  48  -3.176   8.254  -5.252
  313   3HG2  ILE  48          3HG2      ILE  48  -4.557   8.156  -4.160
  314   1HD1  ILE  48          1HD1      ILE  48  -2.078  10.583  -3.961
  315   2HD1  ILE  48          2HD1      ILE  48  -0.458  10.629  -3.264
  316   3HD1  ILE  48          3HD1      ILE  48  -0.677  10.208  -4.963
  317    H    ARG  49           H        ARG  49  -3.951   7.459  -0.397
  318    HA   ARG  49           HA       ARG  49  -6.686   7.320  -1.069
  319   1HB   ARG  49          1HB       ARG  49  -5.634   5.690   0.346
  320   2HB   ARG  49          2HB       ARG  49  -5.119   6.920   1.496
  321   1HG   ARG  49          1HG       ARG  49  -7.961   7.104   1.229
  322   2HG   ARG  49          2HG       ARG  49  -7.546   5.411   1.495
  323   1HD   ARG  49          1HD       ARG  49  -7.875   6.645   3.647
  324   2HD   ARG  49          2HD       ARG  49  -6.215   6.039   3.484
  325    HE   ARG  49           HE       ARG  49  -5.549   8.322   2.750
  326   1HH1  ARG  49          1HH1      ARG  49  -8.866   8.440   2.854
  327   2HH1  ARG  49          2HH1      ARG  49  -8.978   9.849   3.857
  328   1HH2  ARG  49          1HH2      ARG  49  -5.594   9.908   4.609
  329   2HH2  ARG  49          2HH2      ARG  49  -7.126  10.679   4.850
  330    H    ASP  50           H        ASP  50  -4.949   9.649   0.937
  331    HA   ASP  50           HA       ASP  50  -7.336  10.885   2.064
  332   1HB   ASP  50          1HB       ASP  50  -4.917  10.827   2.944
  333   2HB   ASP  50          2HB       ASP  50  -4.574  12.080   1.750
  334    H    GLN  51           H        GLN  51  -5.220  11.486  -0.722
  335    HA   GLN  51           HA       GLN  51  -6.471  14.021  -1.438
  336   1HB   GLN  51          2HB       GLN  51  -4.784  12.072  -3.045
  337   2HB   GLN  51          1HB       GLN  51  -5.046  13.776  -3.422
  338   1HG   GLN  51          1HG       GLN  51  -3.858  14.484  -1.466
  339   2HG   GLN  51          2HG       GLN  51  -3.827  12.845  -0.812
  340   2HE2  GLN  51          2HE2      GLN  51  -3.162  13.748  -4.211
  341   1HE2  GLN  51          1HE2      GLN  51  -1.544  13.234  -4.198
  342    H    LEU  52           H        LEU  52  -6.732  10.652  -2.596
  343    HA   LEU  52           HA       LEU  52  -8.558  11.122  -4.738
  344   1HB   LEU  52          1HB       LEU  52  -7.303   8.964  -3.363
  345   2HB   LEU  52          2HB       LEU  52  -9.028   8.604  -3.432
  346    HG   LEU  52           HG       LEU  52  -7.862   7.745  -5.432
  347   1HD1  LEU  52          1HD1      LEU  52 -10.177   9.309  -5.355
  348   2HD1  LEU  52          2HD1      LEU  52  -9.276   9.936  -6.734
  349   3HD1  LEU  52          3HD1      LEU  52  -9.696   8.225  -6.659
  350   1HD2  LEU  52          1HD2      LEU  52  -6.160   9.730  -5.281
  351   2HD2  LEU  52          2HD2      LEU  52  -6.607   9.113  -6.871
  352   3HD2  LEU  52          3HD2      LEU  52  -7.345  10.594  -6.260
  353    H    HIS  53           H        HIS  53  -9.165  10.240  -1.321
  354    HA   HIS  53           HA       HIS  53 -11.986  10.079  -1.413
  355   1HB   HIS  53          1HB       HIS  53  -9.999   9.839   0.445
  356   2HB   HIS  53          2HB       HIS  53 -10.750  11.349   0.961
  357    HD1  HIS  53           HD1      HIS  53 -12.615  10.998   2.563
  358    HD2  HIS  53           HD2      HIS  53 -12.253   7.788  -0.073
  359    HE1  HIS  53           HE1      HIS  53 -14.403   9.328   3.218
  360    H    GLN  54           H        GLN  54  -9.885  12.925  -0.944
  361    HA   GLN  54           HA       GLN  54 -12.050  14.796  -0.518
  362   1HB   GLN  54          1HB       GLN  54  -9.115  14.792  -0.979
  363   2HB   GLN  54          2HB       GLN  54  -9.954  16.291  -1.381
  364   1HG   GLN  54          1HG       GLN  54 -10.640  14.981   1.212
  365   2HG   GLN  54          2HG       GLN  54  -9.082  15.803   1.098
  366   2HE2  GLN  54          2HE2      GLN  54  -9.351  17.852   2.005
  367   1HE2  GLN  54          1HE2      GLN  54 -10.654  18.891   1.684
  368    H    LEU  55           H        LEU  55  -9.984  14.103  -3.367
  369    HA   LEU  55           HA       LEU  55 -11.159  15.906  -5.193
  370   1HB   LEU  55          1HB       LEU  55  -9.936  13.149  -5.489
  371   2HB   LEU  55          2HB       LEU  55 -10.332  14.172  -6.872
  372    HG   LEU  55           HG       LEU  55  -8.781  15.480  -4.709
  373   1HD1  LEU  55          1HD1      LEU  55  -7.941  12.971  -5.312
  374   2HD1  LEU  55          2HD1      LEU  55  -7.140  13.880  -6.593
  375   3HD1  LEU  55          3HD1      LEU  55  -6.839  14.286  -4.904
  376   1HD2  LEU  55          1HD2      LEU  55  -8.625  15.373  -7.738
  377   2HD2  LEU  55          2HD2      LEU  55  -9.330  16.665  -6.767
  378   3HD2  LEU  55          3HD2      LEU  55  -7.590  16.378  -6.724
  379    H    ARG  56           H        ARG  56 -12.441  12.954  -3.858
  380    HA   ARG  56           HA       ARG  56 -14.322  12.267  -5.910
  381   1HB   ARG  56          1HB       ARG  56 -13.654  10.785  -4.077
  382   2HB   ARG  56          2HB       ARG  56 -14.343  11.900  -2.896
  383   1HG   ARG  56          1HG       ARG  56 -16.382  11.392  -4.789
  384   2HG   ARG  56          2HG       ARG  56 -15.667   9.827  -4.399
  385   1HD   ARG  56          1HD       ARG  56 -15.945  10.323  -1.973
  386   2HD   ARG  56          2HD       ARG  56 -16.739  11.852  -2.400
  387    HE   ARG  56           HE       ARG  56 -18.226  10.163  -3.861
  388   1HH1  ARG  56          1HH1      ARG  56 -16.799   8.197  -1.791
  389   2HH1  ARG  56          2HH1      ARG  56 -18.150   7.892  -0.750
  390   1HH2  ARG  56          1HH2      ARG  56 -20.063  10.482  -2.036
  391   2HH2  ARG  56          2HH2      ARG  56 -19.997   9.187  -0.888
  392    H    GLU  57           H        GLU  57 -14.787  14.131  -2.877
  393    HA   GLU  57           HA       GLU  57 -17.502  14.859  -3.339
  394   1HB   GLU  57          1HB       GLU  57 -16.292  15.042  -1.196
  395   2HB   GLU  57          2HB       GLU  57 -15.264  16.301  -1.879
  396   1HG   GLU  57          2HG       GLU  57 -16.856  17.627  -0.854
  397   2HG   GLU  57          1HG       GLU  57 -17.618  17.422  -2.431
  398    H    LEU  58           H        LEU  58 -14.467  16.332  -4.429
  399    HA   LEU  58           HA       LEU  58 -15.614  18.785  -5.425
  400   1HB   LEU  58          1HB       LEU  58 -13.100  17.194  -5.990
  401   2HB   LEU  58          2HB       LEU  58 -13.407  18.771  -6.719
  402    HG   LEU  58           HG       LEU  58 -13.610  18.387  -3.738
  403   1HD1  LEU  58          1HD1      LEU  58 -11.133  18.893  -5.404
  404   2HD1  LEU  58          2HD1      LEU  58 -11.231  19.292  -3.689
  405   3HD1  LEU  58          3HD1      LEU  58 -11.389  17.617  -4.215
  406   1HD2  LEU  58          1HD2      LEU  58 -13.139  20.713  -5.621
  407   2HD2  LEU  58          2HD2      LEU  58 -14.513  20.460  -4.544
  408   3HD2  LEU  58          3HD2      LEU  58 -12.926  20.840  -3.875
  409    H    PHE  59           H        PHE  59 -15.449  15.529  -6.677
  410    HA   PHE  59           HA       PHE  59 -15.656  15.988  -9.470
  411   1HB   PHE  59          1HB       PHE  59 -15.285  13.817  -8.295
  412   2HB   PHE  59          2HB       PHE  59 -16.965  13.846  -7.760
  413    HD1  PHE  59           HD1      PHE  59 -18.827  13.680  -9.416
  414    HD2  PHE  59           HD2      PHE  59 -14.689  13.272 -10.578
  415    HE1  PHE  59           HE1      PHE  59 -19.536  12.676 -11.585
  416    HE2  PHE  59           HE2      PHE  59 -15.397  12.267 -12.747
  417    HZ   PHE  59           HZ       PHE  59 -17.821  11.969 -13.250
  418    H    ILE  60           H        ILE  60 -18.264  15.642  -7.035
  419    HA   ILE  60           HA       ILE  60 -20.396  16.168  -8.930
  420    HB   ILE  60           HB       ILE  60 -20.292  16.367  -5.902
  421   1HG1  ILE  60          2HG1      ILE  60 -21.520  13.969  -6.799
  422   2HG1  ILE  60          1HG1      ILE  60 -20.004  14.123  -7.687
  423   1HG2  ILE  60          1HG2      ILE  60 -22.318  17.143  -7.582
  424   2HG2  ILE  60          2HG2      ILE  60 -22.740  15.458  -7.276
  425   3HG2  ILE  60          3HG2      ILE  60 -22.557  16.581  -5.927
  426   1HD1  ILE  60          1HD1      ILE  60 -19.315  14.875  -5.101
  427   2HD1  ILE  60          2HD1      ILE  60 -20.441  13.540  -4.855
  428   3HD1  ILE  60          3HD1      ILE  60 -18.995  13.305  -5.837
  429    H    ALA  61           H        ALA  61 -18.777  18.144  -6.423
  430    HA   ALA  61           HA       ALA  61 -20.270  20.519  -6.658
  431   1HB   ALA  61          1HB       ALA  61 -17.993  19.606  -5.372
  432   2HB   ALA  61          3HB       ALA  61 -18.638  21.243  -5.250
  433   3HB   ALA  61          2HB       ALA  61 -17.364  20.882  -6.415
  434    H    ALA  62           H        ALA  62 -17.864  19.168  -8.838
  435    HA   ALA  62           HA       ALA  62 -17.721  21.668 -10.428
  436   1HB   ALA  62          1HB       ALA  62 -16.088  19.389  -9.880
  437   2HB   ALA  62          3HB       ALA  62 -15.670  20.816 -10.827
  438   3HB   ALA  62          2HB       ALA  62 -16.399  19.418 -11.615
  439    H    SER  63           H        SER  63 -18.333  18.214 -11.198
  440    HA   SER  63           HA       SER  63 -20.280  19.144 -13.286
  441   1HB   SER  63          1HB       SER  63 -19.554  17.122 -14.518
  442   2HB   SER  63          2HB       SER  63 -18.181  18.162 -14.145
  443    HG   SER  63           HG       SER  63 -18.407  15.655 -13.562
  444    H    LEU   8           H        LEU   8  12.579 -36.736  15.917
  445    HA   LEU   8           HA       LEU   8  11.698 -35.601  13.549
  446   1HB   LEU   8          1HB       LEU   8  10.249 -34.609  15.984
  447   2HB   LEU   8          2HB       LEU   8  10.551 -33.484  14.658
  448    HG   LEU   8           HG       LEU   8   9.600 -35.391  13.148
  449   1HD1  LEU   8          1HD1      LEU   8   9.281 -36.484  15.807
  450   2HD1  LEU   8          2HD1      LEU   8   7.705 -36.292  15.039
  451   3HD1  LEU   8          3HD1      LEU   8   8.960 -37.249  14.250
  452   1HD2  LEU   8          1HD2      LEU   8   8.203 -33.421  14.891
  453   2HD2  LEU   8          2HD2      LEU   8   8.225 -33.548  13.132
  454   3HD2  LEU   8          3HD2      LEU   8   7.187 -34.614  14.080
  455    H    GLU   9           H        GLU   9  13.674 -34.747  13.015
  456    HA   GLU   9           HA       GLU   9  14.796 -32.556  14.632
  457   1HB   GLU   9          1HB       GLU   9  15.474 -35.053  15.385
  458   2HB   GLU   9          2HB       GLU   9  16.670 -34.819  14.110
  459   1HG   GLU   9          1HG       GLU   9  17.200 -32.574  15.227
  460   2HG   GLU   9          2HG       GLU   9  16.259 -33.156  16.600
  461    HA   PRO  10           HA       PRO  10  15.631 -32.583  10.031
  462   1HB   PRO  10          1HB       PRO  10  14.397 -30.207   9.466
  463   2HB   PRO  10          2HB       PRO  10  13.546 -31.764   9.448
  464   1HG   PRO  10          2HG       PRO  10  13.575 -29.646  11.536
  465   2HG   PRO  10          1HG       PRO  10  12.242 -30.674  10.988
  466   1HD   PRO  10          1HD       PRO  10  13.644 -31.110  13.292
  467   2HD   PRO  10          2HD       PRO  10  12.827 -32.394  12.375
  468    H    ASP  11           H        ASP  11  15.465 -29.638  12.072
  469    HA   ASP  11           HA       ASP  11  17.084 -27.982  12.518
  470   1HB   ASP  11          1HB       ASP  11  18.402 -30.550  12.272
  471   2HB   ASP  11          2HB       ASP  11  19.468 -29.262  11.710
  472    H    ASN  12           H        ASN  12  18.871 -29.539   9.878
  473    HA   ASN  12           HA       ASN  12  18.037 -27.498   7.926
  474   1HB   ASN  12          1HB       ASN  12  19.662 -26.306   9.319
  475   2HB   ASN  12          2HB       ASN  12  20.825 -27.617   9.121
  476   2HD2  ASN  12          2HD2      ASN  12  18.753 -26.451   6.471
  477   1HD2  ASN  12          1HD2      ASN  12  20.017 -25.793   5.549
  478    H    VAL  13           H        VAL  13  17.705 -30.207   7.653
  479    HA   VAL  13           HA       VAL  13  20.024 -31.346   6.230
  480    HB   VAL  13           HB       VAL  13  17.387 -32.240   7.317
  481   1HG1  VAL  13          1HG1      VAL  13  18.756 -33.511   4.951
  482   2HG1  VAL  13          2HG1      VAL  13  17.879 -34.505   6.114
  483   3HG1  VAL  13          3HG1      VAL  13  17.033 -33.244   5.216
  484   1HG2  VAL  13          1HG2      VAL  13  20.274 -32.879   7.538
  485   2HG2  VAL  13          2HG2      VAL  13  19.031 -32.827   8.789
  486   3HG2  VAL  13          3HG2      VAL  13  19.162 -34.233   7.732
  487    HA   PRO  14           HA       PRO  14  17.032 -30.865   2.592
  488   1HB   PRO  14          1HB       PRO  14  14.644 -29.583   2.948
  489   2HB   PRO  14          2HB       PRO  14  14.857 -31.323   3.214
  490   1HG   PRO  14          2HG       PRO  14  14.545 -29.152   5.173
  491   2HG   PRO  14          1HG       PRO  14  14.182 -30.874   5.321
  492   1HD   PRO  14          1HD       PRO  14  16.437 -29.521   6.352
  493   2HD   PRO  14          2HD       PRO  14  16.156 -31.270   6.311
  494    H    MET  15           H        MET  15  15.798 -27.986   4.325
  495    HA   MET  15           HA       MET  15  17.829 -26.181   3.404
  496   1HB   MET  15          1HB       MET  15  16.187 -27.099   1.390
  497   2HB   MET  15          2HB       MET  15  15.385 -25.599   1.857
  498   1HG   MET  15          1HG       MET  15  17.100 -24.293   1.103
  499   2HG   MET  15          2HG       MET  15  18.335 -25.444   1.614
  500   1HE   MET  15          1HE       MET  15  18.790 -23.941  -0.863
  501   2HE   MET  15          2HE       MET  15  19.822 -25.316  -0.481
  502   3HE   MET  15          3HE       MET  15  19.163 -25.127  -2.111
  503    H    ASP  16           H        ASP  16  17.536 -25.277   5.504
  504    HA   ASP  16           HA       ASP  16  15.227 -23.446   5.752
  505   1HB   ASP  16          1HB       ASP  16  15.195 -26.032   6.844
  506   2HB   ASP  16          2HB       ASP  16  15.572 -24.976   8.206
  507    H    MET  17           H        MET  17  17.669 -22.455   5.407
  508    HA   MET  17           HA       MET  17  19.495 -22.275   7.550
  509   1HB   MET  17          1HB       MET  17  20.118 -20.135   6.446
  510   2HB   MET  17          2HB       MET  17  19.847 -21.419   5.267
  511   1HG   MET  17          1HG       MET  17  17.393 -20.526   5.227
  512   2HG   MET  17          2HG       MET  17  18.090 -19.068   5.934
  513   1HE   MET  17          1HE       MET  17  19.735 -17.570   4.947
  514   2HE   MET  17          2HE       MET  17  20.938 -18.843   4.753
  515   3HE   MET  17          3HE       MET  17  20.579 -17.767   3.404
  516    H    SER  18           H        SER  18  16.481 -20.475   6.984
  517    HA   SER  18           HA       SER  18  16.822 -18.639   9.198
  518   1HB   SER  18          1HB       SER  18  14.249 -19.567   7.902
  519   2HB   SER  18          2HB       SER  18  14.584 -17.998   8.628
  520    HG   SER  18           HG       SER  18  14.841 -17.705   6.473
  521    HA   PRO  19           HA       PRO  19  15.269 -21.197  12.427
  522   1HB   PRO  19          1HB       PRO  19  14.077 -19.368  14.064
  523   2HB   PRO  19          2HB       PRO  19  15.834 -19.486  13.855
  524   1HG   PRO  19          1HG       PRO  19  13.968 -17.465  12.855
  525   2HG   PRO  19          2HG       PRO  19  15.711 -17.361  13.113
  526   1HD   PRO  19          1HD       PRO  19  14.329 -17.737  10.647
  527   2HD   PRO  19          2HD       PRO  19  16.084 -17.706  10.919
  528    H    LYS  20           H        LYS  20  13.287 -20.508  10.105
  529    HA   LYS  20           HA       LYS  20  11.085 -21.145   9.565
  530   1HB   LYS  20          1HB       LYS  20  11.932 -23.076  11.038
  531   2HB   LYS  20          2HB       LYS  20  10.997 -22.341  12.341
  532   1HG   LYS  20          1HG       LYS  20   9.736 -22.913   9.663
  533   2HG   LYS  20          2HG       LYS  20   9.837 -24.161  10.906
  534   1HD   LYS  20          1HD       LYS  20   8.917 -21.901  12.270
  535   2HD   LYS  20          2HD       LYS  20   8.042 -21.876  10.738
  536   1HE   LYS  20          1HE       LYS  20   7.745 -24.478  11.266
  537   2HE   LYS  20          2HE       LYS  20   7.946 -23.905  12.934
  538   1HZ   LYS  20          1HZ       LYS  20   6.103 -22.675  10.954
  539   2HZ   LYS  20          2HZ       LYS  20   5.616 -23.790  12.141
  540   3HZ   LYS  20          3HZ       LYS  20   6.241 -22.278  12.598
  541    H    ALA  21           H        ALA  21  10.825 -20.568  13.101
  542    HA   ALA  21           HA       ALA  21   8.325 -19.369  13.192
  543   1HB   ALA  21          1HB       ALA  21  10.889 -18.819  14.703
  544   2HB   ALA  21          3HB       ALA  21   9.341 -18.123  15.184
  545   3HB   ALA  21          2HB       ALA  21   9.558 -19.873  15.180
  546    H    LEU  22           H        LEU  22  11.416 -17.656  12.627
  547    HA   LEU  22           HA       LEU  22  10.070 -15.097  12.139
  548   1HB   LEU  22          1HB       LEU  22  12.885 -16.188  11.956
  549   2HB   LEU  22          2HB       LEU  22  12.504 -14.544  11.444
  550    HG   LEU  22           HG       LEU  22  11.456 -14.184  13.725
  551   1HD1  LEU  22          1HD1      LEU  22  12.528 -16.963  14.008
  552   2HD1  LEU  22          2HD1      LEU  22  12.583 -15.898  15.412
  553   3HD1  LEU  22          3HD1      LEU  22  11.038 -16.270  14.645
  554   1HD2  LEU  22          1HD2      LEU  22  14.399 -14.829  13.422
  555   2HD2  LEU  22          2HD2      LEU  22  13.625 -13.246  13.350
  556   3HD2  LEU  22          3HD2      LEU  22  13.737 -14.103  14.887
  557    H    GLN  23           H        GLN  23  11.701 -17.596  10.226
  558    HA   GLN  23           HA       GLN  23  11.694 -16.432   7.671
  559   1HB   GLN  23          1HB       GLN  23  12.611 -18.663   8.469
  560   2HB   GLN  23          2HB       GLN  23  10.974 -19.302   8.330
  561   1HG   GLN  23          1HG       GLN  23  11.013 -18.414   5.916
  562   2HG   GLN  23          2HG       GLN  23  12.755 -18.245   6.132
  563   2HE2  GLN  23          2HE2      GLN  23  12.914 -19.981   4.407
  564   1HE2  GLN  23          1HE2      GLN  23  12.736 -21.605   4.868
  565    H    GLN  24           H        GLN  24   9.076 -18.428   9.103
  566    HA   GLN  24           HA       GLN  24   7.232 -18.058   6.931
  567   1HB   GLN  24          1HB       GLN  24   7.095 -19.875   8.564
  568   2HB   GLN  24          2HB       GLN  24   6.863 -18.715   9.872
  569   1HG   GLN  24          2HG       GLN  24   4.696 -19.632   9.227
  570   2HG   GLN  24          1HG       GLN  24   4.771 -17.935   8.753
  571   2HE2  GLN  24          2HE2      GLN  24   3.306 -18.145   6.944
  572   1HE2  GLN  24          1HE2      GLN  24   3.710 -19.029   5.553
  573    H    LYS  25           H        LYS  25   7.327 -16.525  10.178
  574    HA   LYS  25           HA       LYS  25   5.193 -14.722   9.872
  575   1HB   LYS  25          1HB       LYS  25   7.572 -15.089  11.521
  576   2HB   LYS  25          2HB       LYS  25   7.179 -13.381  11.319
  577   1HG   LYS  25          1HG       LYS  25   5.806 -13.858  13.110
  578   2HG   LYS  25          2HG       LYS  25   4.708 -14.284  11.796
  579   1HD   LYS  25          1HD       LYS  25   6.107 -16.617  12.098
  580   2HD   LYS  25          2HD       LYS  25   6.055 -16.028  13.760
  581   1HE   LYS  25          1HE       LYS  25   3.531 -15.633  13.355
  582   2HE   LYS  25          2HE       LYS  25   3.735 -16.677  11.933
  583   1HZ   LYS  25          1HZ       LYS  25   4.595 -17.369  14.694
  584   2HZ   LYS  25          2HZ       LYS  25   3.191 -17.958  13.941
  585   3HZ   LYS  25          3HZ       LYS  25   4.717 -18.367  13.324
  586    H    ILE  26           H        ILE  26   8.585 -14.356   8.831
  587    HA   ILE  26           HA       ILE  26   8.237 -11.634   7.865
  588    HB   ILE  26           HB       ILE  26  10.313 -13.794   7.378
  589   1HG1  ILE  26          1HG1      ILE  26  10.452 -11.352   9.166
  590   2HG1  ILE  26          2HG1      ILE  26   9.929 -12.933   9.748
  591   1HG2  ILE  26          1HG2      ILE  26   9.968 -11.095   6.273
  592   2HG2  ILE  26          2HG2      ILE  26  11.533 -11.334   7.049
  593   3HG2  ILE  26          3HG2      ILE  26  11.027 -12.400   5.739
  594   1HD1  ILE  26          1HD1      ILE  26  12.174 -13.729   8.574
  595   2HD1  ILE  26          2HD1      ILE  26  12.640 -12.050   8.840
  596   3HD1  ILE  26          3HD1      ILE  26  12.194 -13.069  10.209
  597    H    HIS  27           H        HIS  27   8.696 -14.765   6.167
  598    HA   HIS  27           HA       HIS  27   8.197 -13.756   3.540
  599   1HB   HIS  27          1HB       HIS  27   9.184 -16.003   4.479
  600   2HB   HIS  27          2HB       HIS  27   7.506 -16.545   4.438
  601    HD1  HIS  27           HD1      HIS  27   9.159 -18.047   2.531
  602    HD2  HIS  27           HD2      HIS  27   7.591 -14.323   1.501
  603    HE1  HIS  27           HE1      HIS  27   9.139 -17.953  -0.001
  604    H    GLU  28           H        GLU  28   6.031 -14.831   6.106
  605    HA   GLU  28           HA       GLU  28   3.669 -15.016   4.401
  606   1HB   GLU  28          1HB       GLU  28   3.956 -16.315   6.465
  607   2HB   GLU  28          2HB       GLU  28   4.073 -14.825   7.404
  608   1HG   GLU  28          2HG       GLU  28   1.807 -15.693   7.592
  609   2HG   GLU  28          1HG       GLU  28   1.773 -14.215   6.630
  610    H    LEU  29           H        LEU  29   4.821 -12.665   6.850
  611    HA   LEU  29           HA       LEU  29   2.666 -10.804   6.543
  612   1HB   LEU  29          1HB       LEU  29   5.502 -10.748   7.551
  613   2HB   LEU  29          2HB       LEU  29   4.568  -9.253   7.477
  614    HG   LEU  29           HG       LEU  29   3.556 -11.763   8.831
  615   1HD1  LEU  29          1HD1      LEU  29   5.256  -9.500   9.845
  616   2HD1  LEU  29          2HD1      LEU  29   4.093 -10.271  10.925
  617   3HD1  LEU  29          3HD1      LEU  29   5.380 -11.225  10.190
  618   1HD2  LEU  29          1HD2      LEU  29   2.252  -9.464   8.011
  619   2HD2  LEU  29          2HD2      LEU  29   1.694 -10.547   9.287
  620   3HD2  LEU  29          3HD2      LEU  29   2.633  -9.112   9.697
  621    H    GLU  30           H        GLU  30   5.865 -11.006   4.968
  622    HA   GLU  30           HA       GLU  30   5.816  -8.595   3.500
  623   1HB   GLU  30          1HB       GLU  30   7.579 -10.508   3.806
  624   2HB   GLU  30          2HB       GLU  30   6.830 -11.195   2.364
  625   1HG   GLU  30          1HG       GLU  30   7.157  -8.512   1.709
  626   2HG   GLU  30          2HG       GLU  30   8.627  -8.903   2.604
  627    H    GLY  31           H        GLY  31   4.585 -11.816   2.515
  628   1HA   GLY  31          2HA       GLY  31   3.104 -12.406   0.788
  629   2HA   GLY  31          1HA       GLY  31   3.546 -10.895  -0.009
  630    H    LEU  32           H        LEU  32   2.322 -10.860   3.260
  631    HA   LEU  32           HA       LEU  32  -0.479 -10.527   2.624
  632   1HB   LEU  32          1HB       LEU  32   0.861 -11.134   4.823
  633   2HB   LEU  32          2HB       LEU  32   0.851  -9.386   5.063
  634    HG   LEU  32           HG       LEU  32  -1.708  -9.600   4.521
  635   1HD1  LEU  32          1HD1      LEU  32  -0.934 -12.412   5.350
  636   2HD1  LEU  32          2HD1      LEU  32  -2.588 -11.800   5.390
  637   3HD1  LEU  32          3HD1      LEU  32  -1.731 -11.925   3.853
  638   1HD2  LEU  32          1HD2      LEU  32  -0.134  -9.729   6.924
  639   2HD2  LEU  32          2HD2      LEU  32  -1.733  -9.020   6.697
  640   3HD2  LEU  32          3HD2      LEU  32  -1.577 -10.721   7.133
  641    H    MET  33           H        MET  33   2.270  -8.338   2.818
  642    HA   MET  33           HA       MET  33   0.930  -5.851   3.110
  643   1HB   MET  33          1HB       MET  33   3.504  -6.893   2.041
  644   2HB   MET  33          2HB       MET  33   3.060  -5.259   1.542
  645   1HG   MET  33          1HG       MET  33   3.306  -4.407   3.647
  646   2HG   MET  33          2HG       MET  33   2.672  -5.861   4.417
  647   1HE   MET  33          1HE       MET  33   5.494  -3.736   3.504
  648   2HE   MET  33          2HE       MET  33   6.944  -4.732   3.393
  649   3HE   MET  33          3HE       MET  33   5.736  -4.776   2.101
  650    H    MET  34           H        MET  34   2.118  -7.269   0.029
  651    HA   MET  34           HA       MET  34   0.839  -5.490  -1.737
  652   1HB   MET  34          1HB       MET  34   2.540  -7.396  -2.113
  653   2HB   MET  34          2HB       MET  34   1.138  -8.461  -2.209
  654   1HG   MET  34          1HG       MET  34   1.737  -7.746  -4.459
  655   2HG   MET  34          2HG       MET  34   0.204  -6.999  -4.010
  656   1HE   MET  34          1HE       MET  34   3.889  -6.814  -3.788
  657   2HE   MET  34          2HE       MET  34   4.365  -5.138  -4.060
  658   3HE   MET  34          3HE       MET  34   3.748  -5.642  -2.480
  659    H    GLN  35           H        GLN  35  -0.437  -8.459  -0.236
  660    HA   GLN  35           HA       GLN  35  -2.882  -8.720  -1.604
  661   1HB   GLN  35          1HB       GLN  35  -2.023 -10.324   0.019
  662   2HB   GLN  35          2HB       GLN  35  -2.146  -9.134   1.313
  663   1HG   GLN  35          2HG       GLN  35  -4.204  -9.975   1.711
  664   2HG   GLN  35          1HG       GLN  35  -4.706  -9.177   0.221
  665   2HE2  GLN  35          2HE2      GLN  35  -3.100 -12.245   1.256
  666   1HE2  GLN  35          1HE2      GLN  35  -3.853 -13.205   0.074
  667    H    HIS  36           H        HIS  36  -2.779  -7.329   1.677
  668    HA   HIS  36           HA       HIS  36  -5.227  -5.958   1.568
  669   1HB   HIS  36          1HB       HIS  36  -2.625  -5.385   3.012
  670   2HB   HIS  36          2HB       HIS  36  -4.150  -4.593   3.410
  671    HD1  HIS  36           HD1      HIS  36  -5.544  -7.569   2.588
  672    HD2  HIS  36           HD2      HIS  36  -2.922  -6.611   5.686
  673    HE1  HIS  36           HE1      HIS  36  -5.832  -9.363   4.351
  674    H    ALA  37           H        ALA  37  -1.971  -4.687   0.746
  675    HA   ALA  37           HA       ALA  37  -2.670  -2.021   0.098
  676   1HB   ALA  37          1HB       ALA  37  -0.381  -3.005   0.252
  677   2HB   ALA  37          3HB       ALA  37  -0.676  -3.889  -1.244
  678   3HB   ALA  37          2HB       ALA  37  -0.612  -2.126  -1.259
  679    H    GLN  38           H        GLN  38  -2.718  -4.970  -1.937
  680    HA   GLN  38           HA       GLN  38  -3.555  -3.767  -4.381
  681   1HB   GLN  38          1HB       GLN  38  -3.598  -6.452  -3.082
  682   2HB   GLN  38          2HB       GLN  38  -4.653  -6.235  -4.477
  683   1HG   GLN  38          1HG       GLN  38  -2.282  -5.040  -5.284
  684   2HG   GLN  38          2HG       GLN  38  -1.736  -6.446  -4.370
  685   2HE2  GLN  38          2HE2      GLN  38  -2.694  -5.499  -7.448
  686   1HE2  GLN  38          1HE2      GLN  38  -3.163  -7.013  -8.056
  687    H    ASN  39           H        ASN  39  -5.323  -4.747  -1.493
  688    HA   ASN  39           HA       ASN  39  -7.950  -4.159  -2.727
  689   1HB   ASN  39          1HB       ASN  39  -6.987  -5.092  -0.005
  690   2HB   ASN  39          2HB       ASN  39  -8.689  -4.817  -0.379
  691   2HD2  ASN  39          2HD2      ASN  39  -8.862  -7.249   0.060
  692   1HD2  ASN  39          1HD2      ASN  39  -8.506  -8.314  -1.212
  693    H    LEU  40           H        LEU  40  -5.610  -2.170  -1.935
  694    HA   LEU  40           HA       LEU  40  -5.459   0.023  -1.166
  695   1HB   LEU  40          1HB       LEU  40  -8.392  -0.362  -1.766
  696   2HB   LEU  40          2HB       LEU  40  -7.764   1.197  -1.232
  697    HG   LEU  40           HG       LEU  40  -5.991   0.843  -3.124
  698   1HD1  LEU  40          1HD1      LEU  40  -8.188  -1.108  -3.844
  699   2HD1  LEU  40          2HD1      LEU  40  -7.111  -0.414  -5.057
  700   3HD1  LEU  40          3HD1      LEU  40  -6.452  -1.409  -3.758
  701   1HD2  LEU  40          1HD2      LEU  40  -8.094   2.422  -2.957
  702   2HD2  LEU  40          2HD2      LEU  40  -7.292   2.203  -4.513
  703   3HD2  LEU  40          3HD2      LEU  40  -8.776   1.319  -4.153
  704    H    GLU  41           H        GLU  41  -6.127  -2.297   0.787
  705    HA   GLU  41           HA       GLU  41  -7.664  -1.175   2.956
  706   1HB   GLU  41          1HB       GLU  41  -5.418  -3.225   2.867
  707   2HB   GLU  41          2HB       GLU  41  -6.504  -2.985   4.237
  708   1HG   GLU  41          1HG       GLU  41  -8.043  -3.277   1.812
  709   2HG   GLU  41          2HG       GLU  41  -6.935  -4.639   1.985
  710    H    PHE  42           H        PHE  42  -4.170  -1.461   2.377
  711    HA   PHE  42           HA       PHE  42  -2.350  -0.174   3.051
  712   1HB   PHE  42          1HB       PHE  42  -4.688   1.664   2.925
  713   2HB   PHE  42          2HB       PHE  42  -3.238   2.280   3.715
  714    HD1  PHE  42           HD1      PHE  42  -1.039   1.061   2.260
  715    HD2  PHE  42           HD2      PHE  42  -4.792   2.581   0.762
  716    HE1  PHE  42           HE1      PHE  42   0.011   1.461   0.035
  717    HE2  PHE  42           HE2      PHE  42  -3.740   2.983  -1.461
  718    HZ   PHE  42           HZ       PHE  42  -1.337   2.425  -1.820
  719    H    GLU  43           H        GLU  43  -5.004   0.699   5.335
  720    HA   GLU  43           HA       GLU  43  -3.456   1.256   7.589
  721   1HB   GLU  43          1HB       GLU  43  -5.876   1.490   7.514
  722   2HB   GLU  43          2HB       GLU  43  -6.078  -0.249   7.299
  723   1HG   GLU  43          1HG       GLU  43  -4.868  -0.517   9.540
  724   2HG   GLU  43          2HG       GLU  43  -5.108   1.217   9.757
  725    H    GLU  44           H        GLU  44  -4.854  -1.944   6.856
  726    HA   GLU  44           HA       GLU  44  -3.038  -3.283   8.723
  727   1HB   GLU  44          2HB       GLU  44  -4.314  -5.256   8.050
  728   2HB   GLU  44          1HB       GLU  44  -5.426  -3.913   8.310
  729   1HG   GLU  44          1HG       GLU  44  -5.441  -3.467   5.870
  730   2HG   GLU  44          2HG       GLU  44  -4.358  -4.837   5.625
  731    H    ALA  45           H        ALA  45  -3.030  -2.458   5.336
  732    HA   ALA  45           HA       ALA  45  -1.194  -4.590   4.527
  733   1HB   ALA  45          1HB       ALA  45  -1.550  -2.107   2.934
  734   2HB   ALA  45          2HB       ALA  45  -3.013  -3.027   3.284
  735   3HB   ALA  45          3HB       ALA  45  -1.673  -3.792   2.431
  736    H    ALA  46           H        ALA  46  -0.882  -1.038   4.877
  737    HA   ALA  46           HA       ALA  46   1.998  -1.170   4.430
  738   1HB   ALA  46          1HB       ALA  46   1.825   1.157   4.377
  739   2HB   ALA  46          3HB       ALA  46   0.208   0.652   3.889
  740   3HB   ALA  46          2HB       ALA  46   0.502   1.182   5.547
  741    H    GLN  47           H        GLN  47  -0.046  -1.355   7.256
  742    HA   GLN  47           HA       GLN  47   1.885  -0.373   9.167
  743   1HB   GLN  47          2HB       GLN  47   0.404  -1.433  10.792
  744   2HB   GLN  47          1HB       GLN  47  -0.572  -0.657   9.549
  745   1HG   GLN  47          1HG       GLN  47  -1.116  -2.717   8.527
  746   2HG   GLN  47          2HG       GLN  47   0.193  -3.570   9.342
  747   2HE2  GLN  47          2HE2      GLN  47  -1.016  -5.091  10.566
  748   1HE2  GLN  47          1HE2      GLN  47  -2.168  -4.647  11.731
  749    H    ILE  48           H        ILE  48   1.437  -3.427   7.494
  750    HA   ILE  48           HA       ILE  48   2.909  -5.181   9.176
  751    HB   ILE  48           HB       ILE  48   2.698  -4.971   6.151
  752   1HG1  ILE  48          2HG1      ILE  48   0.534  -5.166   7.319
  753   2HG1  ILE  48          1HG1      ILE  48   0.906  -6.655   6.449
  754   1HG2  ILE  48          1HG2      ILE  48   3.736  -7.141   7.977
  755   2HG2  ILE  48          2HG2      ILE  48   3.115  -7.510   6.368
  756   3HG2  ILE  48          3HG2      ILE  48   4.509  -6.445   6.552
  757   1HD1  ILE  48          1HD1      ILE  48   2.088  -6.938   8.995
  758   2HD1  ILE  48          2HD1      ILE  48   0.480  -6.273   9.281
  759   3HD1  ILE  48          3HD1      ILE  48   0.663  -7.778   8.383
  760    H    ARG  49           H        ARG  49   3.945  -2.640   6.988
  761    HA   ARG  49           HA       ARG  49   6.667  -3.263   6.594
  762   1HB   ARG  49          1HB       ARG  49   5.600  -1.430   5.468
  763   2HB   ARG  49          2HB       ARG  49   5.128  -0.681   6.991
  764   1HG   ARG  49          1HG       ARG  49   7.971  -1.011   7.020
  765   2HG   ARG  49          2HG       ARG  49   7.523  -0.264   5.486
  766   1HD   ARG  49          1HD       ARG  49   7.910   1.437   7.281
  767   2HD   ARG  49          2HD       ARG  49   6.235   1.469   6.694
  768    HE   ARG  49           HE       ARG  49   5.607   0.113   8.685
  769   1HH1  ARG  49          1HH1      ARG  49   8.926   0.150   8.745
  770   2HH1  ARG  49          2HH1      ARG  49   9.084   0.702  10.379
  771   1HH2  ARG  49          1HH2      ARG  49   5.714   1.434  10.737
  772   2HH2  ARG  49          2HH2      ARG  49   7.265   1.429  11.507
  773    H    ASP  50           H        ASP  50   5.010  -2.003   9.445
  774    HA   ASP  50           HA       ASP  50   7.439  -1.299  10.895
  775   1HB   ASP  50          1HB       ASP  50   5.032  -0.421  11.153
  776   2HB   ASP  50          2HB       ASP  50   4.698  -1.923  12.016
  777    H    GLN  51           H        GLN  51   5.295  -4.123  10.717
  778    HA   GLN  51           HA       GLN  51   6.589  -5.551  12.906
  779   1HB   GLN  51          2HB       GLN  51   4.838  -6.513  10.619
  780   2HB   GLN  51          1HB       GLN  51   5.131  -7.369  12.133
  781   1HG   GLN  51          1HG       GLN  51   3.987  -5.691  13.406
  782   2HG   GLN  51          2HG       GLN  51   3.930  -4.593  12.027
  783   2HE2  GLN  51          2HE2      GLN  51   3.236  -8.101  11.925
  784   1HE2  GLN  51          1HE2      GLN  51   1.608  -7.928  11.478
  785    H    LEU  52           H        LEU  52   6.760  -5.689   9.341
  786    HA   LEU  52           HA       LEU  52   8.565  -7.890   9.127
  787   1HB   LEU  52          1HB       LEU  52   7.285  -5.939   7.490
  788   2HB   LEU  52          2HB       LEU  52   9.000  -5.916   7.083
  789    HG   LEU  52           HG       LEU  52   7.786  -7.572   5.712
  790   1HD1  LEU  52          1HD1      LEU  52  10.136  -7.968   7.172
  791   2HD1  LEU  52          2HD1      LEU  52   9.228  -9.463   7.398
  792   3HD1  LEU  52          3HD1      LEU  52   9.610  -8.901   5.771
  793   1HD2  LEU  52          1HD2      LEU  52   6.129  -7.986   7.697
  794   2HD2  LEU  52          2HD2      LEU  52   6.539  -9.334   6.637
  795   3HD2  LEU  52          3HD2      LEU  52   7.317  -9.183   8.212
  796    H    HIS  53           H        HIS  53   9.204  -4.369   9.255
  797    HA   HIS  53           HA       HIS  53  12.019  -4.432   9.003
  798   1HB   HIS  53          1HB       HIS  53  10.055  -2.568   9.359
  799   2HB   HIS  53          2HB       HIS  53  10.844  -2.517  10.935
  800    HD1  HIS  53           HD1      HIS  53  12.724  -0.897  11.017
  801    HD2  HIS  53           HD2      HIS  53  12.256  -2.488   7.192
  802    HE1  HIS  53           HE1      HIS  53  14.487   0.199   9.564
  803    H    GLN  54           H        GLN  54   9.987  -4.789  11.916
  804    HA   GLN  54           HA       GLN  54  12.197  -4.939  13.776
  805   1HB   GLN  54          1HB       GLN  54   9.256  -5.355  13.711
  806   2HB   GLN  54          2HB       GLN  54  10.120  -6.180  15.009
  807   1HG   GLN  54          1HG       GLN  54  10.816  -3.325  14.487
  808   2HG   GLN  54          2HG       GLN  54   9.276  -3.659  15.280
  809   2HE2  GLN  54          2HE2      GLN  54   9.604  -3.383  17.495
  810   1HE2  GLN  54          1HE2      GLN  54  10.923  -4.002  18.365
  811    H    LEU  55           H        LEU  55  10.076  -7.449  12.340
  812    HA   LEU  55           HA       LEU  55  11.261  -9.727  13.511
  813   1HB   LEU  55          1HB       LEU  55   9.976  -9.205  10.817
  814   2HB   LEU  55          2HB       LEU  55  10.373 -10.827  11.385
  815    HG   LEU  55           HG       LEU  55   8.882  -9.122  13.300
  816   1HD1  LEU  55          1HD1      LEU  55   7.981  -8.968  10.746
  817   2HD1  LEU  55          2HD1      LEU  55   7.182 -10.452  11.264
  818   3HD1  LEU  55          3HD1      LEU  55   6.912  -8.951  12.150
  819   1HD2  LEU  55          1HD2      LEU  55   8.679 -11.989  12.327
  820   2HD2  LEU  55          2HD2      LEU  55   9.428 -11.440  13.826
  821   3HD2  LEU  55          3HD2      LEU  55   7.683 -11.301  13.610
  822    H    ARG  56           H        ARG  56  12.500  -7.606  11.039
  823    HA   ARG  56           HA       ARG  56  14.335  -9.387   9.742
  824   1HB   ARG  56          1HB       ARG  56  13.662  -7.198   8.870
  825   2HB   ARG  56          2HB       ARG  56  14.392  -6.396  10.262
  826   1HG   ARG  56          1HG       ARG  56  16.394  -8.077   9.177
  827   2HG   ARG  56          2HG       ARG  56  15.650  -7.247   7.810
  828   1HD   ARG  56          1HD       ARG  56  15.974  -5.069   8.977
  829   2HD   ARG  56          2HD       ARG  56  16.794  -5.925  10.299
  830    HE   ARG  56           HE       ARG  56  18.224  -6.847   8.223
  831   1HH1  ARG  56          1HH1      ARG  56  16.787  -4.290   6.970
  832   2HH1  ARG  56          2HH1      ARG  56  18.144  -3.214   6.947
  833   1HH2  ARG  56          1HH2      ARG  56  20.091  -5.204   9.014
  834   2HH2  ARG  56          2HH2      ARG  56  20.016  -3.732   8.105
  835    H    GLU  57           H        GLU  57  14.886  -7.026  12.390
  836    HA   GLU  57           HA       GLU  57  17.608  -7.700  12.886
  837   1HB   GLU  57          1HB       GLU  57  16.433  -5.692  13.710
  838   2HB   GLU  57          2HB       GLU  57  15.423  -6.702  14.744
  839   1HG   GLU  57          2HG       GLU  57  17.057  -6.116  16.268
  840   2HG   GLU  57          1HG       GLU  57  17.792  -7.573  15.598
  841    H    LEU  58           H        LEU  58  14.590  -9.145  14.057
  842    HA   LEU  58           HA       LEU  58  15.775 -10.816  16.087
  843   1HB   LEU  58          1HB       LEU  58  13.218 -10.879  14.464
  844   2HB   LEU  58          2HB       LEU  58  13.548 -12.034  15.756
  845    HG   LEU  58           HG       LEU  58  13.786  -9.070  16.244
  846   1HD1  LEU  58          1HD1      LEU  58  11.298 -10.793  16.310
  847   2HD1  LEU  58          2HD1      LEU  58  11.429  -9.266  17.183
  848   3HD1  LEU  58          3HD1      LEU  58  11.542  -9.288  15.424
  849   1HD2  LEU  58          1HD2      LEU  58  13.337 -11.540  17.939
  850   2HD2  LEU  58          2HD2      LEU  58  14.722 -10.450  17.971
  851   3HD2  LEU  58          3HD2      LEU  58  13.156  -9.903  18.569
  852    H    PHE  59           H        PHE  59  15.521 -11.074  12.614
  853    HA   PHE  59           HA       PHE  59  15.696 -13.881  12.242
  854   1HB   PHE  59          1HB       PHE  59  15.295 -12.126  10.513
  855   2HB   PHE  59          2HB       PHE  59  16.984 -11.637  10.654
  856    HD1  PHE  59           HD1      PHE  59  18.817 -13.187   9.971
  857    HD2  PHE  59           HD2      PHE  59  14.654 -14.149   9.346
  858    HE1  PHE  59           HE1      PHE  59  19.472 -14.978   8.366
  859    HE2  PHE  59           HE2      PHE  59  15.310 -15.940   7.740
  860    HZ   PHE  59           HZ       PHE  59  17.719 -16.354   7.250
  861    H    ILE  60           H        ILE  60  18.332 -11.471  12.550
  862    HA   ILE  60           HA       ILE  60  20.447 -13.455  12.453
  863    HB   ILE  60           HB       ILE  60  20.391 -10.612  13.520
  864   1HG1  ILE  60          2HG1      ILE  60  21.554 -10.786  10.936
  865   2HG1  ILE  60          1HG1      ILE  60  20.028 -11.670  10.864
  866   1HG2  ILE  60          1HG2      ILE  60  22.408 -12.459  13.729
  867   2HG2  ILE  60          2HG2      ILE  60  22.798 -11.685  12.193
  868   3HG2  ILE  60          3HG2      ILE  60  22.659 -10.715  13.659
  869   1HD1  ILE  60          1HD1      ILE  60  19.395  -9.407  12.348
  870   2HD1  ILE  60          2HD1      ILE  60  20.495  -8.794  11.113
  871   3HD1  ILE  60          3HD1      ILE  60  19.030  -9.655  10.641
  872    H    ALA  61           H        ALA  61  18.909 -11.612  15.109
  873    HA   ALA  61           HA       ALA  61  20.448 -12.535  17.277
  874   1HB   ALA  61          1HB       ALA  61  18.172 -11.023  16.831
  875   2HB   ALA  61          3HB       ALA  61  18.852 -11.386  18.417
  876   3HB   ALA  61          2HB       ALA  61  17.554 -12.386  17.765
  877    H    ALA  62           H        ALA  62  17.981 -14.213  15.414
  878    HA   ALA  62           HA       ALA  62  17.870 -16.456  17.352
  879   1HB   ALA  62          1HB       ALA  62  16.482 -16.934  14.889
  880   2HB   ALA  62          3HB       ALA  62  16.197 -15.261  15.366
  881   3HB   ALA  62          2HB       ALA  62  15.794 -16.574  16.472
  882    H    SER  63           H        SER  63  18.394 -16.201  13.808
  883    HA   SER  63           HA       SER  63  20.331 -18.484  14.047
  884   1HB   SER  63          1HB       SER  63  19.542 -19.073  11.774
  885   2HB   SER  63          2HB       SER  63  18.198 -19.006  12.911
  886    HG   SER  63           HG       SER  63  18.377 -17.726  10.675

  No H/Q in entry =         886
  Start of MODEL    9
    1    H    LEU   8           H        LEU   8 -25.721  19.683  -8.727
    2    HA   LEU   8           HA       LEU   8 -28.001  19.226  -8.171
    3   1HB   LEU   8          1HB       LEU   8 -27.525  19.843 -10.737
    4   2HB   LEU   8          2HB       LEU   8 -28.212  18.238 -10.982
    5    HG   LEU   8           HG       LEU   8 -30.079  19.067  -9.348
    6   1HD1  LEU   8          1HD1      LEU   8 -28.908  21.673 -10.368
    7   2HD1  LEU   8          2HD1      LEU   8 -30.459  21.518  -9.544
    8   3HD1  LEU   8          3HD1      LEU   8 -28.965  21.145  -8.686
    9   1HD2  LEU   8          1HD2      LEU   8 -29.754  20.025 -12.206
   10   2HD2  LEU   8          2HD2      LEU   8 -30.554  18.551 -11.661
   11   3HD2  LEU   8          3HD2      LEU   8 -31.271  20.124 -11.315
   12    H    GLU   9           H        GLU   9 -26.248  16.930  -7.613
   13    HA   GLU   9           HA       GLU   9 -26.430  14.614  -7.170
   14   1HB   GLU   9          1HB       GLU   9 -29.135  15.846  -7.093
   15   2HB   GLU   9          2HB       GLU   9 -29.091  14.084  -7.141
   16   1HG   GLU   9          1HG       GLU   9 -28.135  13.913  -5.065
   17   2HG   GLU   9          2HG       GLU   9 -27.202  15.398  -5.259
   18    HA   PRO  10           HA       PRO  10 -27.510  13.904 -11.716
   19   1HB   PRO  10          1HB       PRO  10 -24.967  13.633 -12.691
   20   2HB   PRO  10          2HB       PRO  10 -25.819  15.190 -12.634
   21   1HG   PRO  10          2HG       PRO  10 -23.733  14.106 -10.811
   22   2HG   PRO  10          1HG       PRO  10 -23.974  15.759 -11.398
   23   1HD   PRO  10          1HD       PRO  10 -24.708  14.912  -8.906
   24   2HD   PRO  10          2HD       PRO  10 -25.494  16.255  -9.765
   25    H    ASP  11           H        ASP  11 -24.741  12.535  -9.907
   26    HA   ASP  11           HA       ASP  11 -24.147  10.300  -9.455
   27   1HB   ASP  11          1HB       ASP  11 -27.077  10.486  -9.576
   28   2HB   ASP  11          2HB       ASP  11 -26.474   8.861  -9.902
   29    H    ASN  12           H        ASN  12 -26.648   9.483 -11.825
   30    HA   ASN  12           HA       ASN  12 -24.638   9.019 -13.945
   31   1HB   ASN  12          1HB       ASN  12 -25.208   6.603 -14.032
   32   2HB   ASN  12          2HB       ASN  12 -24.507   7.043 -12.474
   33   2HD2  ASN  12          2HD2      ASN  12 -27.586   6.264 -14.098
   34   1HD2  ASN  12          1HD2      ASN  12 -28.441   5.923 -12.672
   35    H    VAL  13           H        VAL  13 -27.316  10.470 -13.366
   36    HA   VAL  13           HA       VAL  13 -29.130   9.185 -15.308
   37    HB   VAL  13           HB       VAL  13 -29.207  11.355 -13.252
   38   1HG1  VAL  13          1HG1      VAL  13 -30.907  11.318 -15.735
   39   2HG1  VAL  13          2HG1      VAL  13 -31.601  11.855 -14.206
   40   3HG1  VAL  13          3HG1      VAL  13 -30.210  12.700 -14.888
   41   1HG2  VAL  13          1HG2      VAL  13 -30.952   9.024 -14.064
   42   2HG2  VAL  13          2HG2      VAL  13 -29.949   9.168 -12.620
   43   3HG2  VAL  13          3HG2      VAL  13 -31.394  10.164 -12.792
   44    HA   PRO  14           HA       PRO  14 -28.059  13.122 -17.709
   45   1HB   PRO  14          1HB       PRO  14 -26.146  14.828 -16.752
   46   2HB   PRO  14          2HB       PRO  14 -27.858  14.945 -16.309
   47   1HG   PRO  14          2HG       PRO  14 -25.576  13.984 -14.725
   48   2HG   PRO  14          1HG       PRO  14 -27.125  14.648 -14.197
   49   1HD   PRO  14          1HD       PRO  14 -26.369  11.924 -14.247
   50   2HD   PRO  14          2HD       PRO  14 -27.972  12.593 -13.900
   51    H    MET  15           H        MET  15 -24.823  13.056 -16.210
   52    HA   MET  15           HA       MET  15 -23.698  11.082 -17.972
   53   1HB   MET  15          1HB       MET  15 -24.295  13.586 -19.124
   54   2HB   MET  15          2HB       MET  15 -22.548  13.586 -18.884
   55   1HG   MET  15          1HG       MET  15 -22.221  11.744 -20.277
   56   2HG   MET  15          2HG       MET  15 -23.870  11.159 -20.057
   57   1HE   MET  15          1HE       MET  15 -24.062  10.567 -22.107
   58   2HE   MET  15          2HE       MET  15 -24.943  11.548 -23.275
   59   3HE   MET  15          3HE       MET  15 -23.190  11.352 -23.422
   60    H    ASP  16           H        ASP  16 -21.238  11.158 -17.854
   61    HA   ASP  16           HA       ASP  16 -20.358  12.491 -15.312
   62   1HB   ASP  16          1HB       ASP  16 -19.762   9.808 -16.573
   63   2HB   ASP  16          2HB       ASP  16 -18.768  10.470 -15.275
   64    H    MET  17           H        MET  17 -20.174  13.661 -18.005
   65    HA   MET  17           HA       MET  17 -17.688  13.336 -19.296
   66   1HB   MET  17          2HB       MET  17 -18.115  15.652 -20.068
   67   2HB   MET  17          1HB       MET  17 -19.597  14.695 -20.087
   68   1HG   MET  17          1HG       MET  17 -19.908  15.624 -17.654
   69   2HG   MET  17          2HG       MET  17 -18.779  16.871 -18.182
   70   1HE   MET  17          1HE       MET  17 -19.847  18.692 -18.020
   71   2HE   MET  17          2HE       MET  17 -19.686  19.055 -19.743
   72   3HE   MET  17          3HE       MET  17 -21.224  19.318 -18.924
   73    H    SER  18           H        SER  18 -18.468  14.977 -16.279
   74    HA   SER  18           HA       SER  18 -17.076  15.982 -14.658
   75   1HB   SER  18          1HB       SER  18 -14.931  14.396 -16.096
   76   2HB   SER  18          2HB       SER  18 -14.943  14.878 -14.401
   77    HG   SER  18           HG       SER  18 -16.268  12.822 -15.698
   78    HA   PRO  19           HA       PRO  19 -14.990  19.317 -16.631
   79   1HB   PRO  19          1HB       PRO  19 -13.368  20.223 -14.630
   80   2HB   PRO  19          2HB       PRO  19 -15.132  20.404 -14.609
   81   1HG   PRO  19          1HG       PRO  19 -13.423  18.624 -13.039
   82   2HG   PRO  19          2HG       PRO  19 -15.064  19.186 -12.714
   83   1HD   PRO  19          1HD       PRO  19 -14.251  16.650 -13.744
   84   2HD   PRO  19          2HD       PRO  19 -15.905  17.237 -13.465
   85    H    LYS  20           H        LYS  20 -13.528  16.546 -16.630
   86    HA   LYS  20           HA       LYS  20 -11.538  15.725 -17.585
   87   1HB   LYS  20          1HB       LYS  20 -12.153  17.719 -19.087
   88   2HB   LYS  20          2HB       LYS  20 -10.918  18.617 -18.206
   89   1HG   LYS  20          1HG       LYS  20 -10.145  15.931 -19.229
   90   2HG   LYS  20          2HG       LYS  20 -10.353  17.211 -20.426
   91   1HD   LYS  20          1HD       LYS  20  -8.920  18.583 -18.620
   92   2HD   LYS  20          2HD       LYS  20  -8.332  16.962 -18.249
   93   1HE   LYS  20          1HE       LYS  20  -7.502  16.636 -20.457
   94   2HE   LYS  20          2HE       LYS  20  -8.429  18.009 -21.091
   95   1HZ   LYS  20          1HZ       LYS  20  -6.406  18.293 -18.943
   96   2HZ   LYS  20          2HZ       LYS  20  -6.020  18.474 -20.587
   97   3HZ   LYS  20          3HZ       LYS  20  -7.136  19.524 -19.853
   98    H    ALA  21           H        ALA  21 -10.479  18.926 -16.346
   99    HA   ALA  21           HA       ALA  21  -7.954  18.255 -15.418
  100   1HB   ALA  21          1HB       ALA  21  -8.633  20.507 -15.326
  101   2HB   ALA  21          2HB       ALA  21 -10.108  20.120 -14.441
  102   3HB   ALA  21          3HB       ALA  21  -8.548  20.057 -13.623
  103    H    LEU  22           H        LEU  22 -10.993  17.929 -13.557
  104    HA   LEU  22           HA       LEU  22  -9.634  16.659 -11.289
  105   1HB   LEU  22          1HB       LEU  22 -12.481  17.248 -12.119
  106   2HB   LEU  22          2HB       LEU  22 -12.128  16.320 -10.661
  107    HG   LEU  22           HG       LEU  22 -10.626  18.219  -9.926
  108   1HD1  LEU  22          1HD1      LEU  22 -11.728  19.313 -12.484
  109   2HD1  LEU  22          2HD1      LEU  22 -11.448  20.430 -11.148
  110   3HD1  LEU  22          3HD1      LEU  22 -10.113  19.481 -11.800
  111   1HD2  LEU  22          1HD2      LEU  22 -13.600  18.470 -10.300
  112   2HD2  LEU  22          2HD2      LEU  22 -12.685  18.202  -8.816
  113   3HD2  LEU  22          3HD2      LEU  22 -12.702  19.799  -9.565
  114    H    GLN  23           H        GLN  23 -11.781  15.663 -13.932
  115    HA   GLN  23           HA       GLN  23 -12.189  12.954 -13.303
  116   1HB   GLN  23          1HB       GLN  23 -13.138  14.337 -15.193
  117   2HB   GLN  23          2HB       GLN  23 -11.605  14.123 -16.041
  118   1HG   GLN  23          1HG       GLN  23 -11.982  11.587 -15.651
  119   2HG   GLN  23          2HG       GLN  23 -13.655  12.034 -15.313
  120   2HE2  GLN  23          2HE2      GLN  23 -11.603  11.123 -17.821
  121   1HE2  GLN  23          1HE2      GLN  23 -12.492  11.748 -19.126
  122    H    GLN  24           H        GLN  24  -9.434  14.406 -15.067
  123    HA   GLN  24           HA       GLN  24  -8.050  11.900 -15.481
  124   1HB   GLN  24          1HB       GLN  24  -7.774  14.726 -16.035
  125   2HB   GLN  24          2HB       GLN  24  -6.236  14.072 -15.470
  126   1HG   GLN  24          1HG       GLN  24  -7.604  12.301 -17.365
  127   2HG   GLN  24          2HG       GLN  24  -7.201  13.874 -18.057
  128   2HE2  GLN  24          2HE2      GLN  24  -5.870  10.840 -16.964
  129   1HE2  GLN  24          1HE2      GLN  24  -4.244  11.210 -17.274
  130    H    LYS  25           H        LYS  25  -7.617  14.559 -13.120
  131    HA   LYS  25           HA       LYS  25  -5.419  13.436 -11.699
  132   1HB   LYS  25          1HB       LYS  25  -7.468  15.523 -11.389
  133   2HB   LYS  25          2HB       LYS  25  -6.891  14.875  -9.853
  134   1HG   LYS  25          2HG       LYS  25  -5.484  16.759 -10.524
  135   2HG   LYS  25          1HG       LYS  25  -4.549  15.265 -10.602
  136   1HD   LYS  25          1HD       LYS  25  -5.354  15.195 -13.093
  137   2HD   LYS  25          2HD       LYS  25  -5.657  16.917 -12.858
  138   1HE   LYS  25          1HE       LYS  25  -3.246  17.052 -11.951
  139   2HE   LYS  25          2HE       LYS  25  -3.021  15.444 -12.667
  140   1HZ   LYS  25          1HZ       LYS  25  -3.963  16.354 -14.754
  141   2HZ   LYS  25          2HZ       LYS  25  -3.937  17.904 -14.058
  142   3HZ   LYS  25          3HZ       LYS  25  -2.484  17.068 -14.320
  143    H    ILE  26           H        ILE  26  -8.931  13.233 -11.002
  144    HA   ILE  26           HA       ILE  26  -8.822  11.630  -8.685
  145    HB   ILE  26           HB       ILE  26 -10.789  11.695 -10.996
  146   1HG1  ILE  26          1HG1      ILE  26 -10.993  13.050  -8.300
  147   2HG1  ILE  26          2HG1      ILE  26 -10.226  13.835  -9.681
  148   1HG2  ILE  26          1HG2      ILE  26 -10.680   9.992  -8.685
  149   2HG2  ILE  26          2HG2      ILE  26 -12.043  11.098  -8.515
  150   3HG2  ILE  26          3HG2      ILE  26 -11.919  10.063  -9.937
  151   1HD1  ILE  26          1HD1      ILE  26 -12.742  12.687 -10.498
  152   2HD1  ILE  26          2HD1      ILE  26 -12.991  13.724  -9.093
  153   3HD1  ILE  26          3HD1      ILE  26 -12.231  14.374 -10.546
  154    H    HIS  27           H        HIS  27  -9.298  10.470 -12.051
  155    HA   HIS  27           HA       HIS  27  -8.981   7.687 -11.397
  156   1HB   HIS  27          1HB       HIS  27  -9.893   9.106 -13.493
  157   2HB   HIS  27          2HB       HIS  27  -8.276   8.742 -14.096
  158    HD1  HIS  27           HD1      HIS  27  -7.880   6.420 -14.982
  159    HD2  HIS  27           HD2      HIS  27 -11.405   6.670 -12.769
  160    HE1  HIS  27           HE1      HIS  27  -9.053   4.191 -15.248
  161    H    GLU  28           H        GLU  28  -6.692  10.255 -11.904
  162    HA   GLU  28           HA       GLU  28  -4.445   8.545 -12.655
  163   1HB   GLU  28          1HB       GLU  28  -4.984  11.406 -11.975
  164   2HB   GLU  28          2HB       GLU  28  -3.315  10.843 -11.873
  165   1HG   GLU  28          1HG       GLU  28  -4.831  10.045 -14.302
  166   2HG   GLU  28          2HG       GLU  28  -4.400  11.750 -14.170
  167    H    LEU  29           H        LEU  29  -5.413  10.277  -9.670
  168    HA   LEU  29           HA       LEU  29  -3.277   9.548  -7.993
  169   1HB   LEU  29          1HB       LEU  29  -6.245   9.934  -7.525
  170   2HB   LEU  29          2HB       LEU  29  -5.095   9.745  -6.201
  171    HG   LEU  29           HG       LEU  29  -4.428  11.748  -8.305
  172   1HD1  LEU  29          1HD1      LEU  29  -6.969  11.848  -7.432
  173   2HD1  LEU  29          2HD1      LEU  29  -6.186  12.675  -6.084
  174   3HD1  LEU  29          3HD1      LEU  29  -6.018  13.305  -7.723
  175   1HD2  LEU  29          1HD2      LEU  29  -4.119  11.463  -5.310
  176   2HD2  LEU  29          2HD2      LEU  29  -2.851  11.499  -6.535
  177   3HD2  LEU  29          3HD2      LEU  29  -3.745  12.968  -6.149
  178    H    GLU  30           H        GLU  30  -6.162   7.669  -8.885
  179    HA   GLU  30           HA       GLU  30  -5.758   5.494  -7.054
  180   1HB   GLU  30          1HB       GLU  30  -7.706   6.287  -8.722
  181   2HB   GLU  30          2HB       GLU  30  -6.959   5.069  -9.756
  182   1HG   GLU  30          1HG       GLU  30  -7.299   4.181  -6.979
  183   2HG   GLU  30          2HG       GLU  30  -8.824   4.549  -7.785
  184    H    GLY  31           H        GLY  31  -4.776   5.948 -10.466
  185   1HA   GLY  31          2HA       GLY  31  -3.150   4.833 -11.739
  186   2HA   GLY  31          1HA       GLY  31  -3.523   3.402 -10.777
  187    H    LEU  32           H        LEU  32  -2.385   6.440  -9.398
  188    HA   LEU  32           HA       LEU  32   0.408   5.602  -9.228
  189   1HB   LEU  32          1HB       LEU  32  -0.666   7.963  -9.330
  190   2HB   LEU  32          2HB       LEU  32  -0.966   7.748  -7.605
  191    HG   LEU  32           HG       LEU  32   1.582   7.060  -7.558
  192   1HD1  LEU  32          1HD1      LEU  32   1.343   8.755 -10.061
  193   2HD1  LEU  32          2HD1      LEU  32   2.862   8.421  -9.231
  194   3HD1  LEU  32          3HD1      LEU  32   1.948   7.102  -9.961
  195   1HD2  LEU  32          1HD2      LEU  32   0.264   9.741  -7.581
  196   2HD2  LEU  32          2HD2      LEU  32   1.116   8.922  -6.273
  197   3HD2  LEU  32          3HD2      LEU  32   2.028   9.704  -7.564
  198    H    MET  33           H        MET  33  -2.454   5.231  -7.260
  199    HA   MET  33           HA       MET  33  -1.268   4.840  -4.693
  200   1HB   MET  33          1HB       MET  33  -3.791   4.695  -5.957
  201   2HB   MET  33          2HB       MET  33  -3.545   3.121  -5.199
  202   1HG   MET  33          1HG       MET  33  -3.765   3.976  -3.116
  203   2HG   MET  33          2HG       MET  33  -2.708   5.340  -3.481
  204   1HE   MET  33          1HE       MET  33  -6.010   3.679  -3.817
  205   2HE   MET  33          2HE       MET  33  -6.228   4.591  -2.325
  206   3HE   MET  33          3HE       MET  33  -7.217   4.961  -3.743
  207    H    MET  34           H        MET  34  -2.359   2.320  -7.011
  208    HA   MET  34           HA       MET  34  -1.136   0.131  -5.638
  209   1HB   MET  34          1HB       MET  34  -2.932   0.307  -7.538
  210   2HB   MET  34          2HB       MET  34  -1.539   0.261  -8.620
  211   1HG   MET  34          1HG       MET  34  -1.068  -1.925  -8.142
  212   2HG   MET  34          2HG       MET  34  -1.561  -1.768  -6.457
  213   1HE   MET  34          1HE       MET  34  -3.671  -1.891  -5.523
  214   2HE   MET  34          2HE       MET  34  -4.544  -0.680  -6.473
  215   3HE   MET  34          3HE       MET  34  -5.210  -2.299  -6.276
  216    H    GLN  35           H        GLN  35   0.099   2.389  -8.063
  217    HA   GLN  35           HA       GLN  35   2.405   1.060  -8.964
  218   1HB   GLN  35          1HB       GLN  35   1.610   3.196  -9.826
  219   2HB   GLN  35          2HB       GLN  35   1.908   3.974  -8.273
  220   1HG   GLN  35          2HG       GLN  35   3.965   4.488  -9.042
  221   2HG   GLN  35          1HG       GLN  35   4.348   2.771  -8.927
  222   2HE2  GLN  35          2HE2      GLN  35   2.952   5.189 -11.193
  223   1HE2  GLN  35          1HE2      GLN  35   3.423   4.365 -12.600
  224    H    HIS  36           H        HIS  36   2.720   3.656  -6.542
  225    HA   HIS  36           HA       HIS  36   5.195   2.857  -5.487
  226   1HB   HIS  36          1HB       HIS  36   2.801   4.322  -4.374
  227   2HB   HIS  36          2HB       HIS  36   4.287   4.150  -3.438
  228    HD1  HIS  36           HD1      HIS  36   6.334   4.457  -5.756
  229    HD2  HIS  36           HD2      HIS  36   3.068   6.983  -5.180
  230    HE1  HIS  36           HE1      HIS  36   6.896   6.632  -6.924
  231    H    ALA  37           H        ALA  37   1.946   2.069  -4.170
  232    HA   ALA  37           HA       ALA  37   2.641   0.489  -1.974
  233   1HB   ALA  37          1HB       ALA  37   0.426   0.620  -3.962
  234   2HB   ALA  37          2HB       ALA  37   0.485  -0.822  -2.949
  235   3HB   ALA  37          3HB       ALA  37   0.368   0.773  -2.206
  236    H    GLN  38           H        GLN  38   2.403  -0.536  -5.398
  237    HA   GLN  38           HA       GLN  38   2.985  -3.298  -5.035
  238   1HB   GLN  38          1HB       GLN  38   3.090  -1.250  -7.188
  239   2HB   GLN  38          2HB       GLN  38   4.057  -2.699  -7.464
  240   1HG   GLN  38          1HG       GLN  38   1.983  -4.047  -6.842
  241   2HG   GLN  38          2HG       GLN  38   1.082  -2.534  -6.943
  242   2HE2  GLN  38          2HE2      GLN  38  -0.066  -3.656  -8.815
  243   1HE2  GLN  38          1HE2      GLN  38   0.665  -3.617 -10.345
  244    H    ASN  39           H        ASN  39   5.067  -0.450  -5.214
  245    HA   ASN  39           HA       ASN  39   7.529  -2.098  -5.110
  246   1HB   ASN  39          1HB       ASN  39   6.704   0.652  -5.761
  247   2HB   ASN  39          2HB       ASN  39   8.215   0.569  -4.854
  248   2HD2  ASN  39          2HD2      ASN  39   7.512   1.038  -7.876
  249   1HD2  ASN  39          1HD2      ASN  39   8.578  -0.010  -8.680
  250    H    LEU  40           H        LEU  40   5.361  -1.648  -2.866
  251    HA   LEU  40           HA       LEU  40   5.365  -1.462  -0.531
  252   1HB   LEU  40          1HB       LEU  40   8.151  -2.282  -1.313
  253   2HB   LEU  40          2HB       LEU  40   7.780  -1.975   0.384
  254    HG   LEU  40           HG       LEU  40   5.706  -3.523  -0.086
  255   1HD1  LEU  40          1HD1      LEU  40   7.404  -3.823  -2.486
  256   2HD1  LEU  40          2HD1      LEU  40   6.891  -5.341  -1.748
  257   3HD1  LEU  40          3HD1      LEU  40   5.687  -4.164  -2.272
  258   1HD2  LEU  40          1HD2      LEU  40   7.711  -3.963   1.408
  259   2HD2  LEU  40          2HD2      LEU  40   6.978  -5.408   0.711
  260   3HD2  LEU  40          3HD2      LEU  40   8.470  -4.760   0.031
  261    H    GLU  41           H        GLU  41   6.001   0.976  -2.255
  262    HA   GLU  41           HA       GLU  41   7.887   2.618  -0.792
  263   1HB   GLU  41          1HB       GLU  41   5.766   2.925  -2.877
  264   2HB   GLU  41          2HB       GLU  41   6.291   4.386  -2.040
  265   1HG   GLU  41          1HG       GLU  41   8.249   2.433  -3.264
  266   2HG   GLU  41          2HG       GLU  41   7.583   3.796  -4.165
  267    H    PHE  42           H        PHE  42   4.341   2.325  -0.786
  268    HA   PHE  42           HA       PHE  42   2.731   3.057   0.771
  269   1HB   PHE  42          1HB       PHE  42   5.125   2.061   2.281
  270   2HB   PHE  42          2HB       PHE  42   3.760   2.721   3.181
  271    HD1  PHE  42           HD1      PHE  42   1.421   1.921   1.639
  272    HD2  PHE  42           HD2      PHE  42   5.041  -0.286   2.463
  273    HE1  PHE  42           HE1      PHE  42   0.183  -0.221   1.343
  274    HE2  PHE  42           HE2      PHE  42   3.801  -2.427   2.166
  275    HZ   PHE  42           HZ       PHE  42   1.371  -2.392   1.610
  276    H    GLU  43           H        GLU  43   2.591   4.503   2.890
  277    HA   GLU  43           HA       GLU  43   2.705   6.625   3.862
  278   1HB   GLU  43          1HB       GLU  43   5.089   6.134   4.128
  279   2HB   GLU  43          2HB       GLU  43   5.402   6.588   2.456
  280   1HG   GLU  43          1HG       GLU  43   4.434   8.870   3.018
  281   2HG   GLU  43          2HG       GLU  43   4.508   8.382   4.713
  282    H    GLU  44           H        GLU  44   4.289   6.886   0.714
  283    HA   GLU  44           HA       GLU  44   2.726   9.272   0.007
  284   1HB   GLU  44          2HB       GLU  44   4.153   9.224  -1.984
  285   2HB   GLU  44          1HB       GLU  44   5.140   8.927  -0.555
  286   1HG   GLU  44          1HG       GLU  44   5.132   6.532  -0.982
  287   2HG   GLU  44          2HG       GLU  44   4.006   6.741  -2.324
  288    H    ALA  45           H        ALA  45   2.766   5.818  -0.732
  289    HA   ALA  45           HA       ALA  45   0.857   6.023  -2.942
  290   1HB   ALA  45          1HB       ALA  45   1.389   3.493  -1.449
  291   2HB   ALA  45          3HB       ALA  45   2.758   4.273  -2.241
  292   3HB   ALA  45          2HB       ALA  45   1.355   3.781  -3.188
  293    H    ALA  46           H        ALA  46   0.709   4.842   0.436
  294    HA   ALA  46           HA       ALA  46  -2.120   4.219   0.294
  295   1HB   ALA  46          1HB       ALA  46  -0.337   3.211   1.785
  296   2HB   ALA  46          3HB       ALA  46  -0.382   4.705   2.725
  297   3HB   ALA  46          2HB       ALA  46  -1.816   3.684   2.621
  298    H    GLN  47           H        GLN  47  -0.337   7.145   0.901
  299    HA   GLN  47           HA       GLN  47  -2.369   8.491   2.479
  300   1HB   GLN  47          1HB       GLN  47   0.155   9.128   1.033
  301   2HB   GLN  47          2HB       GLN  47  -0.930  10.479   1.360
  302   1HG   GLN  47          1HG       GLN  47  -0.164   8.509   3.516
  303   2HG   GLN  47          2HG       GLN  47   0.819   9.932   3.169
  304   2HE2  GLN  47          2HE2      GLN  47  -0.616   9.542   5.674
  305   1HE2  GLN  47          1HE2      GLN  47  -1.791  10.763   5.779
  306    H    ILE  48           H        ILE  48  -1.981   7.813  -0.908
  307    HA   ILE  48           HA       ILE  48  -3.522  10.013  -1.968
  308    HB   ILE  48           HB       ILE  48  -2.979   7.217  -3.018
  309   1HG1  ILE  48          2HG1      ILE  48  -0.919   8.432  -2.440
  310   2HG1  ILE  48          1HG1      ILE  48  -1.087   8.313  -4.191
  311   1HG2  ILE  48          1HG2      ILE  48  -4.770   8.957  -4.047
  312   2HG2  ILE  48          2HG2      ILE  48  -3.304   9.565  -4.815
  313   3HG2  ILE  48          3HG2      ILE  48  -3.793   7.888  -5.055
  314   1HD1  ILE  48          1HD1      ILE  48  -2.455  10.667  -3.458
  315   2HD1  ILE  48          2HD1      ILE  48  -0.950  10.683  -2.538
  316   3HD1  ILE  48          3HD1      ILE  48  -0.908  10.554  -4.297
  317    H    ARG  49           H        ARG  49  -4.384   6.852  -0.634
  318    HA   ARG  49           HA       ARG  49  -6.979   6.502  -1.662
  319   1HB   ARG  49          1HB       ARG  49  -7.333   5.178   0.368
  320   2HB   ARG  49          2HB       ARG  49  -5.679   4.948  -0.196
  321   1HG   ARG  49          2HG       ARG  49  -5.188   5.406   1.994
  322   2HG   ARG  49          1HG       ARG  49  -5.302   7.072   1.429
  323   1HD   ARG  49          1HD       ARG  49  -7.870   6.778   1.980
  324   2HD   ARG  49          2HD       ARG  49  -7.276   5.488   3.046
  325    HE   ARG  49           HE       ARG  49  -5.711   7.932   3.284
  326   1HH1  ARG  49          1HH1      ARG  49  -8.962   7.272   3.828
  327   2HH1  ARG  49          2HH1      ARG  49  -8.939   7.662   5.514
  328   1HH2  ARG  49          1HH2      ARG  49  -5.492   8.005   5.661
  329   2HH2  ARG  49          2HH2      ARG  49  -6.975   8.077   6.553
  330    H    ASP  50           H        ASP  50  -5.820   8.806   0.722
  331    HA   ASP  50           HA       ASP  50  -8.480   9.559   1.681
  332   1HB   ASP  50          1HB       ASP  50  -5.897   9.785   2.565
  333   2HB   ASP  50          2HB       ASP  50  -6.191  11.416   1.962
  334    H    GLN  51           H        GLN  51  -6.145  10.776  -0.703
  335    HA   GLN  51           HA       GLN  51  -7.530  13.233  -1.307
  336   1HB   GLN  51          2HB       GLN  51  -5.656  11.497  -2.951
  337   2HB   GLN  51          1HB       GLN  51  -6.027  13.191  -3.275
  338   1HG   GLN  51          1HG       GLN  51  -5.085  13.838  -1.104
  339   2HG   GLN  51          2HG       GLN  51  -4.758  12.146  -0.725
  340   2HE2  GLN  51          2HE2      GLN  51  -4.272  13.826  -3.863
  341   1HE2  GLN  51          1HE2      GLN  51  -2.597  13.555  -3.922
  342    H    LEU  52           H        LEU  52  -7.764   9.918  -2.543
  343    HA   LEU  52           HA       LEU  52  -9.280  10.321  -4.885
  344   1HB   LEU  52          1HB       LEU  52  -8.652   8.217  -2.981
  345   2HB   LEU  52          2HB       LEU  52 -10.297   8.039  -3.589
  346    HG   LEU  52           HG       LEU  52  -7.795   8.322  -5.281
  347   1HD1  LEU  52          1HD1      LEU  52  -8.791   6.083  -3.998
  348   2HD1  LEU  52          2HD1      LEU  52  -9.516   5.967  -5.602
  349   3HD1  LEU  52          3HD1      LEU  52  -7.763   6.062  -5.431
  350   1HD2  LEU  52          1HD2      LEU  52 -10.537   8.906  -5.859
  351   2HD2  LEU  52          2HD2      LEU  52  -9.165   8.923  -6.967
  352   3HD2  LEU  52          3HD2      LEU  52 -10.094   7.442  -6.737
  353    H    HIS  53           H        HIS  53 -10.510   9.774  -1.559
  354    HA   HIS  53           HA       HIS  53 -13.274  10.254  -2.260
  355   1HB   HIS  53          1HB       HIS  53 -11.655  10.157   0.292
  356   2HB   HIS  53          2HB       HIS  53 -13.393  10.454   0.309
  357    HD1  HIS  53           HD1      HIS  53 -10.867   7.777  -0.147
  358    HD2  HIS  53           HD2      HIS  53 -14.974   8.232  -0.700
  359    HE1  HIS  53           HE1      HIS  53 -11.813   5.446  -0.441
  360    H    GLN  54           H        GLN  54 -10.675  12.283  -0.919
  361    HA   GLN  54           HA       GLN  54 -12.225  14.594  -0.299
  362   1HB   GLN  54          1HB       GLN  54  -9.660  13.806  -0.011
  363   2HB   GLN  54          2HB       GLN  54  -9.469  14.879  -1.397
  364   1HG   GLN  54          1HG       GLN  54 -10.912  16.543   0.011
  365   2HG   GLN  54          2HG       GLN  54 -10.432  15.534   1.376
  366   2HE2  GLN  54          2HE2      GLN  54  -8.386  15.937   2.263
  367   1HE2  GLN  54          1HE2      GLN  54  -7.193  16.898   1.531
  368    H    LEU  55           H        LEU  55 -10.540  13.654  -3.309
  369    HA   LEU  55           HA       LEU  55 -11.269  16.043  -4.770
  370   1HB   LEU  55          1HB       LEU  55 -10.112  13.336  -5.308
  371   2HB   LEU  55          2HB       LEU  55 -10.704  14.265  -6.685
  372    HG   LEU  55           HG       LEU  55  -9.323  16.206  -5.437
  373   1HD1  LEU  55          1HD1      LEU  55  -8.626  14.675  -3.609
  374   2HD1  LEU  55          2HD1      LEU  55  -7.827  13.645  -4.797
  375   3HD1  LEU  55          3HD1      LEU  55  -7.242  15.285  -4.517
  376   1HD2  LEU  55          1HD2      LEU  55  -8.221  14.058  -7.274
  377   2HD2  LEU  55          2HD2      LEU  55  -8.984  15.572  -7.759
  378   3HD2  LEU  55          3HD2      LEU  55  -7.412  15.593  -6.958
  379    H    ARG  56           H        ARG  56 -12.877  13.016  -4.079
  380    HA   ARG  56           HA       ARG  56 -14.730  12.881  -6.231
  381   1HB   ARG  56          1HB       ARG  56 -14.273  11.153  -4.485
  382   2HB   ARG  56          2HB       ARG  56 -15.101  12.166  -3.303
  383   1HG   ARG  56          1HG       ARG  56 -17.025  12.111  -5.155
  384   2HG   ARG  56          2HG       ARG  56 -16.234  10.590  -5.572
  385   1HD   ARG  56          1HD       ARG  56 -16.577   9.696  -3.371
  386   2HD   ARG  56          2HD       ARG  56 -17.063  11.281  -2.736
  387    HE   ARG  56           HE       ARG  56 -18.647   9.836  -4.830
  388   1HH1  ARG  56          1HH1      ARG  56 -18.944  12.803  -3.788
  389   2HH1  ARG  56          2HH1      ARG  56 -20.364  12.612  -2.813
  390   1HH2  ARG  56          1HH2      ARG  56 -20.220   9.147  -2.811
  391   2HH2  ARG  56          2HH2      ARG  56 -21.086  10.543  -2.260
  392    H    GLU  57           H        GLU  57 -15.181  14.354  -2.986
  393    HA   GLU  57           HA       GLU  57 -17.743  15.500  -3.523
  394   1HB   GLU  57          1HB       GLU  57 -17.149  16.888  -1.524
  395   2HB   GLU  57          2HB       GLU  57 -16.806  15.175  -1.286
  396   1HG   GLU  57          1HG       GLU  57 -14.486  15.475  -1.541
  397   2HG   GLU  57          2HG       GLU  57 -14.684  17.030  -2.347
  398    H    LEU  58           H        LEU  58 -14.513  16.502  -4.395
  399    HA   LEU  58           HA       LEU  58 -15.075  19.305  -4.847
  400   1HB   LEU  58          1HB       LEU  58 -12.875  17.712  -4.694
  401   2HB   LEU  58          2HB       LEU  58 -13.003  17.898  -6.443
  402    HG   LEU  58           HG       LEU  58 -13.442  20.424  -5.061
  403   1HD1  LEU  58          1HD1      LEU  58 -10.914  18.859  -4.528
  404   2HD1  LEU  58          2HD1      LEU  58 -10.931  20.623  -4.507
  405   3HD1  LEU  58          3HD1      LEU  58 -11.933  19.718  -3.372
  406   1HD2  LEU  58          1HD2      LEU  58 -12.759  19.731  -7.532
  407   2HD2  LEU  58          2HD2      LEU  58 -12.178  21.242  -6.831
  408   3HD2  LEU  58          3HD2      LEU  58 -11.126  19.827  -6.869
  409    H    PHE  59           H        PHE  59 -15.669  16.388  -6.665
  410    HA   PHE  59           HA       PHE  59 -15.736  17.291  -9.328
  411   1HB   PHE  59          1HB       PHE  59 -16.060  14.972  -8.607
  412   2HB   PHE  59          2HB       PHE  59 -17.579  15.404  -7.822
  413    HD1  PHE  59           HD1      PHE  59 -19.574  16.022  -9.155
  414    HD2  PHE  59           HD2      PHE  59 -15.892  14.769 -11.030
  415    HE1  PHE  59           HE1      PHE  59 -20.787  15.677 -11.306
  416    HE2  PHE  59           HE2      PHE  59 -17.105  14.425 -13.182
  417    HZ   PHE  59           HZ       PHE  59 -19.552  14.879 -13.319
  418    H    ILE  60           H        ILE  60 -18.350  17.456  -6.881
  419    HA   ILE  60           HA       ILE  60 -20.256  18.779  -8.578
  420    HB   ILE  60           HB       ILE  60 -19.899  18.770  -5.562
  421   1HG1  ILE  60          1HG1      ILE  60 -21.868  17.018  -6.945
  422   2HG1  ILE  60          2HG1      ILE  60 -20.170  16.576  -7.123
  423   1HG2  ILE  60          1HG2      ILE  60 -22.318  19.313  -7.312
  424   2HG2  ILE  60          2HG2      ILE  60 -22.360  19.150  -5.556
  425   3HG2  ILE  60          3HG2      ILE  60 -21.480  20.488  -6.297
  426   1HD1  ILE  60          1HD1      ILE  60 -20.020  16.878  -4.561
  427   2HD1  ILE  60          2HD1      ILE  60 -21.783  16.825  -4.585
  428   3HD1  ILE  60          3HD1      ILE  60 -20.851  15.443  -5.162
  429    H    ALA  61           H        ALA  61 -18.029  20.053  -6.073
  430    HA   ALA  61           HA       ALA  61 -18.682  22.792  -6.272
  431   1HB   ALA  61          1HB       ALA  61 -16.187  21.220  -5.632
  432   2HB   ALA  61          2HB       ALA  61 -17.259  22.079  -4.526
  433   3HB   ALA  61          3HB       ALA  61 -16.174  22.984  -5.582
  434    H    ALA  62           H        ALA  62 -16.886  20.749  -8.475
  435    HA   ALA  62           HA       ALA  62 -15.801  23.062  -9.977
  436   1HB   ALA  62          1HB       ALA  62 -15.358  20.167  -9.706
  437   2HB   ALA  62          3HB       ALA  62 -15.243  20.739 -11.371
  438   3HB   ALA  62          2HB       ALA  62 -14.211  21.441 -10.125
  439    H    SER  63           H        SER  63 -17.436  20.087 -11.104
  440    HA   SER  63           HA       SER  63 -19.544  21.637 -12.456
  441   1HB   SER  63          1HB       SER  63 -17.133  20.467 -13.806
  442   2HB   SER  63          2HB       SER  63 -18.666  20.486 -14.673
  443    HG   SER  63           HG       SER  63 -17.006  22.570 -13.896
  444    H    LEU   8           H        LEU   8  25.788 -14.428  15.807
  445    HA   LEU   8           HA       LEU   8  28.071 -13.797  15.479
  446   1HB   LEU   8          1HB       LEU   8  27.555 -16.425  15.343
  447   2HB   LEU   8          2HB       LEU   8  28.208 -16.209  13.719
  448    HG   LEU   8           HG       LEU   8  30.123 -14.908  14.940
  449   1HD1  LEU   8          1HD1      LEU   8  28.977 -16.616  17.171
  450   2HD1  LEU   8          2HD1      LEU   8  30.542 -15.804  17.223
  451   3HD1  LEU   8          3HD1      LEU   8  29.058 -14.854  17.145
  452   1HD2  LEU   8          1HD2      LEU   8  29.755 -17.916  15.046
  453   2HD2  LEU   8          2HD2      LEU   8  30.541 -16.982  13.772
  454   3HD2  LEU   8          3HD2      LEU   8  31.294 -17.113  15.362
  455    H    GLU   9           H        GLU   9  26.289 -12.578  13.479
  456    HA   GLU   9           HA       GLU   9  26.439 -11.491  11.384
  457   1HB   GLU   9          1HB       GLU   9  29.167 -11.810  12.526
  458   2HB   GLU   9          2HB       GLU   9  29.091 -11.348  10.825
  459   1HG   GLU   9          1HG       GLU   9  28.173  -9.297  11.277
  460   2HG   GLU   9          2HG       GLU   9  27.263  -9.896  12.666
  461    HA   PRO  10           HA       PRO  10  27.414 -15.655   9.374
  462   1HB   PRO  10          1HB       PRO  10  24.848 -16.476   8.893
  463   2HB   PRO  10          2HB       PRO  10  25.728 -16.880  10.381
  464   1HG   PRO  10          2HG       PRO  10  23.661 -14.793   9.913
  465   2HG   PRO  10          1HG       PRO  10  23.918 -15.832  11.323
  466   1HD   PRO  10          1HD       PRO  10  24.687 -13.213  11.208
  467   2HD   PRO  10          2HD       PRO  10  25.480 -14.432  12.231
  468    H    ASP  11           H        ASP  11  24.660 -13.491   8.645
  469    HA   ASP  11           HA       ASP  11  24.035 -12.407   6.648
  470   1HB   ASP  11          1HB       ASP  11  26.965 -12.618   6.724
  471   2HB   ASP  11          2HB       ASP  11  26.327 -12.456   5.088
  472    H    ASN  12           H        ASN  12  26.474 -14.478   5.129
  473    HA   ASN  12           HA       ASN  12  24.414 -16.347   4.121
  474   1HB   ASN  12          1HB       ASN  12  24.941 -15.743   1.769
  475   2HB   ASN  12          2HB       ASN  12  24.278 -14.369   2.654
  476   2HD2  ASN  12          2HD2      ASN  12  27.310 -15.743   1.373
  477   1HD2  ASN  12          1HD2      ASN  12  28.188 -14.292   1.436
  478    H    VAL  13           H        VAL  13  27.127 -16.248   5.616
  479    HA   VAL  13           HA       VAL  13  28.879 -17.765   3.789
  480    HB   VAL  13           HB       VAL  13  29.036 -16.420   6.455
  481   1HG1  VAL  13          1HG1      VAL  13  30.686 -18.811   5.666
  482   2HG1  VAL  13          2HG1      VAL  13  31.419 -17.510   6.605
  483   3HG1  VAL  13          3HG1      VAL  13  30.031 -18.388   7.249
  484   1HG2  VAL  13          1HG2      VAL  13  30.722 -16.552   3.949
  485   2HG2  VAL  13          2HG2      VAL  13  29.751 -15.197   4.524
  486   3HG2  VAL  13          3HG2      VAL  13  31.211 -15.667   5.395
  487    HA   PRO  14           HA       PRO  14  27.830 -21.179   6.894
  488   1HB   PRO  14          1HB       PRO  14  25.967 -20.725   8.846
  489   2HB   PRO  14          2HB       PRO  14  27.690 -20.359   9.046
  490   1HG   PRO  14          2HG       PRO  14  25.424 -18.534   8.633
  491   2HG   PRO  14          1HG       PRO  14  26.995 -18.240   9.384
  492   1HD   PRO  14          1HD       PRO  14  26.188 -17.497   6.778
  493   2HD   PRO  14          2HD       PRO  14  27.810 -17.378   7.481
  494    H    MET  15           H        MET  15  24.624 -19.678   7.333
  495    HA   MET  15           HA       MET  15  23.428 -20.783   4.964
  496   1HB   MET  15          1HB       MET  15  24.048 -22.614   7.018
  497   2HB   MET  15          2HB       MET  15  22.305 -22.360   7.126
  498   1HG   MET  15          1HG       MET  15  21.918 -23.159   4.971
  499   2HG   MET  15          2HG       MET  15  23.560 -22.805   4.435
  500   1HE   MET  15          1HE       MET  15  23.701 -24.600   3.275
  501   2HE   MET  15          2HE       MET  15  24.575 -26.014   3.860
  502   3HE   MET  15          3HE       MET  15  22.817 -26.073   3.670
  503    H    ASP  16           H        ASP  16  20.974 -20.656   5.124
  504    HA   ASP  16           HA       ASP  16  20.169 -18.592   7.152
  505   1HB   ASP  16          1HB       ASP  16  19.499 -19.022   4.232
  506   2HB   ASP  16          2HB       ASP  16  18.544 -17.953   5.261
  507    H    MET  17           H        MET  17  19.951 -21.505   7.503
  508    HA   MET  17           HA       MET  17  17.434 -22.613   6.877
  509   1HB   MET  17          2HB       MET  17  17.887 -24.025   8.863
  510   2HB   MET  17          1HB       MET  17  19.351 -23.789   7.908
  511   1HG   MET  17          1HG       MET  17  19.727 -21.729   9.490
  512   2HG   MET  17          2HG       MET  17  18.609 -22.579  10.557
  513   1HE   MET  17          1HE       MET  17  19.712 -22.960  12.324
  514   2HE   MET  17          2HE       MET  17  19.522 -24.713  12.180
  515   3HE   MET  17          3HE       MET  17  21.079 -24.027  12.633
  516    H    SER  18           H        SER  18  18.303 -20.206   9.297
  517    HA   SER  18           HA       SER  18  16.962 -18.923  10.756
  518   1HB   SER  18          1HB       SER  18  14.761 -19.814   8.873
  519   2HB   SER  18          2HB       SER  18  14.814 -18.330   9.821
  520    HG   SER  18           HG       SER  18  16.078 -18.998   7.450
  521    HA   PRO  19           HA       PRO  19  14.896 -21.741  13.432
  522   1HB   PRO  19          1HB       PRO  19  13.331 -20.062  14.909
  523   2HB   PRO  19          2HB       PRO  19  15.097 -20.118  15.049
  524   1HG   PRO  19          1HG       PRO  19  13.389 -18.081  13.833
  525   2HG   PRO  19          2HG       PRO  19  15.045 -17.953  14.428
  526   1HD   PRO  19          1HD       PRO  19  14.171 -18.198  11.721
  527   2HD   PRO  19          2HD       PRO  19  15.838 -18.125  12.329
  528    H    LYS  20           H        LYS  20  13.385 -20.924  10.810
  529    HA   LYS  20           HA       LYS  20  11.362 -21.574   9.796
  530   1HB   LYS  20          1HB       LYS  20  11.983 -23.594  11.261
  531   2HB   LYS  20          2HB       LYS  20  10.781 -22.990  12.403
  532   1HG   LYS  20          1HG       LYS  20   9.942 -23.189   9.552
  533   2HG   LYS  20          2HG       LYS  20  10.147 -24.706  10.431
  534   1HD   LYS  20          1HD       LYS  20   8.774 -23.350  12.294
  535   2HD   LYS  20          2HD       LYS  20   8.166 -22.521  10.861
  536   1HE   LYS  20          1HE       LYS  20   7.286 -24.530   9.934
  537   2HE   LYS  20          2HE       LYS  20   8.225 -25.544  11.047
  538   1HZ   LYS  20          1HZ       LYS  20   6.250 -23.540  11.981
  539   2HZ   LYS  20          2HZ       LYS  20   5.836 -25.162  11.692
  540   3HZ   LYS  20          3HZ       LYS  20   6.984 -24.775  12.882
  541    H    ALA  21           H        ALA  21  10.385 -21.290  13.241
  542    HA   ALA  21           HA       ALA  21   7.869 -20.173  12.921
  543   1HB   ALA  21          1HB       ALA  21  10.075 -19.802  14.939
  544   2HB   ALA  21          3HB       ALA  21   8.530 -18.979  15.147
  545   3HB   ALA  21          2HB       ALA  21   8.589 -20.741  15.089
  546    H    LEU  22           H        LEU  22  10.938 -18.340  13.074
  547    HA   LEU  22           HA       LEU  22   9.602 -15.784  12.538
  548   1HB   LEU  22          1HB       LEU  22  12.442 -16.788  12.802
  549   2HB   LEU  22          2HB       LEU  22  12.101 -15.121  12.337
  550    HG   LEU  22           HG       LEU  22  10.648 -14.940  14.401
  551   1HD1  LEU  22          1HD1      LEU  22  11.719 -17.720  14.691
  552   2HD1  LEU  22          2HD1      LEU  22  11.483 -16.757  16.150
  553   3HD1  LEU  22          3HD1      LEU  22  10.119 -17.092  15.081
  554   1HD2  LEU  22          1HD2      LEU  22  13.618 -15.412  14.467
  555   2HD2  LEU  22          2HD2      LEU  22  12.728 -13.901  14.659
  556   3HD2  LEU  22          3HD2      LEU  22  12.758 -15.080  15.971
  557    H    GLN  23           H        GLN  23  11.678 -18.061  10.780
  558    HA   GLN  23           HA       GLN  23  12.051 -16.687   8.355
  559   1HB   GLN  23          1HB       GLN  23  12.985 -18.908   9.115
  560   2HB   GLN  23          2HB       GLN  23  11.433 -19.636   8.702
  561   1HG   GLN  23          1HG       GLN  23  11.773 -18.540   6.377
  562   2HG   GLN  23          2HG       GLN  23  13.458 -18.367   6.864
  563   2HE2  GLN  23          2HE2      GLN  23  11.341 -20.478   5.319
  564   1HE2  GLN  23          1HE2      GLN  23  12.216 -21.920   5.523
  565    H    GLN  24           H        GLN  24   9.288 -18.755   9.301
  566    HA   GLN  24           HA       GLN  24   7.851 -18.412   6.814
  567   1HB   GLN  24          1HB       GLN  24   7.614 -19.749   9.368
  568   2HB   GLN  24          2HB       GLN  24   6.076 -18.998   8.938
  569   1HG   GLN  24          1HG       GLN  24   7.373 -20.325   6.669
  570   2HG   GLN  24          2HG       GLN  24   6.984 -21.432   7.986
  571   2HE2  GLN  24          2HE2      GLN  24   5.624 -19.495   5.424
  572   1HE2  GLN  24          1HE2      GLN  24   3.998 -19.876   5.726
  573    H    LYS  25           H        LYS  25   7.512 -16.908  10.048
  574    HA   LYS  25           HA       LYS  25   5.323 -15.193   9.429
  575   1HB   LYS  25          1HB       LYS  25   7.415 -15.525  11.472
  576   2HB   LYS  25          2HB       LYS  25   6.858 -13.860  11.304
  577   1HG   LYS  25          1HG       LYS  25   5.470 -15.023  12.947
  578   2HG   LYS  25          2HG       LYS  25   4.507 -14.655  11.516
  579   1HD   LYS  25          1HD       LYS  25   5.262 -17.032  10.715
  580   2HD   LYS  25          2HD       LYS  25   5.599 -17.305  12.426
  581   1HE   LYS  25          1HE       LYS  25   3.210 -16.443  12.870
  582   2HE   LYS  25          2HE       LYS  25   2.942 -16.662  11.129
  583   1HZ   LYS  25          1HZ       LYS  25   3.859 -18.936  11.381
  584   2HZ   LYS  25          2HZ       LYS  25   3.872 -18.714  13.066
  585   3HZ   LYS  25          3HZ       LYS  25   2.401 -18.706  12.222
  586    H    ILE  26           H        ILE  26   8.845 -14.517   9.357
  587    HA   ILE  26           HA       ILE  26   8.755 -11.836   8.489
  588    HB   ILE  26           HB       ILE  26  10.677 -14.096   7.843
  589   1HG1  ILE  26          1HG1      ILE  26  10.958 -11.906   9.910
  590   2HG1  ILE  26          2HG1      ILE  26  10.177 -13.443  10.283
  591   1HG2  ILE  26          1HG2      ILE  26  10.583 -11.391   6.878
  592   2HG2  ILE  26          2HG2      ILE  26  11.968 -11.564   7.956
  593   3HG2  ILE  26          3HG2      ILE  26  11.799 -12.628   6.559
  594   1HD1  ILE  26          1HD1      ILE  26  12.655 -13.931   8.892
  595   2HD1  ILE  26          2HD1      ILE  26  12.951 -12.887  10.282
  596   3HD1  ILE  26          3HD1      ILE  26  12.174 -14.454  10.506
  597    H    HIS  27           H        HIS  27   9.141 -14.733   6.401
  598    HA   HIS  27           HA       HIS  27   8.790 -13.301   3.931
  599   1HB   HIS  27          1HB       HIS  27   9.686 -15.730   4.667
  600   2HB   HIS  27          2HB       HIS  27   8.050 -16.180   4.183
  601    HD1  HIS  27           HD1      HIS  27   7.596 -16.358   1.714
  602    HD2  HIS  27           HD2      HIS  27  11.167 -14.358   2.508
  603    HE1  HIS  27           HE1      HIS  27   8.723 -15.987  -0.524
  604    H    GLU  28           H        GLU  28   6.535 -14.493   6.296
  605    HA   GLU  28           HA       GLU  28   4.245 -14.690   4.494
  606   1HB   GLU  28          1HB       GLU  28   4.847 -14.868   7.417
  607   2HB   GLU  28          2HB       GLU  28   3.172 -14.584   6.946
  608   1HG   GLU  28          1HG       GLU  28   4.623 -16.704   5.450
  609   2HG   GLU  28          2HG       GLU  28   4.224 -17.060   7.130
  610    H    LEU  29           H        LEU  29   5.303 -12.341   6.987
  611    HA   LEU  29           HA       LEU  29   3.189 -10.496   6.818
  612   1HB   LEU  29          1HB       LEU  29   6.171 -10.201   7.255
  613   2HB   LEU  29          2HB       LEU  29   5.044  -8.861   7.479
  614    HG   LEU  29           HG       LEU  29   4.371 -11.444   8.809
  615   1HD1  LEU  29          1HD1      LEU  29   6.931 -10.671   9.098
  616   2HD1  LEU  29          2HD1      LEU  29   6.190  -9.608  10.294
  617   3HD1  LEU  29          3HD1      LEU  29   6.000 -11.355  10.431
  618   1HD2  LEU  29          1HD2      LEU  29   4.118  -8.488   9.404
  619   2HD2  LEU  29          2HD2      LEU  29   2.826  -9.653   9.114
  620   3HD2  LEU  29          3HD2      LEU  29   3.752  -9.720  10.612
  621    H    GLU  30           H        GLU  30   6.022 -10.851   4.698
  622    HA   GLU  30           HA       GLU  30   5.616  -8.467   3.150
  623   1HB   GLU  30          1HB       GLU  30   7.544 -10.321   3.386
  624   2HB   GLU  30          2HB       GLU  30   6.755 -10.950   1.939
  625   1HG   GLU  30          1HG       GLU  30   7.134  -8.039   1.878
  626   2HG   GLU  30          2HG       GLU  30   8.650  -8.940   1.966
  627    H    GLY  31           H        GLY  31   4.574 -11.851   2.628
  628   1HA   GLY  31          2HA       GLY  31   2.903 -12.728   1.231
  629   2HA   GLY  31          1HA       GLY  31   3.270 -11.400   0.128
  630    H    LEU  32           H        LEU  32   2.213 -10.938   3.460
  631    HA   LEU  32           HA       LEU  32  -0.591 -10.494   2.769
  632   1HB   LEU  32          1HB       LEU  32   0.524 -11.286   4.976
  633   2HB   LEU  32          2HB       LEU  32   0.854  -9.575   5.257
  634    HG   LEU  32           HG       LEU  32  -1.703  -9.296   4.670
  635   1HD1  LEU  32          1HD1      LEU  32  -1.485 -12.184   5.570
  636   2HD1  LEU  32          2HD1      LEU  32  -2.993 -11.271   5.524
  637   3HD1  LEU  32          3HD1      LEU  32  -2.118 -11.604   4.029
  638   1HD2  LEU  32          1HD2      LEU  32  -0.340 -10.107   7.202
  639   2HD2  LEU  32          2HD2      LEU  32  -1.179  -8.606   6.812
  640   3HD2  LEU  32          3HD2      LEU  32  -2.103 -10.053   7.210
  641    H    MET  33           H        MET  33   2.303  -8.543   2.913
  642    HA   MET  33           HA       MET  33   1.164  -5.956   3.301
  643   1HB   MET  33          1HB       MET  33   3.658  -7.161   2.743
  644   2HB   MET  33          2HB       MET  33   3.400  -5.978   1.461
  645   1HG   MET  33          1HG       MET  33   3.676  -4.234   2.874
  646   2HG   MET  33          2HG       MET  33   2.636  -4.961   4.098
  647   1HE   MET  33          1HE       MET  33   5.904  -4.854   2.338
  648   2HE   MET  33          2HE       MET  33   6.160  -3.686   3.632
  649   3HE   MET  33          3HE       MET  33   7.132  -5.162   3.563
  650    H    MET  34           H        MET  34   2.164  -7.466   0.199
  651    HA   MET  34           HA       MET  34   0.931  -5.505  -1.477
  652   1HB   MET  34          1HB       MET  34   2.691  -7.401  -1.893
  653   2HB   MET  34          2HB       MET  34   1.276  -8.404  -2.216
  654   1HG   MET  34          1HG       MET  34   0.777  -7.312  -4.163
  655   2HG   MET  34          2HG       MET  34   1.306  -5.749  -3.540
  656   1HE   MET  34          1HE       MET  34   3.432  -4.849  -3.437
  657   2HE   MET  34          2HE       MET  34   4.306  -6.120  -2.569
  658   3HE   MET  34          3HE       MET  34   4.948  -5.476  -4.078
  659    H    GLN  35           H        GLN  35  -0.314  -8.459   0.018
  660    HA   GLN  35           HA       GLN  35  -2.659  -8.906  -1.462
  661   1HB   GLN  35          1HB       GLN  35  -1.845 -10.357   0.317
  662   2HB   GLN  35          2HB       GLN  35  -2.099  -9.090   1.516
  663   1HG   GLN  35          2HG       GLN  35  -4.162  -9.944   1.833
  664   2HG   GLN  35          1HG       GLN  35  -4.572  -9.336   0.229
  665   2HE2  GLN  35          2HE2      GLN  35  -3.181 -12.220   1.867
  666   1HE2  GLN  35          1HE2      GLN  35  -3.692 -13.325   0.684
  667    H    HIS  36           H        HIS  36  -2.880  -7.328   1.727
  668    HA   HIS  36           HA       HIS  36  -5.348  -6.053   1.320
  669   1HB   HIS  36          1HB       HIS  36  -2.907  -5.443   2.989
  670   2HB   HIS  36          2HB       HIS  36  -4.376  -4.476   3.125
  671    HD1  HIS  36           HD1      HIS  36  -6.463  -6.754   2.800
  672    HD2  HIS  36           HD2      HIS  36  -3.143  -6.976   5.312
  673    HE1  HIS  36           HE1      HIS  36  -7.012  -8.490   4.562
  674    H    ALA  37           H        ALA  37  -2.086  -4.612   0.870
  675    HA   ALA  37           HA       ALA  37  -2.767  -2.044   0.003
  676   1HB   ALA  37          1HB       ALA  37  -0.493  -2.378   0.157
  677   2HB   ALA  37          3HB       ALA  37  -0.589  -4.017  -0.490
  678   3HB   ALA  37          2HB       ALA  37  -0.654  -2.632  -1.581
  679    H    GLN  38           H        GLN  38  -2.615  -5.033  -1.965
  680    HA   GLN  38           HA       GLN  38  -3.237  -3.884  -4.495
  681   1HB   GLN  38          1HB       GLN  38  -3.350  -6.533  -3.148
  682   2HB   GLN  38          2HB       GLN  38  -4.348  -6.366  -4.593
  683   1HG   GLN  38          1HG       GLN  38  -2.283  -5.415  -5.751
  684   2HG   GLN  38          2HG       GLN  38  -1.360  -5.960  -4.351
  685   2HE2  GLN  38          2HE2      GLN  38  -0.270  -7.446  -5.989
  686   1HE2  GLN  38          1HE2      GLN  38  -1.033  -8.912  -6.375
  687    H    ASN  39           H        ASN  39  -5.272  -4.843  -1.772
  688    HA   ASN  39           HA       ASN  39  -7.761  -4.235  -3.265
  689   1HB   ASN  39          1HB       ASN  39  -6.901  -5.659  -0.835
  690   2HB   ASN  39          2HB       ASN  39  -8.394  -4.745  -0.622
  691   2HD2  ASN  39          2HD2      ASN  39  -7.744  -7.784  -1.055
  692   1HD2  ASN  39          1HD2      ASN  39  -8.844  -8.239  -2.265
  693    H    LEU  40           H        LEU  40  -5.540  -2.245  -2.239
  694    HA   LEU  40           HA       LEU  40  -5.494  -0.063  -1.391
  695   1HB   LEU  40          1HB       LEU  40  -8.308  -0.536  -2.338
  696   2HB   LEU  40          2HB       LEU  40  -7.899   0.995  -1.564
  697    HG   LEU  40           HG       LEU  40  -5.862   0.965  -3.227
  698   1HD1  LEU  40          1HD1      LEU  40  -7.608  -1.227  -4.167
  699   2HD1  LEU  40          2HD1      LEU  40  -7.107  -0.091  -5.419
  700   3HD1  LEU  40          3HD1      LEU  40  -5.893  -0.946  -4.467
  701   1HD2  LEU  40          1HD2      LEU  40  -7.848   2.546  -3.177
  702   2HD2  LEU  40          2HD2      LEU  40  -7.154   2.284  -4.777
  703   3HD2  LEU  40          3HD2      LEU  40  -8.645   1.464  -4.318
  704    H    GLU  41           H        GLU  41  -6.120  -2.404   0.465
  705    HA   GLU  41           HA       GLU  41  -7.949  -1.449   2.499
  706   1HB   GLU  41          1HB       GLU  41  -5.864  -3.564   2.147
  707   2HB   GLU  41          2HB       GLU  41  -6.346  -3.174   3.799
  708   1HG   GLU  41          1HG       GLU  41  -8.362  -3.759   1.622
  709   2HG   GLU  41          2HG       GLU  41  -7.690  -5.022   2.653
  710    H    PHE  42           H        PHE  42  -4.408  -1.408   2.139
  711    HA   PHE  42           HA       PHE  42  -2.755  -0.151   3.251
  712   1HB   PHE  42          1HB       PHE  42  -5.135   1.616   2.784
  713   2HB   PHE  42          2HB       PHE  42  -3.741   2.268   3.645
  714    HD1  PHE  42           HD1      PHE  42  -1.447   0.988   2.384
  715    HD2  PHE  42           HD2      PHE  42  -5.086   2.465   0.588
  716    HE1  PHE  42           HE1      PHE  42  -0.253   1.302   0.219
  717    HE2  PHE  42           HE2      PHE  42  -3.889   2.779  -1.577
  718    HZ   PHE  42           HZ       PHE  42  -1.471   2.198  -1.756
  719    H    GLU  43           H        GLU  43  -2.548   1.462   5.241
  720    HA   GLU  43           HA       GLU  43  -2.604   1.783   7.555
  721   1HB   GLU  43          1HB       GLU  43  -4.991   2.213   7.214
  722   2HB   GLU  43          2HB       GLU  43  -5.329   0.486   7.177
  723   1HG   GLU  43          1HG       GLU  43  -4.311   0.354   9.502
  724   2HG   GLU  43          2HG       GLU  43  -4.359   2.119   9.523
  725    H    GLU  44           H        GLU  44  -4.246  -1.283   6.936
  726    HA   GLU  44           HA       GLU  44  -2.655  -2.668   8.984
  727   1HB   GLU  44          2HB       GLU  44  -4.124  -4.542   8.400
  728   2HB   GLU  44          1HB       GLU  44  -5.087  -3.073   8.548
  729   1HG   GLU  44          1HG       GLU  44  -5.128  -2.795   6.131
  730   2HG   GLU  44          2HG       GLU  44  -4.027  -4.156   5.921
  731    H    ALA  45           H        ALA  45  -2.772  -2.384   5.465
  732    HA   ALA  45           HA       ALA  45  -0.903  -4.587   4.984
  733   1HB   ALA  45          1HB       ALA  45  -2.821  -3.385   3.552
  734   2HB   ALA  45          2HB       ALA  45  -1.447  -4.171   2.777
  735   3HB   ALA  45          3HB       ALA  45  -1.450  -2.422   3.002
  736    H    ALA  46           H        ALA  46  -0.711  -1.014   4.822
  737    HA   ALA  46           HA       ALA  46   2.103  -1.010   4.119
  738   1HB   ALA  46          1HB       ALA  46   1.837   1.376   4.284
  739   2HB   ALA  46          3HB       ALA  46   0.336   0.731   3.620
  740   3HB   ALA  46          2HB       ALA  46   0.419   1.201   5.320
  741    H    GLN  47           H        GLN  47   0.385  -1.246   7.135
  742    HA   GLN  47           HA       GLN  47   2.474  -0.149   8.830
  743   1HB   GLN  47          1HB       GLN  47  -0.068  -1.681   9.084
  744   2HB   GLN  47          2HB       GLN  47   1.047  -1.771  10.447
  745   1HG   GLN  47          1HG       GLN  47   0.290   0.870   9.196
  746   2HG   GLN  47          2HG       GLN  47  -0.676   0.144  10.481
  747   2HE2  GLN  47          2HE2      GLN  47   0.804   2.635  10.793
  748   1HE2  GLN  47          1HE2      GLN  47   2.002   2.368  11.967
  749    H    ILE  48           H        ILE  48   2.004  -3.193   7.219
  750    HA   ILE  48           HA       ILE  48   3.561  -4.862   8.987
  751    HB   ILE  48           HB       ILE  48   2.950  -5.058   6.020
  752   1HG1  ILE  48          1HG1      ILE  48   0.923  -4.822   7.397
  753   2HG1  ILE  48          2HG1      ILE  48   1.053  -6.468   6.775
  754   1HG2  ILE  48          1HG2      ILE  48   4.749  -6.569   7.349
  755   2HG2  ILE  48          2HG2      ILE  48   3.279  -7.457   7.748
  756   3HG2  ILE  48          3HG2      ILE  48   3.732  -7.214   6.062
  757   1HD1  ILE  48          1HD1      ILE  48   2.476  -6.461   9.211
  758   2HD1  ILE  48          2HD1      ILE  48   0.989  -5.566   9.523
  759   3HD1  ILE  48          3HD1      ILE  48   0.912  -7.212   8.895
  760    H    ARG  49           H        ARG  49   4.394  -2.689   6.324
  761    HA   ARG  49           HA       ARG  49   6.962  -3.610   5.634
  762   1HB   ARG  49          2HB       ARG  49   7.334  -1.290   4.941
  763   2HB   ARG  49          1HB       ARG  49   5.664  -1.740   4.597
  764   1HG   ARG  49          2HG       ARG  49   5.226   0.232   5.673
  765   2HG   ARG  49          1HG       ARG  49   5.357  -0.789   7.105
  766   1HD   ARG  49          1HD       ARG  49   7.931  -0.213   6.923
  767   2HD   ARG  49          2HD       ARG  49   7.336   1.187   6.008
  768    HE   ARG  49           HE       ARG  49   5.819   0.735   8.452
  769   1HH1  ARG  49          1HH1      ARG  49   9.068   1.396   7.905
  770   2HH1  ARG  49          2HH1      ARG  49   9.087   2.901   8.762
  771   1HH2  ARG  49          1HH2      ARG  49   5.649   2.995   9.205
  772   2HH2  ARG  49          2HH2      ARG  49   7.151   3.806   9.499
  773    H    ASP  50           H        ASP  50   5.893  -1.972   8.551
  774    HA   ASP  50           HA       ASP  50   8.583  -1.307   9.487
  775   1HB   ASP  50          1HB       ASP  50   6.023  -0.488  10.016
  776   2HB   ASP  50          2HB       ASP  50   6.334  -1.539  11.398
  777    H    GLN  51           H        GLN  51   6.224  -3.908  10.022
  778    HA   GLN  51           HA       GLN  51   7.640  -5.211  12.169
  779   1HB   GLN  51          1HB       GLN  51   5.703  -6.260  10.078
  780   2HB   GLN  51          2HB       GLN  51   6.097  -7.063  11.599
  781   1HG   GLN  51          1HG       GLN  51   5.209  -5.158  12.863
  782   2HG   GLN  51          2HG       GLN  51   4.863  -4.302  11.359
  783   2HE2  GLN  51          2HE2      GLN  51   4.340  -7.783  12.080
  784   1HE2  GLN  51          1HE2      GLN  51   2.661  -7.738  11.839
  785    H    LEU  52           H        LEU  52   7.789  -5.448   8.635
  786    HA   LEU  52           HA       LEU  52   9.266  -7.828   8.316
  787   1HB   LEU  52          1HB       LEU  52   8.637  -5.391   6.859
  788   2HB   LEU  52          2HB       LEU  52  10.268  -5.944   6.478
  789    HG   LEU  52           HG       LEU  52   7.739  -7.612   6.321
  790   1HD1  LEU  52          1HD1      LEU  52   8.722  -5.754   4.521
  791   2HD1  LEU  52          2HD1      LEU  52   9.409  -7.269   3.933
  792   3HD1  LEU  52          3HD1      LEU  52   7.663  -7.105   4.115
  793   1HD2  LEU  52          1HD2      LEU  52  10.480  -8.370   6.652
  794   2HD2  LEU  52          2HD2      LEU  52   9.087  -9.418   6.382
  795   3HD2  LEU  52          3HD2      LEU  52   9.993  -8.785   5.008
  796    H    HIS  53           H        HIS  53  10.552  -4.501   8.719
  797    HA   HIS  53           HA       HIS  53  13.310  -5.350   8.914
  798   1HB   HIS  53          1HB       HIS  53  11.740  -2.854   9.590
  799   2HB   HIS  53          2HB       HIS  53  13.483  -2.948   9.839
  800    HD1  HIS  53           HD1      HIS  53  10.901  -2.583   7.201
  801    HD2  HIS  53           HD2      HIS  53  15.005  -3.296   7.387
  802    HE1  HIS  53           HE1      HIS  53  11.801  -2.206   4.863
  803    H    GLN  54           H        GLN  54  10.774  -4.609  11.300
  804    HA   GLN  54           HA       GLN  54  12.376  -4.704  13.656
  805   1HB   GLN  54          1HB       GLN  54   9.803  -4.166  13.042
  806   2HB   GLN  54          2HB       GLN  54   9.605  -5.799  13.678
  807   1HG   GLN  54          1HG       GLN  54  11.105  -4.945  15.642
  808   2HG   GLN  54          2HG       GLN  54  10.633  -3.342  15.076
  809   2HE2  GLN  54          2HE2      GLN  54   8.612  -2.581  15.763
  810   1HE2  GLN  54          1HE2      GLN  54   7.423  -3.542  16.501
  811    H    LEU  55           H        LEU  55  10.614  -7.291  11.930
  812    HA   LEU  55           HA       LEU  55  11.357  -9.388  13.783
  813   1HB   LEU  55          1HB       LEU  55  10.141  -9.108  11.062
  814   2HB   LEU  55          2HB       LEU  55  10.721 -10.703  11.542
  815    HG   LEU  55           HG       LEU  55   9.401 -10.047  13.791
  816   1HD1  LEU  55          1HD1      LEU  55   8.713  -7.845  12.864
  817   2HD1  LEU  55          2HD1      LEU  55   7.872  -8.677  11.556
  818   3HD1  LEU  55          3HD1      LEU  55   7.323  -8.872  13.220
  819   1HD2  LEU  55          1HD2      LEU  55   8.225 -11.174  11.231
  820   2HD2  LEU  55          2HD2      LEU  55   9.004 -12.082  12.526
  821   3HD2  LEU  55          3HD2      LEU  55   7.450 -11.299  12.810
  822    H    ARG  56           H        ARG  56  12.924  -7.879  11.044
  823    HA   ARG  56           HA       ARG  56  14.731  -9.927  10.256
  824   1HB   ARG  56          1HB       ARG  56  14.280  -7.753   9.113
  825   2HB   ARG  56          2HB       ARG  56  15.148  -6.924  10.405
  826   1HG   ARG  56          1HG       ARG  56  17.034  -8.708   9.778
  827   2HG   ARG  56          2HG       ARG  56  16.209  -8.662   8.219
  828   1HD   ARG  56          1HD       ARG  56  16.580  -6.302   7.985
  829   2HD   ARG  56          2HD       ARG  56  17.106  -6.154   9.674
  830    HE   ARG  56           HE       ARG  56  18.622  -7.768   7.655
  831   1HH1  ARG  56          1HH1      ARG  56  18.992  -7.626  10.788
  832   2HH1  ARG  56          2HH1      ARG  56  20.427  -6.657  10.853
  833   1HH2  ARG  56          1HH2      ARG  56  20.222  -5.658   7.540
  834   2HH2  ARG  56          2HH2      ARG  56  21.123  -5.543   9.015
  835    H    GLU  57           H        GLU  57  15.274  -7.250  12.588
  836    HA   GLU  57           HA       GLU  57  17.845  -8.130  13.474
  837   1HB   GLU  57          1HB       GLU  57  17.315  -6.606  15.390
  838   2HB   GLU  57          2HB       GLU  57  16.946  -5.880  13.825
  839   1HG   GLU  57          1HG       GLU  57  14.627  -6.177  14.091
  840   2HG   GLU  57          2HG       GLU  57  14.837  -7.401  15.345
  841    H    LEU  58           H        LEU  58  14.614  -9.206  14.258
  842    HA   LEU  58           HA       LEU  58  15.217 -10.453  16.798
  843   1HB   LEU  58          1HB       LEU  58  12.993  -9.817  15.366
  844   2HB   LEU  58          2HB       LEU  58  13.089 -11.548  15.040
  845    HG   LEU  58           HG       LEU  58  13.600 -10.954  17.846
  846   1HD1  LEU  58          1HD1      LEU  58  11.056  -9.960  16.556
  847   2HD1  LEU  58          2HD1      LEU  58  11.103 -10.448  18.251
  848   3HD1  LEU  58          3HD1      LEU  58  12.112  -9.114  17.688
  849   1HD2  LEU  58          1HD2      LEU  58  12.856 -13.113  16.490
  850   2HD2  LEU  58          2HD2      LEU  58  12.317 -12.868  18.150
  851   3HD2  LEU  58          3HD2      LEU  58  11.240 -12.485  16.808
  852    H    PHE  59           H        PHE  59  15.723 -11.364  13.469
  853    HA   PHE  59           HA       PHE  59  15.753 -14.174  13.569
  854   1HB   PHE  59          1HB       PHE  59  16.050 -12.822  11.548
  855   2HB   PHE  59          2HB       PHE  59  17.592 -12.217  12.153
  856    HD1  PHE  59           HD1      PHE  59  19.570 -13.699  12.315
  857    HD2  PHE  59           HD2      PHE  59  15.829 -15.083  10.663
  858    HE1  PHE  59           HE1      PHE  59  20.733 -15.677  11.341
  859    HE2  PHE  59           HE2      PHE  59  16.992 -17.061   9.688
  860    HZ   PHE  59           HZ       PHE  59  19.444 -17.358  10.027
  861    H    ILE  60           H        ILE  60  18.417 -11.917  14.370
  862    HA   ILE  60           HA       ILE  60  20.312 -13.949  15.107
  863    HB   ILE  60           HB       ILE  60  20.016 -11.051  15.971
  864   1HG1  ILE  60          1HG1      ILE  60  21.925 -11.901  13.854
  865   2HG1  ILE  60          2HG1      ILE  60  20.215 -11.921  13.417
  866   1HG2  ILE  60          1HG2      ILE  60  22.408 -12.918  15.935
  867   2HG2  ILE  60          2HG2      ILE  60  22.482 -11.190  16.283
  868   3HG2  ILE  60          3HG2      ILE  60  21.613 -12.272  17.371
  869   1HD1  ILE  60          1HD1      ILE  60  20.124  -9.551  14.446
  870   2HD1  ILE  60          2HD1      ILE  60  21.884  -9.585  14.347
  871   3HD1  ILE  60          3HD1      ILE  60  20.916  -9.726  12.879
  872    H    ALA  61           H        ALA  61  18.158 -11.884  17.096
  873    HA   ALA  61           HA       ALA  61  18.854 -12.870  19.648
  874   1HB   ALA  61          1HB       ALA  61  17.455 -10.973  19.500
  875   2HB   ALA  61          3HB       ALA  61  16.347 -11.770  18.382
  876   3HB   ALA  61          2HB       ALA  61  16.364 -12.230  20.085
  877    H    ALA  62           H        ALA  62  16.979 -14.366  17.099
  878    HA   ALA  62           HA       ALA  62  15.906 -16.455  18.908
  879   1HB   ALA  62          1HB       ALA  62  15.280 -17.114  16.296
  880   2HB   ALA  62          2HB       ALA  62  14.285 -16.109  17.348
  881   3HB   ALA  62          3HB       ALA  62  15.416 -15.358  16.224
  882    H    SER  63           H        SER  63  17.465 -16.702  15.698
  883    HA   SER  63           HA       SER  63  19.573 -18.473  16.747
  884   1HB   SER  63          1HB       SER  63  17.115 -19.396  15.294
  885   2HB   SER  63          2HB       SER  63  18.630 -20.252  15.028
  886    HG   SER  63           HG       SER  63  17.024 -20.083  17.286

  No H/Q in entry =         886
  Start of MODEL   10
    1    H    LEU   8           H        LEU   8 -19.873  24.475 -33.719
    2    HA   LEU   8           HA       LEU   8 -21.872  25.809 -32.538
    3   1HB   LEU   8          1HB       LEU   8 -21.699  24.506 -34.821
    4   2HB   LEU   8          2HB       LEU   8 -22.643  23.281 -33.973
    5    HG   LEU   8           HG       LEU   8 -23.469  26.187 -34.012
    6   1HD1  LEU   8          1HD1      LEU   8 -24.022  23.991 -36.012
    7   2HD1  LEU   8          2HD1      LEU   8 -25.117  25.357 -35.806
    8   3HD1  LEU   8          3HD1      LEU   8 -23.453  25.631 -36.322
    9   1HD2  LEU   8          1HD2      LEU   8 -24.661  23.558 -33.200
   10   2HD2  LEU   8          2HD2      LEU   8 -24.722  25.114 -32.373
   11   3HD2  LEU   8          3HD2      LEU   8 -25.737  24.827 -33.786
   12    H    GLU   9           H        GLU   9 -21.960  25.425 -30.236
   13    HA   GLU   9           HA       GLU   9 -22.766  24.388 -28.270
   14   1HB   GLU   9          1HB       GLU   9 -24.743  24.590 -30.007
   15   2HB   GLU   9          2HB       GLU   9 -24.606  22.832 -30.068
   16   1HG   GLU   9          1HG       GLU   9 -25.443  22.567 -27.968
   17   2HG   GLU   9          2HG       GLU   9 -24.588  23.980 -27.346
   18    HA   PRO  10           HA       PRO  10 -20.434  20.499 -29.309
   19   1HB   PRO  10          1HB       PRO  10 -18.458  20.833 -27.447
   20   2HB   PRO  10          2HB       PRO  10 -18.363  21.505 -29.088
   21   1HG   PRO  10          2HG       PRO  10 -19.067  22.849 -26.530
   22   2HG   PRO  10          1HG       PRO  10 -18.126  23.454 -27.902
   23   1HD   PRO  10          1HD       PRO  10 -20.733  24.126 -27.436
   24   2HD   PRO  10          2HD       PRO  10 -19.986  24.123 -29.049
   25    H    ASP  11           H        ASP  11 -20.737  21.908 -26.025
   26    HA   ASP  11           HA       ASP  11 -21.623  20.999 -24.036
   27   1HB   ASP  11          1HB       ASP  11 -23.156  20.029 -26.278
   28   2HB   ASP  11          2HB       ASP  11 -23.067  18.770 -25.046
   29    H    ASN  12           H        ASN  12 -21.502  17.950 -25.860
   30    HA   ASN  12           HA       ASN  12 -19.105  17.098 -24.306
   31   1HB   ASN  12          1HB       ASN  12 -20.375  15.040 -23.632
   32   2HB   ASN  12          2HB       ASN  12 -21.057  16.518 -22.951
   33   2HD2  ASN  12          2HD2      ASN  12 -21.538  14.062 -25.493
   34   1HD2  ASN  12          1HD2      ASN  12 -23.172  14.428 -25.768
   35    H    VAL  13           H        VAL  13 -19.893  17.630 -27.211
   36    HA   VAL  13           HA       VAL  13 -20.173  15.259 -28.706
   37    HB   VAL  13           HB       VAL  13 -19.098  18.017 -29.084
   38   1HG1  VAL  13          1HG1      VAL  13 -18.435  15.709 -30.904
   39   2HG1  VAL  13          2HG1      VAL  13 -18.700  17.318 -31.575
   40   3HG1  VAL  13          3HG1      VAL  13 -17.408  17.055 -30.402
   41   1HG2  VAL  13          1HG2      VAL  13 -21.272  16.259 -30.148
   42   2HG2  VAL  13          2HG2      VAL  13 -21.370  17.896 -29.502
   43   3HG2  VAL  13          3HG2      VAL  13 -20.736  17.626 -31.124
   44    HA   PRO  14           HA       PRO  14 -15.462  14.704 -28.640
   45   1HB   PRO  14          1HB       PRO  14 -13.933  16.301 -27.031
   46   2HB   PRO  14          2HB       PRO  14 -14.362  16.733 -28.697
   47   1HG   PRO  14          2HG       PRO  14 -15.418  17.780 -26.151
   48   2HG   PRO  14          1HG       PRO  14 -15.301  18.553 -27.735
   49   1HD   PRO  14          1HD       PRO  14 -17.613  17.453 -26.586
   50   2HD   PRO  14          2HD       PRO  14 -17.402  17.959 -28.269
   51    H    MET  15           H        MET  15 -15.144  16.047 -25.380
   52    HA   MET  15           HA       MET  15 -16.164  13.754 -23.970
   53   1HB   MET  15          1HB       MET  15 -14.156  12.846 -25.223
   54   2HB   MET  15          2HB       MET  15 -13.150  13.927 -24.259
   55   1HG   MET  15          2HG       MET  15 -13.047  12.115 -22.864
   56   2HG   MET  15          1HG       MET  15 -14.582  12.760 -22.284
   57   1HE   MET  15          1HE       MET  15 -13.286  10.138 -22.048
   58   2HE   MET  15          2HE       MET  15 -14.339   8.802 -22.535
   59   3HE   MET  15          3HE       MET  15 -13.036   9.334 -23.595
   60    H    ASP  16           H        ASP  16 -16.962  15.634 -22.744
   61    HA   ASP  16           HA       ASP  16 -15.340  16.282 -20.447
   62   1HB   ASP  16          1HB       ASP  16 -14.155  17.620 -22.125
   63   2HB   ASP  16          2HB       ASP  16 -15.670  18.372 -22.625
   64    H    MET  17           H        MET  17 -17.675  15.394 -19.990
   65    HA   MET  17           HA       MET  17 -20.016  16.924 -20.402
   66   1HB   MET  17          1HB       MET  17 -20.817  15.666 -18.390
   67   2HB   MET  17          2HB       MET  17 -19.984  14.634 -19.553
   68   1HG   MET  17          1HG       MET  17 -17.879  15.388 -18.030
   69   2HG   MET  17          2HG       MET  17 -19.160  15.456 -16.821
   70   1HE   MET  17          1HE       MET  17 -17.135  13.662 -19.268
   71   2HE   MET  17          2HE       MET  17 -17.421  11.935 -19.078
   72   3HE   MET  17          3HE       MET  17 -18.562  12.914 -19.995
   73    H    SER  18           H        SER  18 -17.465  17.283 -17.956
   74    HA   SER  18           HA       SER  18 -18.106  20.046 -17.483
   75   1HB   SER  18          1HB       SER  18 -19.525  17.971 -15.965
   76   2HB   SER  18          2HB       SER  18 -18.752  19.178 -14.940
   77    HG   SER  18           HG       SER  18 -20.156  20.594 -15.602
   78    HA   PRO  19           HA       PRO  19 -14.880  18.725 -14.251
   79   1HB   PRO  19          1HB       PRO  19 -14.425  16.074 -13.809
   80   2HB   PRO  19          2HB       PRO  19 -15.613  17.026 -12.903
   81   1HG   PRO  19          2HG       PRO  19 -16.017  15.107 -15.125
   82   2HG   PRO  19          1HG       PRO  19 -17.024  15.443 -13.708
   83   1HD   PRO  19          1HD       PRO  19 -17.551  16.380 -16.238
   84   2HD   PRO  19          2HD       PRO  19 -18.136  17.136 -14.741
   85    H    LYS  20           H        LYS  20 -14.265  15.627 -15.754
   86    HA   LYS  20           HA       LYS  20 -12.653  14.949 -17.349
   87   1HB   LYS  20          1HB       LYS  20 -13.772  16.996 -18.537
   88   2HB   LYS  20          2HB       LYS  20 -12.307  17.863 -18.071
   89   1HG   LYS  20          1HG       LYS  20 -12.191  15.209 -19.509
   90   2HG   LYS  20          2HG       LYS  20 -12.296  16.738 -20.384
   91   1HD   LYS  20          1HD       LYS  20 -10.304  17.150 -18.452
   92   2HD   LYS  20          2HD       LYS  20  -9.999  15.531 -19.083
   93   1HE   LYS  20          1HE       LYS  20 -10.442  16.752 -21.423
   94   2HE   LYS  20          2HE       LYS  20  -9.884  18.162 -20.499
   95   1HZ   LYS  20          1HZ       LYS  20  -8.486  15.543 -20.507
   96   2HZ   LYS  20          2HZ       LYS  20  -8.059  16.830 -21.527
   97   3HZ   LYS  20          3HZ       LYS  20  -7.931  17.005 -19.842
   98    H    ALA  21           H        ALA  21 -11.562  18.202 -16.286
   99    HA   ALA  21           HA       ALA  21  -8.828  17.502 -15.925
  100   1HB   ALA  21          1HB       ALA  21  -9.962  19.792 -15.979
  101   2HB   ALA  21          3HB       ALA  21  -8.732  19.599 -14.729
  102   3HB   ALA  21          2HB       ALA  21 -10.442  19.500 -14.308
  103    H    LEU  22           H        LEU  22 -11.661  17.026 -13.922
  104    HA   LEU  22           HA       LEU  22 -10.226  16.308 -11.472
  105   1HB   LEU  22          1HB       LEU  22 -13.055  16.011 -12.522
  106   2HB   LEU  22          2HB       LEU  22 -12.586  15.432 -10.931
  107    HG   LEU  22           HG       LEU  22 -11.866  17.739 -10.334
  108   1HD1  LEU  22          1HD1      LEU  22 -12.895  18.291 -13.124
  109   2HD1  LEU  22          2HD1      LEU  22 -12.780  19.559 -11.902
  110   3HD1  LEU  22          3HD1      LEU  22 -11.326  18.719 -12.441
  111   1HD2  LEU  22          1HD2      LEU  22 -14.672  17.099 -11.211
  112   2HD2  LEU  22          2HD2      LEU  22 -14.031  17.289  -9.576
  113   3HD2  LEU  22          3HD2      LEU  22 -14.309  18.710 -10.584
  114    H    GLN  23           H        GLN  23 -12.046  14.597 -13.989
  115    HA   GLN  23           HA       GLN  23 -11.797  11.938 -13.185
  116   1HB   GLN  23          1HB       GLN  23 -12.837  13.264 -15.270
  117   2HB   GLN  23          2HB       GLN  23 -11.371  12.667 -16.053
  118   1HG   GLN  23          1HG       GLN  23 -11.926  10.387 -15.570
  119   2HG   GLN  23          2HG       GLN  23 -13.239  10.869 -14.494
  120   2HE2  GLN  23          2HE2      GLN  23 -13.062   9.372 -17.275
  121   1HE2  GLN  23          1HE2      GLN  23 -14.292  10.121 -18.173
  122    H    GLN  24           H        GLN  24  -9.547  13.641 -15.401
  123    HA   GLN  24           HA       GLN  24  -7.599  11.557 -15.521
  124   1HB   GLN  24          1HB       GLN  24  -8.058  14.131 -16.558
  125   2HB   GLN  24          2HB       GLN  24  -6.499  14.236 -15.738
  126   1HG   GLN  24          1HG       GLN  24  -6.199  11.858 -16.998
  127   2HG   GLN  24          2HG       GLN  24  -7.272  12.670 -18.138
  128   2HE2  GLN  24          2HE2      GLN  24  -4.147  13.077 -16.419
  129   1HE2  GLN  24          1HE2      GLN  24  -3.478  14.136 -17.564
  130    H    LYS  25           H        LYS  25  -7.772  14.461 -13.433
  131    HA   LYS  25           HA       LYS  25  -5.317  14.036 -12.036
  132   1HB   LYS  25          1HB       LYS  25  -7.830  15.581 -11.747
  133   2HB   LYS  25          2HB       LYS  25  -6.925  15.329 -10.254
  134   1HG   LYS  25          1HG       LYS  25  -5.192  16.652 -10.927
  135   2HG   LYS  25          2HG       LYS  25  -5.297  16.108 -12.602
  136   1HD   LYS  25          1HD       LYS  25  -6.790  17.746 -13.184
  137   2HD   LYS  25          2HD       LYS  25  -7.576  17.735 -11.604
  138   1HE   LYS  25          2HE       LYS  25  -6.434  19.826 -11.677
  139   2HE   LYS  25          1HE       LYS  25  -5.353  18.782 -10.732
  140   1HZ   LYS  25          1HZ       LYS  25  -4.180  18.209 -12.767
  141   2HZ   LYS  25          2HZ       LYS  25  -5.200  19.226 -13.668
  142   3HZ   LYS  25          3HZ       LYS  25  -4.144  19.889 -12.519
  143    H    ILE  26           H        ILE  26  -8.666  13.205 -11.041
  144    HA   ILE  26           HA       ILE  26  -8.086  11.892  -8.623
  145    HB   ILE  26           HB       ILE  26 -10.156  11.316 -10.768
  146   1HG1  ILE  26          1HG1      ILE  26 -10.531  12.840  -8.189
  147   2HG1  ILE  26          2HG1      ILE  26  -9.948  13.646  -9.645
  148   1HG2  ILE  26          1HG2      ILE  26  -9.550   9.901  -8.348
  149   2HG2  ILE  26          2HG2      ILE  26 -11.092  10.730  -8.141
  150   3HG2  ILE  26          3HG2      ILE  26 -10.866   9.610  -9.484
  151   1HD1  ILE  26          1HD1      ILE  26 -11.957  12.712 -10.859
  152   2HD1  ILE  26          2HD1      ILE  26 -12.567  12.168  -9.297
  153   3HD1  ILE  26          3HD1      ILE  26 -12.346  13.891  -9.606
  154    H    HIS  27           H        HIS  27  -8.332  10.414 -11.884
  155    HA   HIS  27           HA       HIS  27  -7.508   7.786 -11.020
  156   1HB   HIS  27          1HB       HIS  27  -8.684   8.855 -13.204
  157   2HB   HIS  27          2HB       HIS  27  -7.031   8.723 -13.807
  158    HD1  HIS  27           HD1      HIS  27  -6.006   6.154 -12.792
  159    HD2  HIS  27           HD2      HIS  27  -9.990   6.547 -13.953
  160    HE1  HIS  27           HE1      HIS  27  -6.841   3.815 -13.289
  161    H    GLU  28           H        GLU  28  -5.767  10.702 -11.769
  162    HA   GLU  28           HA       GLU  28  -3.241   9.438 -12.474
  163   1HB   GLU  28          1HB       GLU  28  -4.397  12.119 -12.047
  164   2HB   GLU  28          2HB       GLU  28  -2.684  11.999 -11.642
  165   1HG   GLU  28          1HG       GLU  28  -3.896  11.074 -14.263
  166   2HG   GLU  28          2HG       GLU  28  -3.064  12.613 -14.033
  167    H    LEU  29           H        LEU  29  -4.644  10.808  -9.497
  168    HA   LEU  29           HA       LEU  29  -2.217  10.374  -7.926
  169   1HB   LEU  29          1HB       LEU  29  -5.090  11.139  -7.374
  170   2HB   LEU  29          2HB       LEU  29  -3.920  10.933  -6.070
  171    HG   LEU  29           HG       LEU  29  -3.219  12.668  -8.419
  172   1HD1  LEU  29          1HD1      LEU  29  -5.540  13.242  -7.360
  173   2HD1  LEU  29          2HD1      LEU  29  -4.584  13.797  -5.985
  174   3HD1  LEU  29          3HD1      LEU  29  -4.359  14.536  -7.571
  175   1HD2  LEU  29          1HD2      LEU  29  -2.230  12.072  -5.721
  176   2HD2  LEU  29          2HD2      LEU  29  -1.377  12.767  -7.100
  177   3HD2  LEU  29          3HD2      LEU  29  -2.341  13.802  -6.045
  178    H    GLU  30           H        GLU  30  -5.366   8.738  -8.294
  179    HA   GLU  30           HA       GLU  30  -5.161   6.792  -6.272
  180   1HB   GLU  30          1HB       GLU  30  -7.012   7.376  -7.999
  181   2HB   GLU  30          2HB       GLU  30  -6.190   6.224  -9.052
  182   1HG   GLU  30          1HG       GLU  30  -6.356   4.529  -7.190
  183   2HG   GLU  30          2HG       GLU  30  -7.372   5.677  -6.317
  184    H    GLY  31           H        GLY  31  -3.833   6.717  -9.586
  185   1HA   GLY  31          2HA       GLY  31  -2.405   5.117 -10.592
  186   2HA   GLY  31          1HA       GLY  31  -2.625   4.084  -9.179
  187    H    LEU  32           H        LEU  32  -1.715   7.386  -8.630
  188    HA   LEU  32           HA       LEU  32   1.102   7.281  -8.832
  189   1HB   LEU  32          1HB       LEU  32  -0.410   9.255  -8.383
  190   2HB   LEU  32          2HB       LEU  32  -0.553   8.691  -6.717
  191    HG   LEU  32           HG       LEU  32   1.878   8.872  -6.424
  192   1HD1  LEU  32          1HD1      LEU  32   1.781   9.714  -9.330
  193   2HD1  LEU  32          2HD1      LEU  32   3.161  10.049  -8.287
  194   3HD1  LEU  32          3HD1      LEU  32   2.695   8.383  -8.622
  195   1HD2  LEU  32          1HD2      LEU  32   0.127  11.120  -7.118
  196   2HD2  LEU  32          2HD2      LEU  32   1.231  10.938  -5.755
  197   3HD2  LEU  32          3HD2      LEU  32   1.838  11.500  -7.312
  198    H    MET  33           H        MET  33  -0.861   6.729  -5.868
  199    HA   MET  33           HA       MET  33   1.449   5.637  -4.443
  200   1HB   MET  33          1HB       MET  33  -0.286   5.274  -2.674
  201   2HB   MET  33          2HB       MET  33  -0.288   6.922  -3.300
  202   1HG   MET  33          1HG       MET  33  -2.380   6.706  -4.132
  203   2HG   MET  33          2HG       MET  33  -2.012   5.134  -4.839
  204   1HE   MET  33          1HE       MET  33  -3.939   4.340  -4.682
  205   2HE   MET  33          2HE       MET  33  -3.709   2.926  -3.650
  206   3HE   MET  33          3HE       MET  33  -5.007   4.081  -3.305
  207    H    MET  34           H        MET  34  -1.064   4.363  -6.477
  208    HA   MET  34           HA       MET  34  -1.278   1.697  -5.496
  209   1HB   MET  34          1HB       MET  34  -2.384   3.174  -7.475
  210   2HB   MET  34          2HB       MET  34  -1.264   2.203  -8.432
  211   1HG   MET  34          1HG       MET  34  -3.252   1.062  -6.447
  212   2HG   MET  34          2HG       MET  34  -3.512   1.132  -8.190
  213   1HE   MET  34          1HE       MET  34  -2.851  -1.084  -5.534
  214   2HE   MET  34          2HE       MET  34  -3.856  -1.545  -6.917
  215   3HE   MET  34          3HE       MET  34  -2.440  -2.503  -6.494
  216    H    GLN  35           H        GLN  35   0.846   2.957  -8.111
  217    HA   GLN  35           HA       GLN  35   2.304   0.590  -8.606
  218   1HB   GLN  35          1HB       GLN  35   4.062   2.213  -9.387
  219   2HB   GLN  35          2HB       GLN  35   2.446   2.600  -9.980
  220   1HG   GLN  35          1HG       GLN  35   2.184   4.386  -8.465
  221   2HG   GLN  35          2HG       GLN  35   3.484   3.809  -7.422
  222   2HE2  GLN  35          2HE2      GLN  35   4.576   5.932  -7.641
  223   1HE2  GLN  35          1HE2      GLN  35   5.407   6.323  -9.069
  224    H    HIS  36           H        HIS  36   2.454   2.814  -5.915
  225    HA   HIS  36           HA       HIS  36   5.047   1.881  -4.924
  226   1HB   HIS  36          1HB       HIS  36   2.876   3.774  -4.168
  227   2HB   HIS  36          2HB       HIS  36   3.889   3.179  -2.853
  228    HD1  HIS  36           HD1      HIS  36   5.310   3.614  -6.295
  229    HD2  HIS  36           HD2      HIS  36   5.311   5.649  -2.657
  230    HE1  HIS  36           HE1      HIS  36   7.077   5.419  -6.484
  231    H    ALA  37           H        ALA  37   1.670   1.603  -3.719
  232    HA   ALA  37           HA       ALA  37   2.069  -0.192  -1.601
  233   1HB   ALA  37          1HB       ALA  37  -0.304  -0.983  -2.855
  234   2HB   ALA  37          2HB       ALA  37  -0.147   0.315  -1.671
  235   3HB   ALA  37          3HB       ALA  37  -0.073   0.680  -3.395
  236    H    GLN  38           H        GLN  38   1.885  -0.845  -5.080
  237    HA   GLN  38           HA       GLN  38   1.907  -3.738  -4.857
  238   1HB   GLN  38          1HB       GLN  38   2.427  -1.667  -6.989
  239   2HB   GLN  38          2HB       GLN  38   2.711  -3.376  -7.322
  240   1HG   GLN  38          1HG       GLN  38   0.330  -3.767  -6.421
  241   2HG   GLN  38          2HG       GLN  38   0.115  -2.023  -6.585
  242   2HE2  GLN  38          2HE2      GLN  38   1.005  -4.942  -8.482
  243   1HE2  GLN  38          1HE2      GLN  38   0.482  -4.321  -9.973
  244    H    ASN  39           H        ASN  39   4.377  -1.215  -5.198
  245    HA   ASN  39           HA       ASN  39   6.553  -3.242  -5.205
  246   1HB   ASN  39          1HB       ASN  39   6.288  -0.273  -5.681
  247   2HB   ASN  39          2HB       ASN  39   7.875  -1.003  -5.439
  248   2HD2  ASN  39          2HD2      ASN  39   8.850  -1.628  -7.362
  249   1HD2  ASN  39          1HD2      ASN  39   8.028  -2.110  -8.766
  250    H    LEU  40           H        LEU  40   4.769  -2.569  -2.826
  251    HA   LEU  40           HA       LEU  40   5.025  -2.275  -0.504
  252   1HB   LEU  40          1HB       LEU  40   7.695  -3.184  -1.542
  253   2HB   LEU  40          2HB       LEU  40   7.532  -2.762   0.162
  254    HG   LEU  40           HG       LEU  40   5.301  -4.310  -0.242
  255   1HD1  LEU  40          1HD1      LEU  40   7.505  -5.199  -2.091
  256   2HD1  LEU  40          2HD1      LEU  40   6.426  -6.387  -1.361
  257   3HD1  LEU  40          3HD1      LEU  40   5.770  -5.119  -2.396
  258   1HD2  LEU  40          1HD2      LEU  40   7.868  -4.494   1.081
  259   2HD2  LEU  40          2HD2      LEU  40   6.316  -5.166   1.581
  260   3HD2  LEU  40          3HD2      LEU  40   7.369  -6.086   0.507
  261    H    GLU  41           H        GLU  41   5.005   0.139  -1.965
  262    HA   GLU  41           HA       GLU  41   6.949   1.789  -0.383
  263   1HB   GLU  41          1HB       GLU  41   5.993   2.074  -3.248
  264   2HB   GLU  41          2HB       GLU  41   6.957   3.289  -2.408
  265   1HG   GLU  41          1HG       GLU  41   7.999   0.513  -2.303
  266   2HG   GLU  41          2HG       GLU  41   8.052   1.296  -3.882
  267    H    PHE  42           H        PHE  42   3.927   0.963  -0.245
  268    HA   PHE  42           HA       PHE  42   2.267   3.210  -0.677
  269   1HB   PHE  42          1HB       PHE  42   0.830   2.037   1.038
  270   2HB   PHE  42          2HB       PHE  42   1.386   1.005  -0.276
  271    HD1  PHE  42           HD1      PHE  42   2.435   2.143   3.159
  272    HD2  PHE  42           HD2      PHE  42   2.417  -1.048   0.244
  273    HE1  PHE  42           HE1      PHE  42   3.524   0.624   4.804
  274    HE2  PHE  42           HE2      PHE  42   3.496  -2.549   1.888
  275    HZ   PHE  42           HZ       PHE  42   4.049  -1.723   4.171
  276    H    GLU  43           H        GLU  43   4.804   2.916   1.640
  277    HA   GLU  43           HA       GLU  43   3.845   4.191   3.940
  278   1HB   GLU  43          1HB       GLU  43   6.126   3.345   3.651
  279   2HB   GLU  43          2HB       GLU  43   6.449   4.564   2.419
  280   1HG   GLU  43          1HG       GLU  43   5.693   6.218   4.365
  281   2HG   GLU  43          2HG       GLU  43   6.223   4.879   5.383
  282    H    GLU  44           H        GLU  44   5.540   5.957   1.350
  283    HA   GLU  44           HA       GLU  44   4.211   8.475   2.077
  284   1HB   GLU  44          1HB       GLU  44   5.644   9.327   0.222
  285   2HB   GLU  44          2HB       GLU  44   6.569   8.364   1.374
  286   1HG   GLU  44          1HG       GLU  44   6.761   6.555  -0.085
  287   2HG   GLU  44          2HG       GLU  44   5.335   7.023  -1.013
  288    H    ALA  45           H        ALA  45   3.684   5.849  -0.129
  289    HA   ALA  45           HA       ALA  45   2.141   7.315  -2.113
  290   1HB   ALA  45          1HB       ALA  45   1.515   4.590  -2.221
  291   2HB   ALA  45          3HB       ALA  45   3.145   4.632  -1.550
  292   3HB   ALA  45          2HB       ALA  45   2.812   5.395  -3.103
  293    H    ALA  46           H        ALA  46   1.206   4.918   0.386
  294    HA   ALA  46           HA       ALA  46  -1.541   4.863   0.135
  295   1HB   ALA  46          1HB       ALA  46   0.238   4.925   2.580
  296   2HB   ALA  46          3HB       ALA  46  -0.410   3.509   1.749
  297   3HB   ALA  46          2HB       ALA  46  -1.481   4.561   2.673
  298    H    GLN  47           H        GLN  47   0.379   7.526   1.450
  299    HA   GLN  47           HA       GLN  47  -1.631   8.999   2.789
  300   1HB   GLN  47          1HB       GLN  47   0.667   9.966   1.056
  301   2HB   GLN  47          2HB       GLN  47  -0.154  10.917   2.295
  302   1HG   GLN  47          1HG       GLN  47   0.469   8.851   3.833
  303   2HG   GLN  47          2HG       GLN  47   1.723   8.605   2.617
  304   2HE2  GLN  47          2HE2      GLN  47   0.331  11.614   4.051
  305   1HE2  GLN  47          1HE2      GLN  47   1.829  12.248   4.536
  306    H    ILE  48           H        ILE  48  -0.940   8.671  -0.667
  307    HA   ILE  48           HA       ILE  48  -2.425  10.787  -1.767
  308    HB   ILE  48           HB       ILE  48  -2.106   7.891  -2.623
  309   1HG1  ILE  48          1HG1      ILE  48   0.006   9.117  -2.322
  310   2HG1  ILE  48          2HG1      ILE  48  -0.295   8.827  -4.035
  311   1HG2  ILE  48          1HG2      ILE  48  -3.663  10.041  -3.777
  312   2HG2  ILE  48          2HG2      ILE  48  -2.360   9.573  -4.870
  313   3HG2  ILE  48          3HG2      ILE  48  -3.518   8.367  -4.311
  314   1HD1  ILE  48          1HD1      ILE  48  -1.489  11.182  -3.905
  315   2HD1  ILE  48          2HD1      ILE  48  -0.458  11.392  -2.490
  316   3HD1  ILE  48          3HD1      ILE  48   0.265  11.085  -4.069
  317    H    ARG  49           H        ARG  49  -3.552   7.750  -0.357
  318    HA   ARG  49           HA       ARG  49  -6.221   7.616  -1.182
  319   1HB   ARG  49          1HB       ARG  49  -5.280   5.921   0.202
  320   2HB   ARG  49          2HB       ARG  49  -4.793   7.079   1.432
  321   1HG   ARG  49          1HG       ARG  49  -7.630   7.287   1.102
  322   2HG   ARG  49          2HG       ARG  49  -7.222   5.583   1.275
  323   1HD   ARG  49          1HD       ARG  49  -7.605   6.665   3.491
  324   2HD   ARG  49          2HD       ARG  49  -5.934   6.089   3.329
  325    HE   ARG  49           HE       ARG  49  -5.388   8.486   2.593
  326   1HH1  ARG  49          1HH1      ARG  49  -8.414   9.173   2.821
  327   2HH1  ARG  49          2HH1      ARG  49  -8.405  10.084   4.294
  328   1HH2  ARG  49          1HH2      ARG  49  -5.242   9.026   5.240
  329   2HH2  ARG  49          2HH2      ARG  49  -6.609  10.001   5.663
  330    H    ASP  50           H        ASP  50  -4.709   9.892   1.043
  331    HA   ASP  50           HA       ASP  50  -7.139  10.984   2.166
  332   1HB   ASP  50          1HB       ASP  50  -4.737  11.148   3.011
  333   2HB   ASP  50          2HB       ASP  50  -4.460  12.339   1.740
  334    H    GLN  51           H        GLN  51  -5.090  11.824  -0.621
  335    HA   GLN  51           HA       GLN  51  -6.741  14.128  -1.374
  336   1HB   GLN  51          1HB       GLN  51  -4.622  12.584  -2.907
  337   2HB   GLN  51          2HB       GLN  51  -5.165  14.230  -3.239
  338   1HG   GLN  51          1HG       GLN  51  -4.306  14.986  -1.078
  339   2HG   GLN  51          2HG       GLN  51  -3.840  13.336  -0.660
  340   2HE2  GLN  51          2HE2      GLN  51  -3.419  15.208  -3.718
  341   1HE2  GLN  51          1HE2      GLN  51  -1.735  14.997  -3.786
  342    H    LEU  52           H        LEU  52  -6.489  10.717  -2.226
  343    HA   LEU  52           HA       LEU  52  -8.041  10.759  -4.639
  344   1HB   LEU  52          1HB       LEU  52  -6.884   8.876  -2.732
  345   2HB   LEU  52          2HB       LEU  52  -8.428   8.300  -3.358
  346    HG   LEU  52           HG       LEU  52  -6.513   7.571  -4.772
  347   1HD1  LEU  52          1HD1      LEU  52  -8.844   9.098  -5.645
  348   2HD1  LEU  52          2HD1      LEU  52  -7.536   9.157  -6.828
  349   3HD1  LEU  52          3HD1      LEU  52  -8.177   7.601  -6.300
  350   1HD2  LEU  52          1HD2      LEU  52  -5.545  10.116  -4.273
  351   2HD2  LEU  52          2HD2      LEU  52  -4.914   9.011  -5.493
  352   3HD2  LEU  52          3HD2      LEU  52  -6.100  10.235  -5.943
  353    H    HIS  53           H        HIS  53  -8.940  10.331  -1.214
  354    HA   HIS  53           HA       HIS  53 -11.758   9.869  -1.764
  355   1HB   HIS  53          1HB       HIS  53 -10.111   9.390   0.297
  356   2HB   HIS  53          2HB       HIS  53 -10.762  10.936   0.843
  357    HD1  HIS  53           HD1      HIS  53 -13.551  11.026   0.639
  358    HD2  HIS  53           HD2      HIS  53 -11.750   7.281   0.980
  359    HE1  HIS  53           HE1      HIS  53 -15.362   9.425   1.398
  360    H    GLN  54           H        GLN  54  -9.810  12.699  -0.814
  361    HA   GLN  54           HA       GLN  54 -11.991  14.516  -0.412
  362   1HB   GLN  54          1HB       GLN  54  -9.610  14.779   0.321
  363   2HB   GLN  54          2HB       GLN  54  -9.155  15.040  -1.363
  364   1HG   GLN  54          1HG       GLN  54  -9.844  17.186  -1.304
  365   2HG   GLN  54          2HG       GLN  54 -11.392  16.735  -0.591
  366   2HE2  GLN  54          2HE2      GLN  54 -11.584  16.788   1.744
  367   1HE2  GLN  54          1HE2      GLN  54 -10.387  17.480   2.729
  368    H    LEU  55           H        LEU  55  -9.851  14.055  -3.257
  369    HA   LEU  55           HA       LEU  55 -11.209  15.889  -4.975
  370   1HB   LEU  55          1HB       LEU  55  -9.341  13.563  -5.229
  371   2HB   LEU  55          2HB       LEU  55 -10.099  14.180  -6.697
  372    HG   LEU  55           HG       LEU  55  -9.164  16.379  -5.075
  373   1HD1  LEU  55          1HD1      LEU  55  -7.375  14.032  -5.351
  374   2HD1  LEU  55          2HD1      LEU  55  -6.664  15.584  -5.795
  375   3HD1  LEU  55          3HD1      LEU  55  -7.331  15.349  -4.180
  376   1HD2  LEU  55          1HD2      LEU  55  -8.673  15.272  -7.837
  377   2HD2  LEU  55          2HD2      LEU  55  -9.512  16.754  -7.377
  378   3HD2  LEU  55          3HD2      LEU  55  -7.755  16.659  -7.249
  379    H    ARG  56           H        ARG  56 -11.798  12.488  -4.205
  380    HA   ARG  56           HA       ARG  56 -13.583  11.828  -6.321
  381   1HB   ARG  56          1HB       ARG  56 -12.579  10.233  -4.740
  382   2HB   ARG  56          2HB       ARG  56 -13.494  10.953  -3.415
  383   1HG   ARG  56          1HG       ARG  56 -15.495  10.417  -5.196
  384   2HG   ARG  56          2HG       ARG  56 -14.386   9.084  -5.523
  385   1HD   ARG  56          1HD       ARG  56 -14.321   8.620  -3.041
  386   2HD   ARG  56          2HD       ARG  56 -15.608   9.827  -2.843
  387    HE   ARG  56           HE       ARG  56 -16.381   8.052  -4.929
  388   1HH1  ARG  56          1HH1      ARG  56 -15.150   6.213  -2.786
  389   2HH1  ARG  56          2HH1      ARG  56 -16.565   5.784  -1.885
  390   1HH2  ARG  56          1HH2      ARG  56 -18.512   8.320  -3.230
  391   2HH2  ARG  56          2HH2      ARG  56 -18.470   6.977  -2.136
  392    H    GLU  57           H        GLU  57 -14.274  13.165  -3.070
  393    HA   GLU  57           HA       GLU  57 -17.080  13.296  -3.204
  394   1HB   GLU  57          1HB       GLU  57 -15.598  13.805  -1.258
  395   2HB   GLU  57          2HB       GLU  57 -15.146  15.323  -2.035
  396   1HG   GLU  57          2HG       GLU  57 -16.884  16.031  -0.657
  397   2HG   GLU  57          1HG       GLU  57 -17.755  15.693  -2.153
  398    H    LEU  58           H        LEU  58 -14.662  15.424  -4.675
  399    HA   LEU  58           HA       LEU  58 -16.565  17.467  -5.498
  400   1HB   LEU  58          1HB       LEU  58 -13.694  16.739  -5.994
  401   2HB   LEU  58          2HB       LEU  58 -14.457  17.948  -7.026
  402    HG   LEU  58           HG       LEU  58 -14.749  18.162  -4.046
  403   1HD1  LEU  58          1HD1      LEU  58 -12.308  18.784  -5.700
  404   2HD1  LEU  58          2HD1      LEU  58 -12.685  19.739  -4.266
  405   3HD1  LEU  58          3HD1      LEU  58 -12.403  18.004  -4.122
  406   1HD2  LEU  58          1HD2      LEU  58 -15.943  19.592  -5.854
  407   2HD2  LEU  58          2HD2      LEU  58 -15.158  20.442  -4.523
  408   3HD2  LEU  58          3HD2      LEU  58 -14.367  20.345  -6.096
  409    H    PHE  59           H        PHE  59 -15.203  14.542  -6.956
  410    HA   PHE  59           HA       PHE  59 -15.888  14.923  -9.666
  411   1HB   PHE  59          1HB       PHE  59 -14.583  13.053  -8.585
  412   2HB   PHE  59          2HB       PHE  59 -16.115  12.375  -8.034
  413    HD1  PHE  59           HD1      PHE  59 -14.289  13.473 -11.123
  414    HD2  PHE  59           HD2      PHE  59 -17.413  10.999  -9.458
  415    HE1  PHE  59           HE1      PHE  59 -14.607  12.380 -13.341
  416    HE2  PHE  59           HE2      PHE  59 -17.729   9.907 -11.676
  417    HZ   PHE  59           HZ       PHE  59 -16.326  10.597 -13.617
  418    H    ILE  60           H        ILE  60 -17.898  13.611  -7.011
  419    HA   ILE  60           HA       ILE  60 -20.224  13.044  -8.569
  420    HB   ILE  60           HB       ILE  60 -19.842  13.844  -5.665
  421   1HG1  ILE  60          1HG1      ILE  60 -20.202  11.091  -6.882
  422   2HG1  ILE  60          2HG1      ILE  60 -18.618  11.798  -6.563
  423   1HG2  ILE  60          1HG2      ILE  60 -22.197  14.088  -6.476
  424   2HG2  ILE  60          2HG2      ILE  60 -22.166  12.395  -6.970
  425   3HG2  ILE  60          3HG2      ILE  60 -22.017  12.818  -5.265
  426   1HD1  ILE  60          1HD1      ILE  60 -20.775  11.459  -4.461
  427   2HD1  ILE  60          2HD1      ILE  60 -19.447  10.323  -4.707
  428   3HD1  ILE  60          3HD1      ILE  60 -19.110  11.977  -4.195
  429    H    ALA  61           H        ALA  61 -19.218  15.988  -6.820
  430    HA   ALA  61           HA       ALA  61 -21.596  17.513  -7.229
  431   1HB   ALA  61          1HB       ALA  61 -20.232  19.319  -6.498
  432   2HB   ALA  61          2HB       ALA  61 -19.511  17.896  -5.747
  433   3HB   ALA  61          3HB       ALA  61 -18.776  18.602  -7.186
  434    H    ALA  62           H        ALA  62 -19.022  16.627  -9.405
  435    HA   ALA  62           HA       ALA  62 -19.906  18.669 -11.399
  436   1HB   ALA  62          1HB       ALA  62 -17.432  17.794 -10.523
  437   2HB   ALA  62          3HB       ALA  62 -17.720  18.666 -12.028
  438   3HB   ALA  62          2HB       ALA  62 -17.641  16.905 -12.031
  439    H    SER  63           H        SER  63 -18.919  15.215 -11.398
  440    HA   SER  63           HA       SER  63 -20.511  14.725 -13.833
  441   1HB   SER  63          1HB       SER  63 -18.226  13.784 -13.365
  442   2HB   SER  63          2HB       SER  63 -18.928  12.847 -12.049
  443    HG   SER  63           HG       SER  63 -20.373  11.965 -13.666
  444    H    LEU   8           H        LEU   8  19.595 -39.634  13.322
  445    HA   LEU   8           HA       LEU   8  21.638 -38.911  14.895
  446   1HB   LEU   8          1HB       LEU   8  21.399 -40.720  12.994
  447   2HB   LEU   8          2HB       LEU   8  22.337 -39.566  12.044
  448    HG   LEU   8           HG       LEU   8  23.215 -40.450  14.796
  449   1HD1  LEU   8          1HD1      LEU   8  23.691 -41.740  12.105
  450   2HD1  LEU   8          2HD1      LEU   8  24.815 -41.949  13.448
  451   3HD1  LEU   8          3HD1      LEU   8  23.148 -42.502  13.599
  452   1HD2  LEU   8          1HD2      LEU   8  24.373 -38.931  12.485
  453   2HD2  LEU   8          2HD2      LEU   8  24.477 -38.587  14.212
  454   3HD2  LEU   8          3HD2      LEU   8  25.461 -39.870  13.507
  455    H    GLU   9           H        GLU   9  21.760 -36.598  15.186
  456    HA   GLU   9           HA       GLU   9  22.583 -34.426  14.741
  457   1HB   GLU   9          1HB       GLU   9  24.531 -36.172  14.390
  458   2HB   GLU   9          2HB       GLU   9  24.361 -35.720  12.693
  459   1HG   GLU   9          1HG       GLU   9  25.230 -33.643  13.025
  460   2HG   GLU   9          2HG       GLU   9  24.414 -33.445  14.576
  461    HA   PRO  10           HA       PRO  10  20.160 -34.272  10.771
  462   1HB   PRO  10          1HB       PRO  10  18.225 -32.563  11.673
  463   2HB   PRO  10          2HB       PRO  10  18.112 -34.325  11.845
  464   1HG   PRO  10          2HG       PRO  10  18.888 -32.272  13.854
  465   2HG   PRO  10          1HG       PRO  10  17.933 -33.749  14.058
  466   1HD   PRO  10          1HD       PRO  10  20.560 -33.530  14.777
  467   2HD   PRO  10          2HD       PRO  10  19.783 -35.063  14.326
  468    H    ASP  11           H        ASP  11  20.549 -31.538  13.059
  469    HA   ASP  11           HA       ASP  11  21.453 -29.383  12.742
  470   1HB   ASP  11          1HB       ASP  11  22.928 -31.268  11.134
  471   2HB   ASP  11          2HB       ASP  11  22.839 -29.725  10.284
  472    H    ASN  12           H        ASN  12  21.244 -30.248   9.301
  473    HA   ASN  12           HA       ASN  12  18.862 -28.485   8.987
  474   1HB   ASN  12          1HB       ASN  12  20.106 -27.263   7.183
  475   2HB   ASN  12          2HB       ASN  12  20.827 -27.046   8.778
  476   2HD2  ASN  12          2HD2      ASN  12  21.217 -28.776   5.684
  477   1HD2  ASN  12          1HD2      ASN  12  22.852 -29.166   5.918
  478    H    VAL  13           H        VAL  13  19.606 -31.430   8.641
  479    HA   VAL  13           HA       VAL  13  19.817 -32.181   5.934
  480    HB   VAL  13           HB       VAL  13  18.786 -33.325   8.491
  481   1HG1  VAL  13          1HG1      VAL  13  18.048 -34.396   5.773
  482   2HG1  VAL  13          2HG1      VAL  13  18.330 -35.505   7.114
  483   3HG1  VAL  13          3HG1      VAL  13  17.056 -34.290   7.227
  484   1HG2  VAL  13          1HG2      VAL  13  20.907 -33.864   6.453
  485   2HG2  VAL  13          2HG2      VAL  13  21.047 -33.718   8.205
  486   3HG2  VAL  13          3HG2      VAL  13  20.378 -35.187   7.493
  487    HA   PRO  14           HA       PRO  14  15.099 -31.903   5.529
  488   1HB   PRO  14          1HB       PRO  14  13.627 -30.804   7.556
  489   2HB   PRO  14          2HB       PRO  14  14.035 -32.528   7.480
  490   1HG   PRO  14          2HG       PRO  14  15.156 -30.404   9.192
  491   2HG   PRO  14          1HG       PRO  14  15.024 -32.143   9.478
  492   1HD   PRO  14          1HD       PRO  14  17.336 -30.753   8.704
  493   2HD   PRO  14          2HD       PRO  14  17.103 -32.509   8.708
  494    H    MET  15           H        MET  15  14.863 -29.165   7.760
  495    HA   MET  15           HA       MET  15  15.866 -27.165   5.948
  496   1HB   MET  15          1HB       MET  15  13.819 -28.080   4.763
  497   2HB   MET  15          2HB       MET  15  12.851 -27.457   6.099
  498   1HG   MET  15          1HG       MET  15  12.740 -25.598   4.767
  499   2HG   MET  15          2HG       MET  15  14.297 -25.245   5.517
  500   1HE   MET  15          1HE       MET  15  12.959 -24.249   3.103
  501   2HE   MET  15          2HE       MET  15  13.978 -24.343   1.660
  502   3HE   MET  15          3HE       MET  15  12.666 -25.496   1.894
  503    H    ASP  16           H        ASP  16  16.721 -26.542   8.082
  504    HA   ASP  16           HA       ASP  16  15.152 -24.511   9.401
  505   1HB   ASP  16          1HB       ASP  16  13.961 -26.489  10.226
  506   2HB   ASP  16          2HB       ASP  16  15.481 -27.202  10.767
  507    H    MET  17           H        MET  17  17.478 -23.845   8.631
  508    HA   MET  17           HA       MET  17  19.839 -24.709   9.924
  509   1HB   MET  17          1HB       MET  17  20.653 -22.430   9.280
  510   2HB   MET  17          2HB       MET  17  19.781 -23.235   7.976
  511   1HG   MET  17          1HG       MET  17  17.718 -21.969   9.183
  512   2HG   MET  17          2HG       MET  17  19.022 -20.847   9.568
  513   1HE   MET  17          1HE       MET  17  16.920 -22.648   7.192
  514   2HE   MET  17          2HE       MET  17  17.178 -21.972   5.585
  515   3HE   MET  17          3HE       MET  17  18.321 -23.146   6.233
  516    H    SER  18           H        SER  18  17.339 -22.440  11.027
  517    HA   SER  18           HA       SER  18  18.038 -22.791  13.795
  518   1HB   SER  18          1HB       SER  18  19.447 -20.755  12.214
  519   2HB   SER  18          2HB       SER  18  18.716 -20.114  13.682
  520    HG   SER  18           HG       SER  18  20.133 -21.172  14.816
  521    HA   PRO  19           HA       PRO  19  14.848 -19.277  13.534
  522   1HB   PRO  19          1HB       PRO  19  14.353 -18.085  11.133
  523   2HB   PRO  19          2HB       PRO  19  15.575 -17.505  12.280
  524   1HG   PRO  19          2HG       PRO  19  15.904 -19.084   9.793
  525   2HG   PRO  19          1HG       PRO  19  16.942 -17.836  10.500
  526   1HD   PRO  19          1HD       PRO  19  17.439 -20.536  10.656
  527   2HD   PRO  19          2HD       PRO  19  18.065 -19.328  11.798
  528    H    LYS  20           H        LYS  20  14.151 -19.814  10.149
  529    HA   LYS  20           HA       LYS  20  12.498 -21.129   9.077
  530   1HB   LYS  20          1HB       LYS  20  13.632 -22.868  10.670
  531   2HB   LYS  20          2HB       LYS  20  12.192 -22.655  11.666
  532   1HG   LYS  20          1HG       LYS  20  12.002 -23.265   8.716
  533   2HG   LYS  20          2HG       LYS  20  12.119 -24.545   9.924
  534   1HD   LYS  20          1HD       LYS  20  10.170 -22.791  10.920
  535   2HD   LYS  20          2HD       LYS  20   9.823 -22.924   9.195
  536   1HE   LYS  20          1HE       LYS  20  10.246 -25.522   9.681
  537   2HE   LYS  20          2HE       LYS  20   9.731 -25.038  11.309
  538   1HZ   LYS  20          1HZ       LYS  20   8.286 -24.273   8.831
  539   2HZ   LYS  20          2HZ       LYS  20   7.865 -25.615   9.778
  540   3HZ   LYS  20          3HZ       LYS  20   7.769 -24.050  10.434
  541    H    ALA  21           H        ALA  21  11.484 -21.035  12.523
  542    HA   ALA  21           HA       ALA  21   8.746 -20.456  12.019
  543   1HB   ALA  21          1HB       ALA  21  10.425 -19.501  14.360
  544   2HB   ALA  21          3HB       ALA  21   8.709 -19.913  14.371
  545   3HB   ALA  21          2HB       ALA  21   9.919 -21.179  14.169
  546    H    LEU  22           H        LEU  22  11.605 -18.434  12.074
  547    HA   LEU  22           HA       LEU  22  10.202 -15.863  12.125
  548   1HB   LEU  22          1HB       LEU  22  13.005 -16.817  11.474
  549   2HB   LEU  22          2HB       LEU  22  12.555 -15.122  11.388
  550    HG   LEU  22           HG       LEU  22  11.888 -15.206  13.785
  551   1HD1  LEU  22          1HD1      LEU  22  12.875 -18.049  13.488
  552   2HD1  LEU  22          2HD1      LEU  22  12.806 -17.242  15.056
  553   3HD1  LEU  22          3HD1      LEU  22  11.327 -17.499  14.129
  554   1HD2  LEU  22          1HD2      LEU  22  14.665 -15.896  12.856
  555   2HD2  LEU  22          2HD2      LEU  22  14.057 -14.377  13.524
  556   3HD2  LEU  22          3HD2      LEU  22  14.342 -15.754  14.587
  557    H    GLN  23           H        GLN  23  11.945 -17.802   9.722
  558    HA   GLN  23           HA       GLN  23  11.662 -16.263   7.412
  559   1HB   GLN  23          1HB       GLN  23  12.689 -18.655   8.058
  560   2HB   GLN  23          2HB       GLN  23  11.197 -19.215   7.295
  561   1HG   GLN  23          1HG       GLN  23  11.721 -18.101   5.238
  562   2HG   GLN  23          2HG       GLN  23  13.061 -17.227   5.980
  563   2HE2  GLN  23          2HE2      GLN  23  12.807 -19.455   3.750
  564   1HE2  GLN  23          1HE2      GLN  23  14.033 -20.546   4.181
  565    H    GLN  24           H        GLN  24   9.403 -18.849   8.455
  566    HA   GLN  24           HA       GLN  24   7.416 -18.340   6.469
  567   1HB   GLN  24          1HB       GLN  24   7.903 -20.079   8.625
  568   2HB   GLN  24          2HB       GLN  24   6.362 -19.306   8.997
  569   1HG   GLN  24          1HG       GLN  24   5.994 -19.823   6.364
  570   2HG   GLN  24          2HG       GLN  24   7.062 -21.162   6.790
  571   2HE2  GLN  24          2HE2      GLN  24   3.977 -19.595   7.744
  572   1HE2  GLN  24          1HE2      GLN  24   3.307 -20.990   8.443
  573    H    LYS  25           H        LYS  25   7.679 -17.180   9.848
  574    HA   LYS  25           HA       LYS  25   5.243 -15.690   9.899
  575   1HB   LYS  25          1HB       LYS  25   7.789 -15.888  11.404
  576   2HB   LYS  25          2HB       LYS  25   6.905 -14.376  11.613
  577   1HG   LYS  25          1HG       LYS  25   5.185 -15.380  12.725
  578   2HG   LYS  25          2HG       LYS  25   5.252 -16.829  11.720
  579   1HD   LYS  25          1HD       LYS  25   6.763 -17.875  13.087
  580   2HD   LYS  25          2HD       LYS  25   7.576 -16.368  13.513
  581   1HE   LYS  25          2HE       LYS  25   6.471 -17.027  15.520
  582   2HE   LYS  25          1HE       LYS  25   5.388 -15.810  14.816
  583   1HZ   LYS  25          1HZ       LYS  25   4.169 -17.579  13.709
  584   2HZ   LYS  25          2HZ       LYS  25   5.191 -18.747  14.400
  585   3HZ   LYS  25          3HZ       LYS  25   4.168 -17.825  15.390
  586    H    ILE  26           H        ILE  26   8.594 -14.537   9.315
  587    HA   ILE  26           HA       ILE  26   8.033 -11.838   8.765
  588    HB   ILE  26           HB       ILE  26  10.053 -13.750   7.550
  589   1HG1  ILE  26          1HG1      ILE  26  10.503 -11.723   9.742
  590   2HG1  ILE  26          2HG1      ILE  26   9.908 -13.342  10.109
  591   1HG2  ILE  26          1HG2      ILE  26   9.465 -11.018   6.906
  592   2HG2  ILE  26          2HG2      ILE  26  11.027 -11.077   7.723
  593   3HG2  ILE  26          3HG2      ILE  26  10.755 -12.039   6.270
  594   1HD1  ILE  26          1HD1      ILE  26  11.878 -14.262   8.818
  595   2HD1  ILE  26          2HD1      ILE  26  12.507 -12.616   8.735
  596   3HD1  ILE  26          3HD1      ILE  26  12.310 -13.406  10.299
  597    H    HIS  27           H        HIS  27   8.195 -14.537   6.407
  598    HA   HIS  27           HA       HIS  27   7.337 -12.943   4.158
  599   1HB   HIS  27          1HB       HIS  27   8.494 -15.356   4.526
  600   2HB   HIS  27          2HB       HIS  27   6.829 -15.876   4.263
  601    HD1  HIS  27           HD1      HIS  27   5.775 -14.150   2.120
  602    HD2  HIS  27           HD2      HIS  27   9.744 -15.423   2.073
  603    HE1  HIS  27           HE1      HIS  27   6.558 -13.964  -0.282
  604    H    GLU  28           H        GLU  28   5.638 -14.479   6.773
  605    HA   GLU  28           HA       GLU  28   3.076 -14.759   5.417
  606   1HB   GLU  28          1HB       GLU  28   4.288 -15.138   8.081
  607   2HB   GLU  28          2HB       GLU  28   2.581 -14.695   8.122
  608   1HG   GLU  28          1HG       GLU  28   3.729 -16.953   6.455
  609   2HG   GLU  28          2HG       GLU  28   2.928 -17.165   8.012
  610    H    LEU  29           H        LEU  29   4.557 -12.321   7.554
  611    HA   LEU  29           HA       LEU  29   2.151 -10.663   7.645
  612   1HB   LEU  29          1HB       LEU  29   5.048 -10.390   8.472
  613   2HB   LEU  29          2HB       LEU  29   3.898  -9.068   8.677
  614    HG   LEU  29           HG       LEU  29   3.186 -11.807   9.677
  615   1HD1  LEU  29          1HD1      LEU  29   5.535 -10.987  10.479
  616   2HD1  LEU  29          2HD1      LEU  29   4.615  -9.818  11.429
  617   3HD1  LEU  29          3HD1      LEU  29   4.374 -11.547  11.684
  618   1HD2  LEU  29          1HD2      LEU  29   2.234  -9.041   9.905
  619   2HD2  LEU  29          2HD2      LEU  29   1.370 -10.551  10.194
  620   3HD2  LEU  29          3HD2      LEU  29   2.371  -9.851  11.465
  621    H    GLU  30           H        GLU  30   5.263 -10.581   5.902
  622    HA   GLU  30           HA       GLU  30   5.058  -8.082   4.625
  623   1HB   GLU  30          1HB       GLU  30   6.889  -9.926   4.645
  624   2HB   GLU  30          2HB       GLU  30   6.027 -10.592   3.257
  625   1HG   GLU  30          1HG       GLU  30   6.196  -8.323   2.167
  626   2HG   GLU  30          2HG       GLU  30   7.247  -7.830   3.494
  627    H    GLY  31           H        GLY  31   3.669 -11.218   3.630
  628   1HA   GLY  31          2HA       GLY  31   2.196 -11.702   1.840
  629   2HA   GLY  31          1HA       GLY  31   2.421 -10.054   1.253
  630    H    LEU  32           H        LEU  32   1.582 -10.470   4.594
  631    HA   LEU  32           HA       LEU  32  -1.240 -10.600   4.498
  632   1HB   LEU  32          1HB       LEU  32   0.315 -10.756   6.483
  633   2HB   LEU  32          2HB       LEU  32   0.479  -9.001   6.419
  634    HG   LEU  32           HG       LEU  32  -1.944  -8.743   6.731
  635   1HD1  LEU  32          1HD1      LEU  32  -1.883 -11.769   6.700
  636   2HD1  LEU  32          2HD1      LEU  32  -3.239 -10.850   7.353
  637   3HD1  LEU  32          3HD1      LEU  32  -2.808 -10.697   5.649
  638   1HD2  LEU  32          1HD2      LEU  32  -0.163 -10.076   8.644
  639   2HD2  LEU  32          2HD2      LEU  32  -1.247  -8.705   8.888
  640   3HD2  LEU  32          3HD2      LEU  32  -1.871 -10.350   8.990
  641    H    MET  33           H        MET  33   0.765  -7.628   4.781
  642    HA   MET  33           HA       MET  33  -1.537  -5.920   4.198
  643   1HB   MET  33          1HB       MET  33   0.226  -4.143   4.319
  644   2HB   MET  33          2HB       MET  33   0.242  -5.217   5.719
  645   1HG   MET  33          1HG       MET  33   2.312  -5.984   5.229
  646   2HG   MET  33          2HG       MET  33   1.905  -6.201   3.527
  647   1HE   MET  33          1HE       MET  33   3.822  -5.847   2.769
  648   2HE   MET  33          2HE       MET  33   3.578  -4.450   1.718
  649   3HE   MET  33          3HE       MET  33   4.909  -4.466   2.887
  650    H    MET  34           H        MET  34   0.915  -7.529   2.334
  651    HA   MET  34           HA       MET  34   1.098  -5.824   0.059
  652   1HB   MET  34          1HB       MET  34   2.195  -8.157   0.878
  653   2HB   MET  34          2HB       MET  34   1.040  -8.780  -0.301
  654   1HG   MET  34          1HG       MET  34   3.042  -6.575  -0.867
  655   2HG   MET  34          2HG       MET  34   3.272  -8.267  -1.307
  656   1HE   MET  34          1HE       MET  34   2.620  -5.077  -2.652
  657   2HE   MET  34          2HE       MET  34   3.591  -6.281  -3.512
  658   3HE   MET  34          3HE       MET  34   2.165  -5.583  -4.277
  659    H    GLN  35           H        GLN  35  -1.050  -8.666   0.560
  660    HA   GLN  35           HA       GLN  35  -2.559  -8.440  -1.817
  661   1HB   GLN  35          1HB       GLN  35  -4.300  -9.634  -0.447
  662   2HB   GLN  35          2HB       GLN  35  -2.689 -10.334  -0.284
  663   1HG   GLN  35          1HG       GLN  35  -2.366  -9.400   1.856
  664   2HG   GLN  35          2HG       GLN  35  -3.658  -8.220   1.634
  665   2HE2  GLN  35          2HE2      GLN  35  -4.715  -9.028   3.627
  666   1HE2  GLN  35          1HE2      GLN  35  -5.565 -10.498   3.611
  667    H    HIS  36           H        HIS  36  -2.620  -6.503   1.092
  668    HA   HIS  36           HA       HIS  36  -5.210  -5.253   0.543
  669   1HB   HIS  36          1HB       HIS  36  -2.992  -5.101   2.524
  670   2HB   HIS  36          2HB       HIS  36  -3.993  -3.658   2.355
  671    HD1  HIS  36           HD1      HIS  36  -5.466  -7.063   1.812
  672    HD2  HIS  36           HD2      HIS  36  -5.365  -4.165   4.808
  673    HE1  HIS  36           HE1      HIS  36  -7.204  -7.743   3.524
  674    H    ALA  37           H        ALA  37  -1.818  -4.058   0.547
  675    HA   ALA  37           HA       ALA  37  -2.211  -1.509  -0.555
  676   1HB   ALA  37          1HB       ALA  37  -0.087  -3.503  -0.284
  677   2HB   ALA  37          3HB       ALA  37   0.012  -1.749  -0.140
  678   3HB   ALA  37          2HB       ALA  37   0.124  -2.511  -1.726
  679    H    GLN  38           H        GLN  38  -2.101  -4.654  -2.185
  680    HA   GLN  38           HA       GLN  38  -2.172  -3.607  -4.890
  681   1HB   GLN  38          1HB       GLN  38  -2.693  -6.239  -3.508
  682   2HB   GLN  38          2HB       GLN  38  -3.014  -6.063  -5.234
  683   1HG   GLN  38          1HG       GLN  38  -0.625  -5.116  -5.403
  684   2HG   GLN  38          2HG       GLN  38  -0.380  -5.778  -3.786
  685   2HE2  GLN  38          2HE2      GLN  38  -1.359  -6.744  -7.105
  686   1HE2  GLN  38          1HE2      GLN  38  -0.850  -8.355  -6.951
  687    H    ASN  39           H        ASN  39  -4.601  -4.629  -2.517
  688    HA   ASN  39           HA       ASN  39  -6.813  -4.027  -4.410
  689   1HB   ASN  39          1HB       ASN  39  -6.503  -5.340  -1.711
  690   2HB   ASN  39          2HB       ASN  39  -8.099  -4.881  -2.303
  691   2HD2  ASN  39          2HD2      ASN  39  -9.120  -6.531  -3.433
  692   1HD2  ASN  39          1HD2      ASN  39  -8.331  -7.745  -4.318
  693    H    LEU  40           H        LEU  40  -4.976  -1.965  -3.122
  694    HA   LEU  40           HA       LEU  40  -5.184   0.177  -2.167
  695   1HB   LEU  40          1HB       LEU  40  -7.889  -0.523  -3.275
  696   2HB   LEU  40          2HB       LEU  40  -7.688   0.985  -2.384
  697    HG   LEU  40           HG       LEU  40  -5.493   1.018  -4.033
  698   1HD1  LEU  40          1HD1      LEU  40  -7.746  -0.470  -5.366
  699   2HD1  LEU  40          2HD1      LEU  40  -6.675   0.559  -6.318
  700   3HD1  LEU  40          3HD1      LEU  40  -6.014  -0.806  -5.416
  701   1HD2  LEU  40          1HD2      LEU  40  -8.038   2.367  -3.769
  702   2HD2  LEU  40          2HD2      LEU  40  -6.490   3.022  -4.304
  703   3HD2  LEU  40          3HD2      LEU  40  -7.579   2.271  -5.470
  704    H    GLU  41           H        GLU  41  -5.147  -1.919  -0.277
  705    HA   GLU  41           HA       GLU  41  -7.031  -0.855   1.803
  706   1HB   GLU  41          1HB       GLU  41  -6.122  -3.691   1.230
  707   2HB   GLU  41          2HB       GLU  41  -7.048  -3.227   2.656
  708   1HG   GLU  41          1HG       GLU  41  -8.139  -2.313   0.053
  709   2HG   GLU  41          2HG       GLU  41  -8.206  -4.050   0.351
  710    H    PHE  42           H        PHE  42  -4.023  -0.518   0.983
  711    HA   PHE  42           HA       PHE  42  -2.332  -1.601   2.972
  712   1HB   PHE  42          1HB       PHE  42  -0.885   0.359   2.309
  713   2HB   PHE  42          2HB       PHE  42  -1.484  -0.594   0.956
  714    HD1  PHE  42           HD1      PHE  42  -2.448   2.382   3.057
  715    HD2  PHE  42           HD2      PHE  42  -2.536   0.512  -0.839
  716    HE1  PHE  42           HE1      PHE  42  -3.524   4.413   2.099
  717    HE2  PHE  42           HE2      PHE  42  -3.603   2.535  -1.781
  718    HZ   PHE  42           HZ       PHE  42  -4.097   4.492  -0.321
  719    H    GLU  43           H        GLU  43  -4.832   0.732   3.416
  720    HA   GLU  43           HA       GLU  43  -3.807   2.556   5.279
  721   1HB   GLU  43          1HB       GLU  43  -6.108   2.550   4.437
  722   2HB   GLU  43          2HB       GLU  43  -6.431   1.022   5.257
  723   1HG   GLU  43          1HG       GLU  43  -5.610   2.400   7.383
  724   2HG   GLU  43          2HG       GLU  43  -6.147   3.766   6.406
  725    H    GLU  44           H        GLU  44  -5.518  -0.414   6.261
  726    HA   GLU  44           HA       GLU  44  -4.128  -0.460   8.851
  727   1HB   GLU  44          1HB       GLU  44  -5.579  -2.463   9.166
  728   2HB   GLU  44          2HB       GLU  44  -6.501  -1.072   8.596
  729   1HG   GLU  44          1HG       GLU  44  -6.752  -1.946   6.447
  730   2HG   GLU  44          2HG       GLU  44  -5.336  -2.987   6.598
  731    H    ALA  45           H        ALA  45  -3.691  -1.822   5.690
  732    HA   ALA  45           HA       ALA  45  -2.158  -4.163   6.488
  733   1HB   ALA  45          1HB       ALA  45  -3.198  -2.837   4.103
  734   2HB   ALA  45          3HB       ALA  45  -1.581  -3.489   3.834
  735   3HB   ALA  45          2HB       ALA  45  -2.881  -4.549   4.380
  736    H    ALA  46           H        ALA  46  -1.223  -1.090   4.894
  737    HA   ALA  46           HA       ALA  46   1.518  -1.346   4.707
  738   1HB   ALA  46          1HB       ALA  46   1.499   1.172   5.148
  739   2HB   ALA  46          3HB       ALA  46   0.389   0.602   3.901
  740   3HB   ALA  46          2HB       ALA  46  -0.216   0.997   5.511
  741    H    GLN  47           H        GLN  47  -0.329  -0.834   7.678
  742    HA   GLN  47           HA       GLN  47   1.733   0.000   9.427
  743   1HB   GLN  47          2HB       GLN  47  -0.578  -1.911   9.908
  744   2HB   GLN  47          1HB       GLN  47   0.283  -1.007  11.155
  745   1HG   GLN  47          1HG       GLN  47  -0.352   1.067   9.634
  746   2HG   GLN  47          2HG       GLN  47  -1.631  -0.012   9.077
  747   2HE2  GLN  47          2HE2      GLN  47  -0.159   0.478  12.339
  748   1HE2  GLN  47          1HE2      GLN  47  -1.635   0.780  13.119
  749    H    ILE  48           H        ILE  48   0.973  -3.206   8.134
  750    HA   ILE  48           HA       ILE  48   2.477  -4.887   9.808
  751    HB   ILE  48           HB       ILE  48   2.092  -4.867   6.798
  752   1HG1  ILE  48          2HG1      ILE  48   0.008  -4.907   8.105
  753   2HG1  ILE  48          1HG1      ILE  48   0.272  -6.468   7.328
  754   1HG2  ILE  48          1HG2      ILE  48   3.666  -6.610   8.488
  755   2HG2  ILE  48          2HG2      ILE  48   2.336  -7.506   7.756
  756   3HG2  ILE  48          3HG2      ILE  48   3.480  -6.638   6.735
  757   1HD1  ILE  48          1HD1      ILE  48   1.511  -7.036   9.593
  758   2HD1  ILE  48          2HD1      ILE  48   0.509  -5.729  10.225
  759   3HD1  ILE  48          3HD1      ILE  48  -0.247  -7.144   9.491
  760    H    ARG  49           H        ARG  49   3.574  -2.676   7.279
  761    HA   ARG  49           HA       ARG  49   6.226  -3.458   6.855
  762   1HB   ARG  49          1HB       ARG  49   5.279  -1.633   5.652
  763   2HB   ARG  49          2HB       ARG  49   4.835  -0.783   7.126
  764   1HG   ARG  49          1HG       ARG  49   7.669  -1.192   7.167
  765   2HG   ARG  49          2HG       ARG  49   7.234  -0.532   5.594
  766   1HD   ARG  49          1HD       ARG  49   7.675   1.273   7.259
  767   2HD   ARG  49          2HD       ARG  49   5.991   1.304   6.700
  768    HE   ARG  49           HE       ARG  49   5.476  -0.084   8.794
  769   1HH1  ARG  49          1HH1      ARG  49   8.518  -0.101   9.449
  770   2HH1  ARG  49          2HH1      ARG  49   8.553   1.047  10.746
  771   1HH2  ARG  49          1HH2      ARG  49   5.388   2.296  10.077
  772   2HH2  ARG  49          2HH2      ARG  49   6.780   2.404  11.101
  773    H    ASP  50           H        ASP  50   4.795  -1.966   9.709
  774    HA   ASP  50           HA       ASP  50   7.264  -1.233  11.023
  775   1HB   ASP  50          1HB       ASP  50   4.880  -0.444  11.478
  776   2HB   ASP  50          2HB       ASP  50   4.602  -2.001  12.259
  777    H    GLN  51           H        GLN  51   5.181  -4.121  11.070
  778    HA   GLN  51           HA       GLN  51   6.860  -5.524  13.024
  779   1HB   GLN  51          2HB       GLN  51   4.685  -6.521  11.151
  780   2HB   GLN  51          1HB       GLN  51   5.252  -7.321  12.617
  781   1HG   GLN  51          1HG       GLN  51   4.447  -5.461  13.986
  782   2HG   GLN  51          2HG       GLN  51   3.959  -4.578  12.537
  783   2HE2  GLN  51          2HE2      GLN  51   3.515  -8.041  13.458
  784   1HE2  GLN  51          1HE2      GLN  51   1.829  -8.024  13.274
  785    H    LEU  52           H        LEU  52   6.532  -5.353   9.518
  786    HA   LEU  52           HA       LEU  52   8.040  -7.696   8.829
  787   1HB   LEU  52          1HB       LEU  52   6.883  -5.313   7.600
  788   2HB   LEU  52          2HB       LEU  52   8.405  -5.766   6.833
  789    HG   LEU  52           HG       LEU  52   6.452  -6.888   5.772
  790   1HD1  LEU  52          1HD1      LEU  52   8.793  -8.192   6.932
  791   2HD1  LEU  52          2HD1      LEU  52   7.466  -9.326   6.679
  792   3HD1  LEU  52          3HD1      LEU  52   8.088  -8.381   5.326
  793   1HD2  LEU  52          1HD2      LEU  52   5.539  -7.130   8.376
  794   2HD2  LEU  52          2HD2      LEU  52   4.866  -7.972   6.981
  795   3HD2  LEU  52          3HD2      LEU  52   6.065  -8.770   7.997
  796    H    HIS  53           H        HIS  53   8.992  -4.304   9.386
  797    HA   HIS  53           HA       HIS  53  11.790  -4.732   8.720
  798   1HB   HIS  53          1HB       HIS  53  10.173  -2.600   8.893
  799   2HB   HIS  53          2HB       HIS  53  10.862  -2.529  10.515
  800    HD1  HIS  53           HD1      HIS  53  13.648  -2.784  10.479
  801    HD2  HIS  53           HD2      HIS  53  11.786  -1.357   7.032
  802    HE1  HIS  53           HE1      HIS  53  15.443  -1.618   9.125
  803    H    GLN  54           H        GLN  54   9.912  -4.614  11.747
  804    HA   GLN  54           HA       GLN  54  12.132  -4.778  13.554
  805   1HB   GLN  54          1HB       GLN  54   9.770  -4.124  14.071
  806   2HB   GLN  54          2HB       GLN  54   9.290  -5.807  13.844
  807   1HG   GLN  54          1HG       GLN  54  10.017  -6.376  15.902
  808   2HG   GLN  54          2HG       GLN  54  11.571  -5.582  15.641
  809   2HE2  GLN  54          2HE2      GLN  54  11.805  -3.364  16.359
  810   1HE2  GLN  54          1HE2      GLN  54  10.639  -2.606  17.331
  811    H    LEU  55           H        LEU  55   9.933  -7.344  12.341
  812    HA   LEU  55           HA       LEU  55  11.294  -9.535  13.572
  813   1HB   LEU  55          1HB       LEU  55   9.379  -9.084  11.314
  814   2HB   LEU  55          2HB       LEU  55  10.122 -10.678  11.464
  815    HG   LEU  55           HG       LEU  55   9.257  -9.746  14.058
  816   1HD1  LEU  55          1HD1      LEU  55   7.420  -9.313  11.771
  817   2HD1  LEU  55          2HD1      LEU  55   6.730 -10.177  13.145
  818   3HD1  LEU  55          3HD1      LEU  55   7.422  -8.570  13.372
  819   1HD2  LEU  55          1HD2      LEU  55   8.695 -12.067  12.215
  820   2HD2  LEU  55          2HD2      LEU  55   9.570 -12.062  13.747
  821   3HD2  LEU  55          3HD2      LEU  55   7.814 -11.891  13.732
  822    H    ARG  56           H        ARG  56  11.835  -7.823  10.524
  823    HA   ARG  56           HA       ARG  56  13.570  -9.681   9.243
  824   1HB   ARG  56          1HB       ARG  56  12.564  -7.695   8.195
  825   2HB   ARG  56          2HB       ARG  56  13.517  -6.644   9.244
  826   1HG   ARG  56          1HG       ARG  56  15.475  -8.220   8.173
  827   2HG   ARG  56          2HG       ARG  56  14.336  -8.134   6.828
  828   1HD   ARG  56          1HD       ARG  56  14.308  -5.624   7.099
  829   2HD   ARG  56          2HD       ARG  56  15.620  -5.799   8.282
  830    HE   ARG  56           HE       ARG  56  16.322  -7.293   5.965
  831   1HH1  ARG  56          1HH1      ARG  56  15.098  -4.697   4.849
  832   2HH1  ARG  56          2HH1      ARG  56  16.521  -3.727   4.666
  833   1HH2  ARG  56          1HH2      ARG  56  18.489  -5.768   6.662
  834   2HH2  ARG  56          2HH2      ARG  56  18.441  -4.333   5.692
  835    H    GLU  57           H        GLU  57  14.342  -6.962  11.444
  836    HA   GLU  57           HA       GLU  57  17.147  -7.162  11.468
  837   1HB   GLU  57          1HB       GLU  57  15.710  -5.426  12.549
  838   2HB   GLU  57          2HB       GLU  57  15.271  -6.602  13.788
  839   1HG   GLU  57          2HG       GLU  57  17.047  -5.508  14.824
  840   2HG   GLU  57          1HG       GLU  57  17.884  -6.854  14.049
  841    H    LEU  58           H        LEU  58  14.741  -9.154  13.136
  842    HA   LEU  58           HA       LEU  58  16.667 -10.554  14.812
  843   1HB   LEU  58          1HB       LEU  58  13.775 -10.785  14.036
  844   2HB   LEU  58          2HB       LEU  58  14.542 -12.131  14.880
  845    HG   LEU  58           HG       LEU  58  14.890  -9.342  15.937
  846   1HD1  LEU  58          1HD1      LEU  58  12.432 -11.076  16.111
  847   2HD1  LEU  58          2HD1      LEU  58  12.852  -9.982  17.429
  848   3HD1  LEU  58          3HD1      LEU  58  12.541  -9.341  15.816
  849   1HD2  LEU  58          1HD2      LEU  58  16.078 -11.499  16.757
  850   2HD2  LEU  58          2HD2      LEU  58  15.332 -10.461  17.972
  851   3HD2  LEU  58          3HD2      LEU  58  14.511 -11.929  17.444
  852    H    PHE  59           H        PHE  59  15.227 -11.089  11.623
  853    HA   PHE  59           HA       PHE  59  15.870 -13.802  11.192
  854   1HB   PHE  59          1HB       PHE  59  14.550 -12.214   9.743
  855   2HB   PHE  59          2HB       PHE  59  16.080 -11.509   9.217
  856    HD1  PHE  59           HD1      PHE  59  14.219 -14.760   9.420
  857    HD2  PHE  59           HD2      PHE  59  17.326 -12.492   7.460
  858    HE1  PHE  59           HE1      PHE  59  14.476 -16.573   7.728
  859    HE2  PHE  59           HE2      PHE  59  17.583 -14.305   5.768
  860    HZ   PHE  59           HZ       PHE  59  16.158 -16.345   5.902
  861    H    ILE  60           H        ILE  60  17.902 -10.907  10.655
  862    HA   ILE  60           HA       ILE  60  20.189 -12.264   9.610
  863    HB   ILE  60           HB       ILE  60  19.874  -9.709  11.220
  864   1HG1  ILE  60          1HG1      ILE  60  20.163 -10.085   8.227
  865   2HG1  ILE  60          2HG1      ILE  60  18.597  -9.964   9.031
  866   1HG2  ILE  60          1HG2      ILE  60  22.218 -10.584  11.168
  867   2HG2  ILE  60          2HG2      ILE  60  22.148 -10.568   9.405
  868   3HG2  ILE  60          3HG2      ILE  60  22.037  -9.056  10.306
  869   1HD1  ILE  60          1HD1      ILE  60  20.785  -7.880   9.262
  870   2HD1  ILE  60          2HD1      ILE  60  19.433  -7.771   8.135
  871   3HD1  ILE  60          3HD1      ILE  60  19.135  -7.754   9.874
  872    H    ALA  61           H        ALA  61  19.269 -11.425  12.954
  873    HA   ALA  61           HA       ALA  61  21.666 -12.284  14.243
  874   1HB   ALA  61          1HB       ALA  61  19.615 -10.951  15.084
  875   2HB   ALA  61          3HB       ALA  61  20.349 -12.089  16.214
  876   3HB   ALA  61          2HB       ALA  61  18.868 -12.523  15.361
  877    H    ALA  62           H        ALA  62  19.038 -14.082  12.827
  878    HA   ALA  62           HA       ALA  62  19.923 -16.590  14.189
  879   1HB   ALA  62          1HB       ALA  62  17.616 -16.660  12.368
  880   2HB   ALA  62          3HB       ALA  62  17.449 -15.470  13.658
  881   3HB   ALA  62          2HB       ALA  62  17.726 -17.166  14.054
  882    H    SER  63           H        SER  63  18.874 -15.583  10.904
  883    HA   SER  63           HA       SER  63  20.412 -17.792   9.699
  884   1HB   SER  63          1HB       SER  63  18.119 -17.045   8.983
  885   2HB   SER  63          2HB       SER  63  18.828 -15.524   8.449
  886    HG   SER  63           HG       SER  63  20.227 -16.835   7.106

  No H/Q in entry =         886
  Start of MODEL   11
    1    H    LEU   8           H        LEU   8 -26.733   1.702  -6.483
    2    HA   LEU   8           HA       LEU   8 -27.167   2.603  -8.923
    3   1HB   LEU   8          1HB       LEU   8 -25.346   3.490  -6.776
    4   2HB   LEU   8          2HB       LEU   8 -25.024   4.229  -8.345
    5    HG   LEU   8           HG       LEU   8 -27.871   4.145  -7.861
    6   1HD1  LEU   8          1HD1      LEU   8 -27.048   4.167  -5.466
    7   2HD1  LEU   8          2HD1      LEU   8 -26.271   5.711  -5.820
    8   3HD1  LEU   8          3HD1      LEU   8 -28.027   5.563  -5.919
    9   1HD2  LEU   8          1HD2      LEU   8 -25.738   6.188  -8.419
   10   2HD2  LEU   8          2HD2      LEU   8 -27.116   5.722  -9.415
   11   3HD2  LEU   8          3HD2      LEU   8 -27.360   6.726  -7.985
   12    H    GLU   9           H        GLU   9 -26.524   1.778 -10.883
   13    HA   GLU   9           HA       GLU   9 -23.594   1.527 -11.404
   14   1HB   GLU   9          1HB       GLU   9 -25.005  -0.631 -10.745
   15   2HB   GLU   9          2HB       GLU   9 -25.495  -0.547 -12.438
   16   1HG   GLU   9          1HG       GLU   9 -22.893  -0.228 -12.833
   17   2HG   GLU   9          2HG       GLU   9 -22.782  -1.046 -11.273
   18    HA   PRO  10           HA       PRO  10 -26.022   3.617 -14.789
   19   1HB   PRO  10          1HB       PRO  10 -24.463   5.860 -14.941
   20   2HB   PRO  10          2HB       PRO  10 -25.849   5.720 -13.841
   21   1HG   PRO  10          2HG       PRO  10 -22.943   5.443 -13.269
   22   2HG   PRO  10          1HG       PRO  10 -24.222   6.177 -12.291
   23   1HD   PRO  10          1HD       PRO  10 -23.197   3.687 -11.827
   24   2HD   PRO  10          2HD       PRO  10 -24.842   4.181 -11.369
   25    H    ASP  11           H        ASP  11 -22.472   3.798 -14.332
   26    HA   ASP  11           HA       ASP  11 -20.701   3.215 -15.775
   27   1HB   ASP  11          1HB       ASP  11 -22.906   1.373 -16.184
   28   2HB   ASP  11          2HB       ASP  11 -22.004   1.595 -17.683
   29    H    ASN  12           H        ASN  12 -23.248   2.983 -18.232
   30    HA   ASN  12           HA       ASN  12 -22.314   5.560 -19.426
   31   1HB   ASN  12          1HB       ASN  12 -21.217   3.326 -20.266
   32   2HB   ASN  12          2HB       ASN  12 -22.755   3.097 -21.100
   33   2HD2  ASN  12          2HD2      ASN  12 -23.461   5.488 -22.112
   34   1HD2  ASN  12          1HD2      ASN  12 -22.240   6.168 -23.077
   35    H    VAL  13           H        VAL  13 -24.837   4.457 -18.054
   36    HA   VAL  13           HA       VAL  13 -26.860   4.331 -20.148
   37    HB   VAL  13           HB       VAL  13 -26.674   4.270 -17.163
   38   1HG1  VAL  13          1HG1      VAL  13 -29.107   5.144 -18.692
   39   2HG1  VAL  13          2HG1      VAL  13 -29.312   4.100 -17.286
   40   3HG1  VAL  13          3HG1      VAL  13 -28.536   5.674 -17.109
   41   1HG2  VAL  13          1HG2      VAL  13 -27.602   2.560 -19.416
   42   2HG2  VAL  13          2HG2      VAL  13 -26.654   2.130 -17.992
   43   3HG2  VAL  13          3HG2      VAL  13 -28.400   2.344 -17.858
   44    HA   PRO  14           HA       PRO  14 -27.933   8.744 -18.702
   45   1HB   PRO  14          1HB       PRO  14 -26.342   9.968 -16.846
   46   2HB   PRO  14          2HB       PRO  14 -27.734   8.958 -16.405
   47   1HG   PRO  14          2HG       PRO  14 -24.836   8.301 -16.379
   48   2HG   PRO  14          1HG       PRO  14 -26.118   7.814 -15.259
   49   1HD   PRO  14          1HD       PRO  14 -25.096   6.194 -17.219
   50   2HD   PRO  14          2HD       PRO  14 -26.723   6.030 -16.526
   51    H    MET  15           H        MET  15 -24.391   8.345 -18.356
   52    HA   MET  15           HA       MET  15 -22.614   9.352 -19.534
   53   1HB   MET  15          1HB       MET  15 -23.952   8.097 -21.296
   54   2HB   MET  15          2HB       MET  15 -24.732   9.631 -21.684
   55   1HG   MET  15          1HG       MET  15 -22.897   9.394 -23.213
   56   2HG   MET  15          2HG       MET  15 -22.409  10.600 -22.023
   57   1HE   MET  15          1HE       MET  15 -20.242  10.557 -22.591
   58   2HE   MET  15          2HE       MET  15 -19.007   9.387 -22.127
   59   3HE   MET  15          3HE       MET  15 -19.905   9.179 -23.637
   60    H    ASP  16           H        ASP  16 -22.293  11.325 -18.426
   61    HA   ASP  16           HA       ASP  16 -23.927  13.655 -19.330
   62   1HB   ASP  16          1HB       ASP  16 -24.108  13.151 -16.970
   63   2HB   ASP  16          2HB       ASP  16 -22.354  13.080 -16.812
   64    H    MET  17           H        MET  17 -20.867  13.926 -17.699
   65    HA   MET  17           HA       MET  17 -19.184  14.305 -20.003
   66   1HB   MET  17          2HB       MET  17 -19.139  16.784 -19.971
   67   2HB   MET  17          1HB       MET  17 -20.756  16.184 -20.336
   68   1HG   MET  17          1HG       MET  17 -21.440  16.514 -18.013
   69   2HG   MET  17          2HG       MET  17 -19.809  17.023 -17.581
   70   1HE   MET  17          1HE       MET  17 -21.992  18.602 -16.693
   71   2HE   MET  17          2HE       MET  17 -20.454  19.458 -16.629
   72   3HE   MET  17          3HE       MET  17 -21.876  20.265 -17.283
   73    H    SER  18           H        SER  18 -19.859  15.123 -16.618
   74    HA   SER  18           HA       SER  18 -18.419  15.211 -14.750
   75   1HB   SER  18          1HB       SER  18 -16.358  13.964 -16.577
   76   2HB   SER  18          2HB       SER  18 -16.542  13.746 -14.839
   77    HG   SER  18           HG       SER  18 -17.607  12.318 -16.798
   78    HA   PRO  19           HA       PRO  19 -16.054  18.854 -15.308
   79   1HB   PRO  19          1HB       PRO  19 -14.244  18.692 -13.263
   80   2HB   PRO  19          2HB       PRO  19 -15.962  19.063 -13.010
   81   1HG   PRO  19          2HG       PRO  19 -14.518  16.479 -12.678
   82   2HG   PRO  19          1HG       PRO  19 -15.787  17.198 -11.673
   83   1HD   PRO  19          1HD       PRO  19 -16.256  15.212 -13.465
   84   2HD   PRO  19          2HD       PRO  19 -17.471  16.435 -13.030
   85    H    LYS  20           H        LYS  20 -14.576  15.796 -15.552
   86    HA   LYS  20           HA       LYS  20 -12.713  15.049 -16.787
   87   1HB   LYS  20          1HB       LYS  20 -13.790  16.903 -18.280
   88   2HB   LYS  20          2HB       LYS  20 -12.407  17.878 -17.784
   89   1HG   LYS  20          1HG       LYS  20 -12.225  15.134 -19.066
   90   2HG   LYS  20          2HG       LYS  20 -11.970  16.664 -19.908
   91   1HD   LYS  20          1HD       LYS  20 -10.276  17.033 -17.852
   92   2HD   LYS  20          2HD       LYS  20 -10.225  15.272 -17.938
   93   1HE   LYS  20          1HE       LYS  20  -9.991  15.832 -20.574
   94   2HE   LYS  20          2HE       LYS  20  -9.229  17.284 -19.894
   95   1HZ   LYS  20          1HZ       LYS  20  -7.973  15.761 -18.391
   96   2HZ   LYS  20          2HZ       LYS  20  -8.557  14.454 -19.299
   97   3HZ   LYS  20          3HZ       LYS  20  -7.557  15.615 -20.032
   98    H    ALA  21           H        ALA  21 -11.764  18.445 -16.066
   99    HA   ALA  21           HA       ALA  21  -9.074  18.031 -15.479
  100   1HB   ALA  21          1HB       ALA  21 -10.753  20.117 -15.456
  101   2HB   ALA  21          2HB       ALA  21  -9.195  20.185 -14.633
  102   3HB   ALA  21          3HB       ALA  21 -10.664  19.850 -13.716
  103    H    LEU  22           H        LEU  22 -11.735  17.981 -13.088
  104    HA   LEU  22           HA       LEU  22 -10.113  17.066 -10.885
  105   1HB   LEU  22          1HB       LEU  22 -12.316  18.259 -10.801
  106   2HB   LEU  22          2HB       LEU  22 -13.091  16.819 -11.442
  107    HG   LEU  22           HG       LEU  22 -11.497  16.852  -8.864
  108   1HD1  LEU  22          1HD1      LEU  22 -14.472  17.072  -9.379
  109   2HD1  LEU  22          2HD1      LEU  22 -13.753  16.808  -7.789
  110   3HD1  LEU  22          3HD1      LEU  22 -13.443  18.312  -8.659
  111   1HD2  LEU  22          1HD2      LEU  22 -13.188  14.839 -10.336
  112   2HD2  LEU  22          2HD2      LEU  22 -11.636  14.606  -9.531
  113   3HD2  LEU  22          3HD2      LEU  22 -13.108  14.779  -8.574
  114    H    GLN  23           H        GLN  23 -12.750  15.300 -12.512
  115    HA   GLN  23           HA       GLN  23 -12.251  12.708 -11.696
  116   1HB   GLN  23          1HB       GLN  23 -14.118  13.474 -13.111
  117   2HB   GLN  23          2HB       GLN  23 -13.011  13.692 -14.467
  118   1HG   GLN  23          1HG       GLN  23 -12.419  11.149 -13.927
  119   2HG   GLN  23          2HG       GLN  23 -14.048  11.164 -13.253
  120   2HE2  GLN  23          2HE2      GLN  23 -15.369  10.235 -14.838
  121   1HE2  GLN  23          1HE2      GLN  23 -15.370  10.680 -16.476
  122    H    GLN  24           H        GLN  24 -10.388  14.534 -14.080
  123    HA   GLN  24           HA       GLN  24  -8.884  12.204 -15.025
  124   1HB   GLN  24          1HB       GLN  24  -9.403  14.257 -16.360
  125   2HB   GLN  24          2HB       GLN  24  -8.357  15.183 -15.283
  126   1HG   GLN  24          1HG       GLN  24  -7.159  12.723 -16.426
  127   2HG   GLN  24          2HG       GLN  24  -7.480  14.022 -17.576
  128   2HE2  GLN  24          2HE2      GLN  24  -4.894  12.950 -16.148
  129   1HE2  GLN  24          1HE2      GLN  24  -4.150  14.373 -15.598
  130    H    LYS  25           H        LYS  25  -8.465  14.747 -12.605
  131    HA   LYS  25           HA       LYS  25  -5.659  14.225 -12.087
  132   1HB   LYS  25          1HB       LYS  25  -7.934  15.743 -10.872
  133   2HB   LYS  25          2HB       LYS  25  -6.504  15.465  -9.878
  134   1HG   LYS  25          1HG       LYS  25  -5.169  16.807 -11.176
  135   2HG   LYS  25          2HG       LYS  25  -6.028  16.402 -12.662
  136   1HD   LYS  25          2HD       LYS  25  -7.128  18.357 -12.495
  137   2HD   LYS  25          1HD       LYS  25  -7.900  17.746 -11.032
  138   1HE   LYS  25          1HE       LYS  25  -6.441  18.876  -9.624
  139   2HE   LYS  25          2HE       LYS  25  -5.116  18.843 -10.805
  140   1HZ   LYS  25          1HZ       LYS  25  -6.383  20.359 -12.208
  141   2HZ   LYS  25          2HZ       LYS  25  -7.623  20.423 -11.047
  142   3HZ   LYS  25          3HZ       LYS  25  -6.090  21.052 -10.685
  143    H    ILE  26           H        ILE  26  -8.669  13.356 -10.341
  144    HA   ILE  26           HA       ILE  26  -7.455  11.821  -8.273
  145    HB   ILE  26           HB       ILE  26 -10.145  11.599  -9.661
  146   1HG1  ILE  26          1HG1      ILE  26  -9.289  13.047  -7.133
  147   2HG1  ILE  26          2HG1      ILE  26  -9.628  13.821  -8.681
  148   1HG2  ILE  26          1HG2      ILE  26  -9.466   9.587  -8.289
  149   2HG2  ILE  26          2HG2      ILE  26  -9.367  10.655  -6.889
  150   3HG2  ILE  26          3HG2      ILE  26 -10.912  10.412  -7.705
  151   1HD1  ILE  26          1HD1      ILE  26 -11.935  12.741  -8.572
  152   2HD1  ILE  26          2HD1      ILE  26 -11.563  12.329  -6.898
  153   3HD1  ILE  26          3HD1      ILE  26 -11.636  14.020  -7.394
  154    H    HIS  27           H        HIS  27  -8.741  10.792 -11.452
  155    HA   HIS  27           HA       HIS  27  -8.265   8.006 -11.193
  156   1HB   HIS  27          1HB       HIS  27  -9.392   9.623 -13.011
  157   2HB   HIS  27          2HB       HIS  27  -7.835   9.393 -13.804
  158    HD1  HIS  27           HD1      HIS  27  -7.321   6.446 -12.940
  159    HD2  HIS  27           HD2      HIS  27 -10.922   7.830 -14.518
  160    HE1  HIS  27           HE1      HIS  27  -8.502   4.425 -13.909
  161    H    GLU  28           H        GLU  28  -6.041  10.648 -11.730
  162    HA   GLU  28           HA       GLU  28  -3.879   8.985 -12.797
  163   1HB   GLU  28          1HB       GLU  28  -4.194  11.817 -11.789
  164   2HB   GLU  28          2HB       GLU  28  -2.622  11.184 -12.278
  165   1HG   GLU  28          1HG       GLU  28  -5.043  10.993 -14.074
  166   2HG   GLU  28          2HG       GLU  28  -3.984  12.404 -14.085
  167    H    LEU  29           H        LEU  29  -4.836  10.260  -9.627
  168    HA   LEU  29           HA       LEU  29  -2.376   9.417  -8.294
  169   1HB   LEU  29          1HB       LEU  29  -5.115  10.355  -7.396
  170   2HB   LEU  29          2HB       LEU  29  -3.799  10.018  -6.270
  171    HG   LEU  29           HG       LEU  29  -3.289  11.835  -8.601
  172   1HD1  LEU  29          1HD1      LEU  29  -4.909  12.444  -6.140
  173   2HD1  LEU  29          2HD1      LEU  29  -3.898  13.697  -6.858
  174   3HD1  LEU  29          3HD1      LEU  29  -5.186  12.954  -7.806
  175   1HD2  LEU  29          1HD2      LEU  29  -1.743  10.874  -6.553
  176   2HD2  LEU  29          2HD2      LEU  29  -1.419  12.378  -7.414
  177   3HD2  LEU  29          3HD2      LEU  29  -2.287  12.410  -5.881
  178    H    GLU  30           H        GLU  30  -5.683   8.137  -8.624
  179    HA   GLU  30           HA       GLU  30  -5.560   6.003  -6.776
  180   1HB   GLU  30          1HB       GLU  30  -7.383   6.993  -8.467
  181   2HB   GLU  30          2HB       GLU  30  -6.854   5.624  -9.446
  182   1HG   GLU  30          1HG       GLU  30  -7.113   4.402  -7.040
  183   2HG   GLU  30          2HG       GLU  30  -8.352   5.648  -6.885
  184    H    GLY  31           H        GLY  31  -4.566   6.060 -10.215
  185   1HA   GLY  31          2HA       GLY  31  -3.266   4.534 -11.444
  186   2HA   GLY  31          1HA       GLY  31  -3.693   3.310 -10.246
  187    H    LEU  32           H        LEU  32  -2.190   6.336  -9.315
  188    HA   LEU  32           HA       LEU  32   0.553   5.618  -9.429
  189   1HB   LEU  32          1HB       LEU  32  -0.995   7.750  -8.626
  190   2HB   LEU  32          2HB       LEU  32  -0.320   7.193  -7.096
  191    HG   LEU  32           HG       LEU  32   1.950   7.284  -8.058
  192   1HD1  LEU  32          1HD1      LEU  32   0.448   7.443 -10.508
  193   2HD1  LEU  32          2HD1      LEU  32   1.497   8.854 -10.380
  194   3HD1  LEU  32          3HD1      LEU  32   2.186   7.232 -10.296
  195   1HD2  LEU  32          1HD2      LEU  32   0.296   9.808  -8.374
  196   2HD2  LEU  32          2HD2      LEU  32   1.150   9.281  -6.924
  197   3HD2  LEU  32          3HD2      LEU  32   2.059   9.779  -8.350
  198    H    MET  33           H        MET  33  -1.860   5.073  -6.853
  199    HA   MET  33           HA       MET  33  -0.169   3.985  -4.863
  200   1HB   MET  33          1HB       MET  33  -3.036   3.739  -5.695
  201   2HB   MET  33          2HB       MET  33  -2.436   2.641  -4.452
  202   1HG   MET  33          1HG       MET  33  -2.199   4.307  -2.908
  203   2HG   MET  33          2HG       MET  33  -1.678   5.485  -4.112
  204   1HE   MET  33          1HE       MET  33  -4.466   3.043  -4.019
  205   2HE   MET  33          2HE       MET  33  -4.995   3.731  -2.487
  206   3HE   MET  33          3HE       MET  33  -5.977   3.959  -3.932
  207    H    MET  34           H        MET  34  -1.800   2.358  -7.592
  208    HA   MET  34           HA       MET  34  -1.196  -0.323  -7.053
  209   1HB   MET  34          1HB       MET  34  -2.439   0.957  -8.998
  210   2HB   MET  34          2HB       MET  34  -0.878   0.827  -9.811
  211   1HG   MET  34          1HG       MET  34  -1.558  -1.234 -10.450
  212   2HG   MET  34          2HG       MET  34  -1.248  -1.716  -8.781
  213   1HE   MET  34          1HE       MET  34  -2.461  -2.023  -7.168
  214   2HE   MET  34          2HE       MET  34  -4.179  -1.710  -6.884
  215   3HE   MET  34          3HE       MET  34  -3.668  -3.215  -7.643
  216    H    GLN  35           H        GLN  35   0.922   2.166  -8.461
  217    HA   GLN  35           HA       GLN  35   3.078   0.501  -9.267
  218   1HB   GLN  35          1HB       GLN  35   2.861   2.837  -9.894
  219   2HB   GLN  35          2HB       GLN  35   2.951   3.341  -8.206
  220   1HG   GLN  35          2HG       GLN  35   5.187   3.483  -8.410
  221   2HG   GLN  35          1HG       GLN  35   5.238   1.742  -8.682
  222   2HE2  GLN  35          2HE2      GLN  35   4.512   4.763 -10.528
  223   1HE2  GLN  35          1HE2      GLN  35   5.226   4.223 -11.970
  224    H    HIS  36           H        HIS  36   3.423   2.653  -6.458
  225    HA   HIS  36           HA       HIS  36   5.452   1.192  -5.170
  226   1HB   HIS  36          1HB       HIS  36   3.398   3.224  -4.452
  227   2HB   HIS  36          2HB       HIS  36   4.245   2.440  -3.119
  228    HD1  HIS  36           HD1      HIS  36   5.458   4.767  -2.668
  229    HD2  HIS  36           HD2      HIS  36   6.369   2.989  -6.327
  230    HE1  HIS  36           HE1      HIS  36   7.517   5.950  -3.546
  231    H    ALA  37           H        ALA  37   1.942   1.123  -4.397
  232    HA   ALA  37           HA       ALA  37   1.877  -0.747  -2.338
  233   1HB   ALA  37          1HB       ALA  37  -0.385  -1.292  -3.256
  234   2HB   ALA  37          3HB       ALA  37  -0.068   0.443  -3.251
  235   3HB   ALA  37          2HB       ALA  37   0.053  -0.471  -4.754
  236    H    GLN  38           H        GLN  38   2.457  -1.343  -5.773
  237    HA   GLN  38           HA       GLN  38   2.265  -4.260  -5.540
  238   1HB   GLN  38          1HB       GLN  38   2.919  -2.189  -7.595
  239   2HB   GLN  38          2HB       GLN  38   3.513  -3.825  -7.881
  240   1HG   GLN  38          1HG       GLN  38   1.095  -4.576  -7.314
  241   2HG   GLN  38          2HG       GLN  38   0.663  -2.888  -7.588
  242   2HE2  GLN  38          2HE2      GLN  38  -0.422  -4.730  -9.357
  243   1HE2  GLN  38          1HE2      GLN  38   0.345  -4.625 -10.866
  244    H    ASN  39           H        ASN  39   4.805  -1.794  -5.516
  245    HA   ASN  39           HA       ASN  39   6.923  -3.869  -5.284
  246   1HB   ASN  39          1HB       ASN  39   6.783  -0.885  -5.714
  247   2HB   ASN  39          2HB       ASN  39   8.309  -1.655  -5.278
  248   2HD2  ASN  39          2HD2      ASN  39   8.553  -0.609  -7.695
  249   1HD2  ASN  39          1HD2      ASN  39   8.329  -1.733  -8.945
  250    H    LEU  40           H        LEU  40   4.841  -3.196  -3.155
  251    HA   LEU  40           HA       LEU  40   4.775  -2.925  -0.819
  252   1HB   LEU  40          1HB       LEU  40   7.608  -3.834  -1.381
  253   2HB   LEU  40          2HB       LEU  40   6.976  -3.674   0.258
  254    HG   LEU  40           HG       LEU  40   4.971  -5.105  -0.813
  255   1HD1  LEU  40          1HD1      LEU  40   7.372  -5.523  -2.554
  256   2HD1  LEU  40          2HD1      LEU  40   6.361  -6.917  -2.173
  257   3HD1  LEU  40          3HD1      LEU  40   5.663  -5.517  -2.987
  258   1HD2  LEU  40          1HD2      LEU  40   7.283  -5.612   0.814
  259   2HD2  LEU  40          2HD2      LEU  40   5.718  -6.426   0.853
  260   3HD2  LEU  40          3HD2      LEU  40   6.995  -7.020  -0.209
  261    H    GLU  41           H        GLU  41   5.537  -0.575  -2.543
  262    HA   GLU  41           HA       GLU  41   7.234   0.957  -0.609
  263   1HB   GLU  41          1HB       GLU  41   6.468   1.332  -3.519
  264   2HB   GLU  41          2HB       GLU  41   7.378   2.531  -2.599
  265   1HG   GLU  41          1HG       GLU  41   8.824   0.314  -2.022
  266   2HG   GLU  41          2HG       GLU  41   8.242  -0.114  -3.632
  267    H    PHE  42           H        PHE  42   4.169   0.289  -0.648
  268    HA   PHE  42           HA       PHE  42   2.676   2.642  -1.108
  269   1HB   PHE  42          1HB       PHE  42   1.042   1.508   0.411
  270   2HB   PHE  42          2HB       PHE  42   1.679   0.456  -0.849
  271    HD1  PHE  42           HD1      PHE  42   2.485   1.518   2.688
  272    HD2  PHE  42           HD2      PHE  42   2.458  -1.666  -0.233
  273    HE1  PHE  42           HE1      PHE  42   3.276  -0.081   4.419
  274    HE2  PHE  42           HE2      PHE  42   3.232  -3.261   1.504
  275    HZ   PHE  42           HZ       PHE  42   3.642  -2.467   3.833
  276    H    GLU  43           H        GLU  43   5.053   2.164   1.328
  277    HA   GLU  43           HA       GLU  43   4.027   3.391   3.625
  278   1HB   GLU  43          1HB       GLU  43   6.294   2.477   3.399
  279   2HB   GLU  43          2HB       GLU  43   6.713   3.745   2.247
  280   1HG   GLU  43          1HG       GLU  43   5.960   5.354   4.192
  281   2HG   GLU  43          2HG       GLU  43   6.277   3.949   5.210
  282    H    GLU  44           H        GLU  44   5.898   5.190   1.181
  283    HA   GLU  44           HA       GLU  44   4.611   7.722   1.938
  284   1HB   GLU  44          1HB       GLU  44   6.164   8.597   0.196
  285   2HB   GLU  44          2HB       GLU  44   7.000   7.561   1.354
  286   1HG   GLU  44          1HG       GLU  44   7.177   5.785  -0.165
  287   2HG   GLU  44          2HG       GLU  44   5.856   6.384  -1.167
  288    H    ALA  45           H        ALA  45   4.126   5.195  -0.389
  289    HA   ALA  45           HA       ALA  45   2.736   6.774  -2.399
  290   1HB   ALA  45          1HB       ALA  45   2.040   4.055  -2.593
  291   2HB   ALA  45          3HB       ALA  45   3.663   4.064  -1.903
  292   3HB   ALA  45          2HB       ALA  45   3.353   4.869  -3.443
  293    H    ALA  46           H        ALA  46   1.599   4.398   0.044
  294    HA   ALA  46           HA       ALA  46  -1.146   4.506  -0.470
  295   1HB   ALA  46          1HB       ALA  46   0.475   4.215   2.061
  296   2HB   ALA  46          3HB       ALA  46  -0.303   2.948   1.108
  297   3HB   ALA  46          2HB       ALA  46  -1.278   4.061   2.067
  298    H    GLN  47           H        GLN  47   0.884   6.976   0.970
  299    HA   GLN  47           HA       GLN  47  -0.986   8.518   2.409
  300   1HB   GLN  47          1HB       GLN  47   1.306   9.319   0.590
  301   2HB   GLN  47          2HB       GLN  47   0.520  10.414   1.728
  302   1HG   GLN  47          1HG       GLN  47   1.450   7.802   2.811
  303   2HG   GLN  47          2HG       GLN  47   2.697   8.978   2.393
  304   2HE2  GLN  47          2HE2      GLN  47   2.788   8.715   4.985
  305   1HE2  GLN  47          1HE2      GLN  47   1.893   9.876   5.841
  306    H    ILE  48           H        ILE  48  -0.530   8.172  -1.078
  307    HA   ILE  48           HA       ILE  48  -2.028  10.362  -2.054
  308    HB   ILE  48           HB       ILE  48  -1.821   7.482  -3.006
  309   1HG1  ILE  48          1HG1      ILE  48  -0.305   9.876  -4.044
  310   2HG1  ILE  48          2HG1      ILE  48   0.287   8.956  -2.660
  311   1HG2  ILE  48          1HG2      ILE  48  -3.577   9.394  -3.939
  312   2HG2  ILE  48          2HG2      ILE  48  -2.182   9.617  -4.994
  313   3HG2  ILE  48          3HG2      ILE  48  -2.962   8.039  -4.886
  314   1HD1  ILE  48          1HD1      ILE  48  -0.371   6.975  -4.476
  315   2HD1  ILE  48          2HD1      ILE  48   0.285   8.247  -5.506
  316   3HD1  ILE  48          3HD1      ILE  48   1.256   7.593  -4.187
  317    H    ARG  49           H        ARG  49  -3.044   7.398  -0.488
  318    HA   ARG  49           HA       ARG  49  -5.765   7.210  -1.187
  319   1HB   ARG  49          1HB       ARG  49  -4.695   5.556   0.181
  320   2HB   ARG  49          2HB       ARG  49  -4.214   6.755   1.376
  321   1HG   ARG  49          1HG       ARG  49  -7.053   6.893   1.124
  322   2HG   ARG  49          2HG       ARG  49  -6.612   5.195   1.298
  323   1HD   ARG  49          1HD       ARG  49  -6.951   6.297   3.515
  324   2HD   ARG  49          2HD       ARG  49  -5.278   5.740   3.312
  325    HE   ARG  49           HE       ARG  49  -4.686   8.089   2.673
  326   1HH1  ARG  49          1HH1      ARG  49  -7.923   8.360   2.672
  327   2HH1  ARG  49          2HH1      ARG  49  -8.052   9.574   3.902
  328   1HH2  ARG  49          1HH2      ARG  49  -4.751   9.272   4.920
  329   2HH2  ARG  49          2HH2      ARG  49  -6.256  10.090   5.173
  330    H    ASP  50           H        ASP  50  -4.146   9.441   1.041
  331    HA   ASP  50           HA       ASP  50  -6.516  10.592   2.204
  332   1HB   ASP  50          1HB       ASP  50  -4.112  10.715   3.007
  333   2HB   ASP  50          2HB       ASP  50  -3.807  11.867   1.706
  334    H    GLN  51           H        GLN  51  -4.616  11.292  -0.709
  335    HA   GLN  51           HA       GLN  51  -6.081  13.724  -1.381
  336   1HB   GLN  51          2HB       GLN  51  -4.362  11.868  -3.064
  337   2HB   GLN  51          1HB       GLN  51  -4.759  13.545  -3.441
  338   1HG   GLN  51          1HG       GLN  51  -3.556  14.327  -1.479
  339   2HG   GLN  51          2HG       GLN  51  -3.259  12.667  -0.958
  340   2HE2  GLN  51          2HE2      GLN  51  -2.981  14.105  -4.249
  341   1HE2  GLN  51          1HE2      GLN  51  -1.343  13.706  -4.446
  342    H    LEU  52           H        LEU  52  -6.228  10.298  -2.321
  343    HA   LEU  52           HA       LEU  52  -8.212  10.588  -4.389
  344   1HB   LEU  52          1HB       LEU  52  -6.623   8.593  -3.178
  345   2HB   LEU  52          2HB       LEU  52  -8.292   8.065  -2.960
  346    HG   LEU  52           HG       LEU  52  -7.363   7.241  -5.099
  347   1HD1  LEU  52          1HD1      LEU  52  -9.477   9.400  -5.392
  348   2HD1  LEU  52          2HD1      LEU  52  -9.166   8.120  -6.565
  349   3HD1  LEU  52          3HD1      LEU  52  -9.768   7.715  -4.958
  350   1HD2  LEU  52          1HD2      LEU  52  -6.210   9.809  -5.184
  351   2HD2  LEU  52          2HD2      LEU  52  -6.113   8.567  -6.432
  352   3HD2  LEU  52          3HD2      LEU  52  -7.388   9.785  -6.496
  353    H    HIS  53           H        HIS  53  -8.427   9.806  -0.909
  354    HA   HIS  53           HA       HIS  53 -11.309   9.516  -0.889
  355   1HB   HIS  53          1HB       HIS  53  -9.648   8.552   0.737
  356   2HB   HIS  53          2HB       HIS  53  -9.377  10.182   1.354
  357    HD1  HIS  53           HD1      HIS  53 -11.662   7.309   1.610
  358    HD2  HIS  53           HD2      HIS  53 -11.790  11.367   2.556
  359    HE1  HIS  53           HE1      HIS  53 -13.634   7.620   3.169
  360    H    GLN  54           H        GLN  54  -9.073  12.185  -0.122
  361    HA   GLN  54           HA       GLN  54 -11.093  14.022   0.806
  362   1HB   GLN  54          1HB       GLN  54  -8.701  14.214   1.314
  363   2HB   GLN  54          2HB       GLN  54  -8.334  14.416  -0.400
  364   1HG   GLN  54          1HG       GLN  54  -8.959  16.599  -0.399
  365   2HG   GLN  54          2HG       GLN  54 -10.366  16.289   0.619
  366   2HE2  GLN  54          2HE2      GLN  54  -8.389  18.480   0.965
  367   1HE2  GLN  54          1HE2      GLN  54  -7.700  18.255   2.499
  368    H    LEU  55           H        LEU  55  -9.495  13.570  -2.363
  369    HA   LEU  55           HA       LEU  55 -10.762  15.709  -3.748
  370   1HB   LEU  55          1HB       LEU  55  -9.487  13.081  -4.422
  371   2HB   LEU  55          2HB       LEU  55 -10.332  13.953  -5.700
  372    HG   LEU  55           HG       LEU  55  -8.489  15.553  -4.002
  373   1HD1  LEU  55          1HD1      LEU  55  -7.635  13.118  -5.276
  374   2HD1  LEU  55          2HD1      LEU  55  -6.922  14.493  -6.120
  375   3HD1  LEU  55          3HD1      LEU  55  -6.664  14.292  -4.387
  376   1HD2  LEU  55          1HD2      LEU  55  -9.520  15.465  -6.805
  377   2HD2  LEU  55          2HD2      LEU  55  -9.359  16.840  -5.712
  378   3HD2  LEU  55          3HD2      LEU  55  -7.939  16.202  -6.543
  379    H    ARG  56           H        ARG  56 -11.967  12.586  -2.741
  380    HA   ARG  56           HA       ARG  56 -14.074  12.111  -4.544
  381   1HB   ARG  56          1HB       ARG  56 -13.351  10.621  -2.718
  382   2HB   ARG  56          2HB       ARG  56 -13.959  11.771  -1.529
  383   1HG   ARG  56          1HG       ARG  56 -16.182  11.477  -3.033
  384   2HG   ARG  56          2HG       ARG  56 -15.453   9.889  -3.277
  385   1HD   ARG  56          1HD       ARG  56 -15.367   9.489  -0.881
  386   2HD   ARG  56          2HD       ARG  56 -15.913  11.145  -0.548
  387    HE   ARG  56           HE       ARG  56 -17.854  10.125  -2.254
  388   1HH1  ARG  56          1HH1      ARG  56 -17.873   7.475  -1.454
  389   2HH1  ARG  56          2HH1      ARG  56 -18.657   7.428   0.088
  390   1HH2  ARG  56          1HH2      ARG  56 -18.253  10.818   0.695
  391   2HH2  ARG  56          2HH2      ARG  56 -18.873   9.320   1.305
  392    H    GLU  57           H        GLU  57 -14.133  14.116  -1.575
  393    HA   GLU  57           HA       GLU  57 -16.852  14.976  -1.808
  394   1HB   GLU  57          2HB       GLU  57 -14.453  16.410  -0.621
  395   2HB   GLU  57          1HB       GLU  57 -16.142  16.659  -0.179
  396   1HG   GLU  57          1HG       GLU  57 -16.062  14.042   0.262
  397   2HG   GLU  57          2HG       GLU  57 -14.336  14.358   0.453
  398    H    LEU  58           H        LEU  58 -13.803  16.462  -2.935
  399    HA   LEU  58           HA       LEU  58 -14.869  18.856  -4.016
  400   1HB   LEU  58          1HB       LEU  58 -12.457  17.209  -4.169
  401   2HB   LEU  58          2HB       LEU  58 -12.772  18.067  -5.678
  402    HG   LEU  58           HG       LEU  58 -13.012  19.551  -3.082
  403   1HD1  LEU  58          1HD1      LEU  58 -10.775  18.208  -3.302
  404   2HD1  LEU  58          2HD1      LEU  58 -10.386  19.398  -4.545
  405   3HD1  LEU  58          3HD1      LEU  58 -10.705  19.922  -2.891
  406   1HD2  LEU  58          1HD2      LEU  58 -12.743  20.107  -5.976
  407   2HD2  LEU  58          2HD2      LEU  58 -13.552  21.045  -4.721
  408   3HD2  LEU  58          3HD2      LEU  58 -11.804  21.166  -4.926
  409    H    PHE  59           H        PHE  59 -15.082  15.570  -5.163
  410    HA   PHE  59           HA       PHE  59 -15.454  15.879  -7.935
  411   1HB   PHE  59          1HB       PHE  59 -15.396  13.791  -6.453
  412   2HB   PHE  59          2HB       PHE  59 -17.101  14.098  -6.121
  413    HD1  PHE  59           HD1      PHE  59 -18.627  14.514  -8.249
  414    HD2  PHE  59           HD2      PHE  59 -14.813  12.490  -8.320
  415    HE1  PHE  59           HE1      PHE  59 -19.247  13.423 -10.403
  416    HE2  PHE  59           HE2      PHE  59 -15.433  11.399 -10.474
  417    HZ   PHE  59           HZ       PHE  59 -17.649  11.866 -11.516
  418    H    ILE  60           H        ILE  60 -17.881  16.210  -5.324
  419    HA   ILE  60           HA       ILE  60 -20.028  16.935  -7.159
  420    HB   ILE  60           HB       ILE  60 -19.660  17.152  -4.153
  421   1HG1  ILE  60          1HG1      ILE  60 -21.279  15.135  -5.722
  422   2HG1  ILE  60          2HG1      ILE  60 -19.587  14.858  -5.308
  423   1HG2  ILE  60          1HG2      ILE  60 -22.002  17.664  -5.973
  424   2HG2  ILE  60          2HG2      ILE  60 -22.267  17.085  -4.328
  425   3HG2  ILE  60          3HG2      ILE  60 -21.437  18.617  -4.600
  426   1HD1  ILE  60          1HD1      ILE  60 -20.430  15.551  -2.881
  427   2HD1  ILE  60          2HD1      ILE  60 -21.979  14.996  -3.518
  428   3HD1  ILE  60          3HD1      ILE  60 -20.603  13.896  -3.464
  429    H    ALA  61           H        ALA  61 -17.738  18.696  -5.093
  430    HA   ALA  61           HA       ALA  61 -18.903  21.291  -5.264
  431   1HB   ALA  61          1HB       ALA  61 -17.064  21.749  -4.018
  432   2HB   ALA  61          2HB       ALA  61 -16.650  20.043  -4.182
  433   3HB   ALA  61          3HB       ALA  61 -15.982  21.223  -5.308
  434    H    ALA  62           H        ALA  62 -17.096  19.410  -7.594
  435    HA   ALA  62           HA       ALA  62 -16.512  21.733  -9.319
  436   1HB   ALA  62          1HB       ALA  62 -15.901  18.823  -9.165
  437   2HB   ALA  62          3HB       ALA  62 -15.886  19.543 -10.775
  438   3HB   ALA  62          2HB       ALA  62 -14.826  20.177  -9.515
  439    H    SER  63           H        SER  63 -17.995  18.602 -10.185
  440    HA   SER  63           HA       SER  63 -19.847  20.048 -12.011
  441   1HB   SER  63          1HB       SER  63 -20.082  17.856 -13.036
  442   2HB   SER  63          2HB       SER  63 -18.369  18.139 -12.733
  443    HG   SER  63           HG       SER  63 -20.093  16.299 -11.640
  444    H    LEU   8           H        LEU   8  26.516  -7.136  -0.833
  445    HA   LEU   8           HA       LEU   8  26.916  -9.738  -0.677
  446   1HB   LEU   8          1HB       LEU   8  25.159  -7.909   0.830
  447   2HB   LEU   8          2HB       LEU   8  24.820  -9.618   1.099
  448    HG   LEU   8           HG       LEU   8  27.673  -9.170   1.086
  449   1HD1  LEU   8          1HD1      LEU   8  26.900  -6.871   1.812
  450   2HD1  LEU   8          2HD1      LEU   8  26.146  -7.640   3.209
  451   3HD1  LEU   8          3HD1      LEU   8  27.895  -7.718   2.996
  452   1HD2  LEU   8          1HD2      LEU   8  25.568 -10.260   2.936
  453   2HD2  LEU   8          2HD2      LEU   8  26.918 -11.099   2.172
  454   3HD2  LEU   8          3HD2      LEU   8  27.210 -10.021   3.536
  455    H    GLU   9           H        GLU   9  26.220 -11.370  -2.012
  456    HA   GLU   9           HA       GLU   9  23.274 -11.756  -2.330
  457   1HB   GLU   9          1HB       GLU   9  24.657 -10.527  -4.244
  458   2HB   GLU   9          2HB       GLU   9  25.112 -12.180  -4.658
  459   1HG   GLU   9          1HG       GLU   9  22.510 -12.612  -4.401
  460   2HG   GLU   9          2HG       GLU   9  22.415 -10.883  -4.737
  461    HA   PRO  10           HA       PRO  10  25.672 -15.632  -1.354
  462   1HB   PRO  10          1HB       PRO  10  24.153 -16.397   0.790
  463   2HB   PRO  10          2HB       PRO  10  25.558 -15.321   0.936
  464   1HG   PRO  10          2HG       PRO  10  22.661 -14.653   0.905
  465   2HG   PRO  10          1HG       PRO  10  23.973 -13.945   1.857
  466   1HD   PRO  10          1HD       PRO  10  22.910 -12.773  -0.371
  467   2HD   PRO  10          2HD       PRO  10  24.573 -12.499   0.192
  468    H    ASP  11           H        ASP  11  22.136 -15.195  -0.961
  469    HA   ASP  11           HA       ASP  11  20.324 -16.385  -1.891
  470   1HB   ASP  11          1HB       ASP  11  22.484 -16.281  -3.825
  471   2HB   ASP  11          2HB       ASP  11  21.556 -17.768  -4.019
  472    H    ASN  12           H        ASN  12  22.815 -18.709  -2.875
  473    HA   ASN  12           HA       ASN  12  21.906 -20.577  -0.725
  474   1HB   ASN  12          1HB       ASN  12  20.750 -20.727  -3.079
  475   2HB   ASN  12          2HB       ASN  12  22.265 -21.482  -3.574
  476   2HD2  ASN  12          2HD2      ASN  12  22.996 -23.146  -1.589
  477   1HD2  ASN  12          1HD2      ASN  12  21.769 -24.247  -1.185
  478    H    VAL  13           H        VAL  13  24.436 -18.982  -1.452
  479    HA   VAL  13           HA       VAL  13  26.413 -20.981  -2.222
  480    HB   VAL  13           HB       VAL  13  26.286 -18.102  -1.422
  481   1HG1  VAL  13          1HG1      VAL  13  28.703 -19.851  -1.081
  482   2HG1  VAL  13          2HG1      VAL  13  28.919 -18.208  -1.684
  483   3HG1  VAL  13          3HG1      VAL  13  28.176 -18.478  -0.107
  484   1HG2  VAL  13          1HG2      VAL  13  27.135 -19.785  -3.727
  485   2HG2  VAL  13          2HG2      VAL  13  26.208 -18.284  -3.709
  486   3HG2  VAL  13          3HG2      VAL  13  27.960 -18.241  -3.508
  487    HA   PRO  14           HA       PRO  14  27.600 -20.873   2.393
  488   1HB   PRO  14          1HB       PRO  14  26.072 -19.422   4.135
  489   2HB   PRO  14          2HB       PRO  14  27.453 -18.731   3.260
  490   1HG   PRO  14          2HG       PRO  14  24.543 -18.477   2.709
  491   2HG   PRO  14          1HG       PRO  14  25.839 -17.283   2.530
  492   1HD   PRO  14          1HD       PRO  14  24.746 -18.683   0.444
  493   2HD   PRO  14          2HD       PRO  14  26.383 -17.995   0.446
  494    H    MET  15           H        MET  15  24.060 -20.377   2.197
  495    HA   MET  15           HA       MET  15  22.278 -21.769   2.869
  496   1HB   MET  15          1HB       MET  15  23.555 -23.118   1.130
  497   2HB   MET  15          2HB       MET  15  24.356 -23.939   2.470
  498   1HG   MET  15          1HG       MET  15  22.485 -25.310   1.850
  499   2HG   MET  15          2HG       MET  15  22.045 -24.508   3.359
  500   1HE   MET  15          1HE       MET  15  19.866 -25.009   3.207
  501   2HE   MET  15          2HE       MET  15  18.620 -24.212   2.251
  502   3HE   MET  15          3HE       MET  15  19.483 -25.612   1.597
  503    H    ASP  16           H        ASP  16  22.018 -21.267   5.082
  504    HA   ASP  16           HA       ASP  16  23.678 -22.825   7.017
  505   1HB   ASP  16          1HB       ASP  16  23.899 -20.421   7.203
  506   2HB   ASP  16          2HB       ASP  16  22.146 -20.224   7.223
  507    H    MET  17           H        MET  17  20.657 -21.295   7.817
  508    HA   MET  17           HA       MET  17  18.936 -23.586   7.563
  509   1HB   MET  17          2HB       MET  17  18.939 -24.264   9.949
  510   2HB   MET  17          1HB       MET  17  20.536 -24.466   9.230
  511   1HG   MET  17          1HG       MET  17  21.274 -22.344  10.193
  512   2HG   MET  17          2HG       MET  17  19.662 -22.052  10.844
  513   1HE   MET  17          1HE       MET  17  21.892 -21.685  12.556
  514   2HE   MET  17          2HE       MET  17  20.374 -21.846  13.434
  515   3HE   MET  17          3HE       MET  17  21.798 -22.724  13.984
  516    H    SER  18           H        SER  18  19.695 -20.587   9.298
  517    HA   SER  18           HA       SER  18  18.297 -18.802   9.951
  518   1HB   SER  18          1HB       SER  18  16.174 -20.166   8.284
  519   2HB   SER  18          2HB       SER  18  16.391 -18.441   8.566
  520    HG   SER  18           HG       SER  18  17.386 -19.925   6.614
  521    HA   PRO  19           HA       PRO  19  15.991 -20.346  13.339
  522   1HB   PRO  19          1HB       PRO  19  14.222 -18.314  13.812
  523   2HB   PRO  19          2HB       PRO  19  15.951 -18.202  14.199
  524   1HG   PRO  19          2HG       PRO  19  14.464 -17.124  11.853
  525   2HG   PRO  19          1HG       PRO  19  15.766 -16.384  12.798
  526   1HD   PRO  19          1HD       PRO  19  16.161 -17.541  10.373
  527   2HD   PRO  19          2HD       PRO  19  17.408 -17.491  11.638
  528    H    LYS  20           H        LYS  20  14.450 -19.683  10.376
  529    HA   LYS  20           HA       LYS  20  12.547 -20.626   9.353
  530   1HB   LYS  20          1HB       LYS  20  13.630 -22.601  10.676
  531   2HB   LYS  20          2HB       LYS  20  12.276 -22.386  11.786
  532   1HG   LYS  20          1HG       LYS  20  12.015 -22.827   8.796
  533   2HG   LYS  20          2HG       LYS  20  11.772 -24.067  10.026
  534   1HD   LYS  20          1HD       LYS  20  10.127 -22.179  11.009
  535   2HD   LYS  20          2HD       LYS  20  10.042 -21.758   9.298
  536   1HE   LYS  20          1HE       LYS  20   9.763 -24.439   9.087
  537   2HE   LYS  20          2HE       LYS  20   9.044 -24.193  10.692
  538   1HZ   LYS  20          1HZ       LYS  20   7.791 -22.300   9.693
  539   2HZ   LYS  20          2HZ       LYS  20   8.331 -22.804   8.166
  540   3HZ   LYS  20          3HZ       LYS  20   7.338 -23.824   9.095
  541    H    ALA  21           H        ALA  21  11.680 -20.894  12.836
  542    HA   ALA  21           HA       ALA  21   8.995 -20.174  12.673
  543   1HB   ALA  21          1HB       ALA  21  10.714 -20.774  14.636
  544   2HB   ALA  21          3HB       ALA  21   9.176 -19.981  14.975
  545   3HB   ALA  21          2HB       ALA  21  10.656 -19.027  14.880
  546    H    LEU  22           H        LEU  22  11.704 -17.908  13.242
  547    HA   LEU  22           HA       LEU  22  10.110 -15.512  13.035
  548   1HB   LEU  22          1HB       LEU  22  12.337 -15.803  14.147
  549   2HB   LEU  22          2HB       LEU  22  13.071 -16.016  12.566
  550    HG   LEU  22           HG       LEU  22  11.531 -13.534  13.373
  551   1HD1  LEU  22          1HD1      LEU  22  14.497 -14.132  13.365
  552   2HD1  LEU  22          2HD1      LEU  22  13.807 -12.523  13.584
  553   3HD1  LEU  22          3HD1      LEU  22  13.508 -13.783  14.784
  554   1HD2  LEU  22          1HD2      LEU  22  13.151 -14.392  10.984
  555   2HD2  LEU  22          2HD2      LEU  22  11.612 -13.532  11.028
  556   3HD2  LEU  22          3HD2      LEU  22  13.106 -12.685  11.431
  557    H    GLN  23           H        GLN  23  12.678 -16.602  10.813
  558    HA   GLN  23           HA       GLN  23  12.146 -15.071   8.576
  559   1HB   GLN  23          1HB       GLN  23  13.997 -16.673   8.860
  560   2HB   GLN  23          2HB       GLN  23  12.868 -18.019   8.709
  561   1HG   GLN  23          1HG       GLN  23  12.237 -16.766   6.441
  562   2HG   GLN  23          2HG       GLN  23  13.881 -16.147   6.608
  563   2HE2  GLN  23          2HE2      GLN  23  15.150 -17.420   5.232
  564   1HE2  GLN  23          1HE2      GLN  23  15.124 -19.116   5.192
  565    H    GLN  24           H        GLN  24  10.270 -17.852   9.690
  566    HA   GLN  24           HA       GLN  24   8.702 -18.069   7.224
  567   1HB   GLN  24          1HB       GLN  24   9.232 -19.944   8.798
  568   2HB   GLN  24          2HB       GLN  24   8.227 -19.161  10.017
  569   1HG   GLN  24          1HG       GLN  24   6.959 -19.536   7.364
  570   2HG   GLN  24          2HG       GLN  24   7.280 -21.014   8.272
  571   2HE2  GLN  24          2HE2      GLN  24   4.704 -19.302   7.716
  572   1HE2  GLN  24          1HE2      GLN  24   4.000 -19.171   9.254
  573    H    LYS  25           H        LYS  25   8.382 -16.473  10.362
  574    HA   LYS  25           HA       LYS  25   5.577 -15.787  10.078
  575   1HB   LYS  25          1HB       LYS  25   7.906 -15.089  11.825
  576   2HB   LYS  25          2HB       LYS  25   6.491 -14.037  11.877
  577   1HG   LYS  25          1HG       LYS  25   5.156 -15.645  12.825
  578   2HG   LYS  25          2HG       LYS  25   5.977 -16.965  11.991
  579   1HD   LYS  25          2HD       LYS  25   7.118 -17.381  13.885
  580   2HD   LYS  25          1HD       LYS  25   7.907 -15.815  13.698
  581   1HE   LYS  25          1HE       LYS  25   6.500 -14.768  15.218
  582   2HE   LYS  25          2HE       LYS  25   5.151 -15.872  14.882
  583   1HZ   LYS  25          1HZ       LYS  25   6.418 -17.668  15.903
  584   2HZ   LYS  25          2HZ       LYS  25   7.682 -16.592  16.266
  585   3HZ   LYS  25          3HZ       LYS  25   6.170 -16.403  17.009
  586    H    ILE  26           H        ILE  26   8.606 -13.908   9.672
  587    HA   ILE  26           HA       ILE  26   7.405 -11.472   8.822
  588    HB   ILE  26           HB       ILE  26  10.062 -12.775   8.147
  589   1HG1  ILE  26          1HG1      ILE  26   9.285 -10.755  10.277
  590   2HG1  ILE  26          2HG1      ILE  26   9.608 -12.465  10.569
  591   1HG2  ILE  26          1HG2      ILE  26   9.372 -10.876   6.627
  592   2HG2  ILE  26          2HG2      ILE  26   9.322  -9.838   8.054
  593   3HG2  ILE  26          3HG2      ILE  26  10.845 -10.572   7.549
  594   1HD1  ILE  26          1HD1      ILE  26  11.895 -12.083   9.507
  595   2HD1  ILE  26          2HD1      ILE  26  11.549 -10.357   9.601
  596   3HD1  ILE  26          3HD1      ILE  26  11.644 -11.317  11.077
  597    H    HIS  27           H        HIS  27   8.604 -14.241   6.897
  598    HA   HIS  27           HA       HIS  27   8.080 -13.189   4.312
  599   1HB   HIS  27          1HB       HIS  27   9.201 -15.408   5.315
  600   2HB   HIS  27          2HB       HIS  27   7.623 -16.081   4.906
  601    HD1  HIS  27           HD1      HIS  27   7.071 -14.402   2.341
  602    HD2  HIS  27           HD2      HIS  27  10.665 -16.363   3.129
  603    HE1  HIS  27           HE1      HIS  27   8.192 -14.769   0.100
  604    H    GLU  28           H        GLU  28   5.898 -14.428   6.744
  605    HA   GLU  28           HA       GLU  28   3.683 -14.943   4.900
  606   1HB   GLU  28          1HB       GLU  28   4.072 -14.792   7.893
  607   2HB   GLU  28          2HB       GLU  28   2.479 -15.058   7.185
  608   1HG   GLU  28          1HG       GLU  28   4.858 -16.758   6.430
  609   2HG   GLU  28          2HG       GLU  28   3.827 -17.157   7.804
  610    H    LEU  29           H        LEU  29   4.727 -12.285   7.003
  611    HA   LEU  29           HA       LEU  29   2.281 -10.731   6.638
  612   1HB   LEU  29          1HB       LEU  29   5.055 -10.177   7.726
  613   2HB   LEU  29          2HB       LEU  29   3.756  -8.984   7.756
  614    HG   LEU  29           HG       LEU  29   3.233 -11.730   8.844
  615   1HD1  LEU  29          1HD1      LEU  29   4.916  -9.569  10.089
  616   2HD1  LEU  29          2HD1      LEU  29   3.914 -10.602  11.110
  617   3HD1  LEU  29          3HD1      LEU  29   5.168 -11.315  10.095
  618   1HD2  LEU  29          1HD2      LEU  29   1.712  -9.470   8.545
  619   2HD2  LEU  29          2HD2      LEU  29   1.399 -10.721   9.748
  620   3HD2  LEU  29          3HD2      LEU  29   2.300  -9.273  10.196
  621    H    GLU  30           H        GLU  30   5.555 -10.728   5.235
  622    HA   GLU  30           HA       GLU  30   5.428  -8.346   3.721
  623   1HB   GLU  30          1HB       GLU  30   7.235 -10.275   4.142
  624   2HB   GLU  30          2HB       GLU  30   6.660 -10.814   2.564
  625   1HG   GLU  30          1HG       GLU  30   6.944  -8.163   2.074
  626   2HG   GLU  30          2HG       GLU  30   8.209  -8.388   3.283
  627    H    GLY  31           H        GLY  31   4.366 -11.641   2.818
  628   1HA   GLY  31          2HA       GLY  31   3.011 -12.364   1.036
  629   2HA   GLY  31          1HA       GLY  31   3.439 -10.874   0.197
  630    H    LEU  32           H        LEU  32   2.014 -10.825   3.398
  631    HA   LEU  32           HA       LEU  32  -0.744 -10.690   2.744
  632   1HB   LEU  32          1HB       LEU  32   0.861 -10.552   4.980
  633   2HB   LEU  32          2HB       LEU  32   0.207  -8.916   4.899
  634    HG   LEU  32           HG       LEU  32  -2.080  -9.832   4.767
  635   1HD1  LEU  32          1HD1      LEU  32  -0.625 -12.248   4.182
  636   2HD1  LEU  32          2HD1      LEU  32  -1.646 -12.512   5.596
  637   3HD1  LEU  32          3HD1      LEU  32  -2.362 -11.958   4.083
  638   1HD2  LEU  32          1HD2      LEU  32  -0.384 -10.882   7.053
  639   2HD2  LEU  32          2HD2      LEU  32  -1.217  -9.329   6.983
  640   3HD2  LEU  32          3HD2      LEU  32  -2.147 -10.826   7.075
  641    H    MET  33           H        MET  33   1.711  -8.100   2.900
  642    HA   MET  33           HA       MET  33   0.041  -5.858   2.467
  643   1HB   MET  33          1HB       MET  33   2.885  -6.625   1.922
  644   2HB   MET  33          2HB       MET  33   2.288  -5.112   1.241
  645   1HG   MET  33          1HG       MET  33   2.118  -4.106   3.284
  646   2HG   MET  33          2HG       MET  33   1.593  -5.590   4.081
  647   1HE   MET  33          1HE       MET  33   4.336  -4.844   1.701
  648   2HE   MET  33          2HE       MET  33   4.908  -3.579   2.785
  649   3HE   MET  33          3HE       MET  33   5.867  -5.042   2.568
  650    H    MET  34           H        MET  34   1.583  -8.031   0.090
  651    HA   MET  34           HA       MET  34   0.940  -6.741  -2.310
  652   1HB   MET  34          1HB       MET  34   2.164  -8.989  -1.670
  653   2HB   MET  34          2HB       MET  34   0.584  -9.707  -1.984
  654   1HG   MET  34          2HG       MET  34   1.209  -9.744  -4.159
  655   2HG   MET  34          1HG       MET  34   0.924  -8.004  -4.140
  656   1HE   MET  34          1HE       MET  34   2.163  -6.388  -3.997
  657   2HE   MET  34          2HE       MET  34   3.893  -6.229  -3.664
  658   3HE   MET  34          3HE       MET  34   3.332  -6.517  -5.309
  659    H    GLN  35           H        GLN  35  -1.161  -8.771  -0.277
  660    HA   GLN  35           HA       GLN  35  -3.365  -9.034  -2.050
  661   1HB   GLN  35          1HB       GLN  35  -3.115 -10.306   0.005
  662   2HB   GLN  35          2HB       GLN  35  -3.160  -8.832   0.971
  663   1HG   GLN  35          2HG       GLN  35  -5.396  -9.036   1.103
  664   2HG   GLN  35          1HG       GLN  35  -5.487  -8.798  -0.642
  665   2HE2  GLN  35          2HE2      GLN  35  -4.740 -11.442   1.708
  666   1HE2  GLN  35          1HE2      GLN  35  -5.496 -12.659   0.796
  667    H    HIS  36           H        HIS  36  -3.609  -6.954   0.822
  668    HA   HIS  36           HA       HIS  36  -5.639  -5.273  -0.159
  669   1HB   HIS  36          1HB       HIS  36  -3.531  -5.195   1.942
  670   2HB   HIS  36          2HB       HIS  36  -4.366  -3.683   1.592
  671    HD1  HIS  36           HD1      HIS  36  -5.524  -3.898   3.979
  672    HD2  HIS  36           HD2      HIS  36  -6.544  -6.882   1.254
  673    HE1  HIS  36           HE1      HIS  36  -7.577  -5.050   4.913
  674    H    ALA  37           H        ALA  37  -2.116  -4.562  -0.091
  675    HA   ALA  37           HA       ALA  37  -2.044  -2.056  -1.295
  676   1HB   ALA  37          1HB       ALA  37  -0.097  -3.299  -0.464
  677   2HB   ALA  37          3HB       ALA  37  -0.267  -4.476  -1.768
  678   3HB   ALA  37          2HB       ALA  37   0.186  -2.812  -2.135
  679    H    GLN  38           H        GLN  38  -2.704  -5.167  -2.835
  680    HA   GLN  38           HA       GLN  38  -2.562  -4.113  -5.567
  681   1HB   GLN  38          1HB       GLN  38  -3.222  -6.663  -4.154
  682   2HB   GLN  38          2HB       GLN  38  -3.852  -6.461  -5.788
  683   1HG   GLN  38          1HG       GLN  38  -1.437  -5.741  -6.404
  684   2HG   GLN  38          2HG       GLN  38  -0.980  -6.492  -4.876
  685   2HE2  GLN  38          2HE2      GLN  38   0.032  -7.674  -7.174
  686   1HE2  GLN  38          1HE2      GLN  38  -0.765  -9.140  -7.484
  687    H    ASN  39           H        ASN  39  -5.057  -4.764  -3.141
  688    HA   ASN  39           HA       ASN  39  -7.208  -3.912  -5.008
  689   1HB   ASN  39          1HB       ASN  39  -7.019  -5.180  -2.275
  690   2HB   ASN  39          2HB       ASN  39  -8.550  -4.521  -2.852
  691   2HD2  ASN  39          2HD2      ASN  39  -8.825  -7.131  -2.531
  692   1HD2  ASN  39          1HD2      ASN  39  -8.648  -8.012  -3.972
  693    H    LEU  40           H        LEU  40  -5.070  -2.095  -3.803
  694    HA   LEU  40           HA       LEU  40  -4.951   0.065  -2.877
  695   1HB   LEU  40          1HB       LEU  40  -7.813  -0.172  -3.839
  696   2HB   LEU  40          2HB       LEU  40  -7.143   1.343  -3.233
  697    HG   LEU  40           HG       LEU  40  -5.191   0.696  -4.960
  698   1HD1  LEU  40          1HD1      LEU  40  -7.635  -0.817  -5.798
  699   2HD1  LEU  40          2HD1      LEU  40  -6.643  -0.069  -7.050
  700   3HD1  LEU  40          3HD1      LEU  40  -5.934  -1.259  -5.958
  701   1HD2  LEU  40          1HD2      LEU  40  -7.477   2.433  -4.924
  702   2HD2  LEU  40          2HD2      LEU  40  -5.928   2.681  -5.730
  703   3HD2  LEU  40          3HD2      LEU  40  -7.238   1.851  -6.572
  704    H    GLU  41           H        GLU  41  -5.703  -2.250  -1.100
  705    HA   GLU  41           HA       GLU  41  -7.330  -0.810   0.960
  706   1HB   GLU  41          1HB       GLU  41  -6.618  -3.717   0.471
  707   2HB   GLU  41          2HB       GLU  41  -7.484  -3.165   1.904
  708   1HG   GLU  41          1HG       GLU  41  -8.961  -1.957  -0.019
  709   2HG   GLU  41          2HG       GLU  41  -8.421  -3.386  -0.903
  710    H    PHE  42           H        PHE  42  -4.279  -0.700   0.235
  711    HA   PHE  42           HA       PHE  42  -2.752  -1.835   2.323
  712   1HB   PHE  42          1HB       PHE  42  -1.108  -0.080   1.630
  713   2HB   PHE  42          2HB       PHE  42  -1.792  -0.975   0.277
  714    HD1  PHE  42           HD1      PHE  42  -2.499   2.121   2.326
  715    HD2  PHE  42           HD2      PHE  42  -2.600   0.234  -1.560
  716    HE1  PHE  42           HE1      PHE  42  -3.282   4.249   1.308
  717    HE2  PHE  42           HE2      PHE  42  -3.364   2.364  -2.573
  718    HZ   PHE  42           HZ       PHE  42  -3.708   4.377  -1.138
  719    H    GLU  43           H        GLU  43  -5.089   0.669   2.618
  720    HA   GLU  43           HA       GLU  43  -3.991   2.504   4.424
  721   1HB   GLU  43          1HB       GLU  43  -6.280   2.582   3.539
  722   2HB   GLU  43          2HB       GLU  43  -6.697   1.121   4.436
  723   1HG   GLU  43          1HG       GLU  43  -5.873   2.514   6.514
  724   2HG   GLU  43          2HG       GLU  43  -6.196   3.895   5.466
  725    H    GLU  44           H        GLU  44  -5.877  -0.325   5.495
  726    HA   GLU  44           HA       GLU  44  -4.525  -0.344   8.107
  727   1HB   GLU  44          1HB       GLU  44  -6.098  -2.239   8.485
  728   2HB   GLU  44          2HB       GLU  44  -6.929  -0.822   7.843
  729   1HG   GLU  44          1HG       GLU  44  -7.171  -1.767   5.712
  730   2HG   GLU  44          2HG       GLU  44  -5.859  -2.917   5.968
  731    H    ALA  45           H        ALA  45  -4.137  -1.856   5.009
  732    HA   ALA  45           HA       ALA  45  -2.759  -4.254   5.913
  733   1HB   ALA  45          1HB       ALA  45  -3.727  -2.990   3.482
  734   2HB   ALA  45          3HB       ALA  45  -2.119  -3.671   3.236
  735   3HB   ALA  45          2HB       ALA  45  -3.434  -4.700   3.805
  736    H    ALA  46           H        ALA  46  -1.619  -1.249   4.308
  737    HA   ALA  46           HA       ALA  46   1.116  -1.809   4.198
  738   1HB   ALA  46          1HB       ALA  46   1.290   0.746   4.493
  739   2HB   ALA  46          2HB       ALA  46   0.270   0.161   3.179
  740   3HB   ALA  46          3HB       ALA  46  -0.459   0.721   4.687
  741    H    GLN  47           H        GLN  47  -0.835  -1.110   7.025
  742    HA   GLN  47           HA       GLN  47   1.094  -0.198   8.868
  743   1HB   GLN  47          1HB       GLN  47  -1.218  -2.139   9.171
  744   2HB   GLN  47          2HB       GLN  47  -0.387  -1.372  10.526
  745   1HG   GLN  47          1HG       GLN  47  -1.346   0.426   8.356
  746   2HG   GLN  47          2HG       GLN  47  -2.578  -0.294   9.394
  747   2HE2  GLN  47          2HE2      GLN  47  -2.621   2.266   9.883
  748   1HE2  GLN  47          1HE2      GLN  47  -1.686   2.742  11.218
  749    H    ILE  48           H        ILE  48   0.560  -3.434   7.550
  750    HA   ILE  48           HA       ILE  48   2.079  -5.017   9.332
  751    HB   ILE  48           HB       ILE  48   1.798  -5.103   6.306
  752   1HG1  ILE  48          1HG1      ILE  48   0.307  -6.760   8.341
  753   2HG1  ILE  48          2HG1      ILE  48  -0.274  -5.163   7.869
  754   1HG2  ILE  48          1HG2      ILE  48   3.571  -6.569   7.829
  755   2HG2  ILE  48          2HG2      ILE  48   2.158  -7.624   7.775
  756   3HG2  ILE  48          3HG2      ILE  48   2.910  -7.079   6.276
  757   1HD1  ILE  48          1HD1      ILE  48   0.308  -6.345   5.436
  758   2HD1  ILE  48          2HD1      ILE  48  -0.344  -7.687   6.377
  759   3HD1  ILE  48          3HD1      ILE  48  -1.300  -6.222   6.151
  760    H    ARG  49           H        ARG  49   3.070  -2.684   6.916
  761    HA   ARG  49           HA       ARG  49   5.772  -3.338   6.470
  762   1HB   ARG  49          1HB       ARG  49   4.699  -1.539   5.302
  763   2HB   ARG  49          2HB       ARG  49   4.266  -0.730   6.804
  764   1HG   ARG  49          1HG       ARG  49   7.101  -1.052   6.794
  765   2HG   ARG  49          2HG       ARG  49   6.631  -0.393   5.229
  766   1HD   ARG  49          1HD       ARG  49   7.037   1.412   6.909
  767   2HD   ARG  49          2HD       ARG  49   5.351   1.401   6.359
  768    HE   ARG  49           HE       ARG  49   4.790   0.123   8.441
  769   1HH1  ARG  49          1HH1      ARG  49   8.032   0.001   8.622
  770   2HH1  ARG  49          2HH1      ARG  49   8.209   0.829  10.132
  771   1HH2  ARG  49          1HH2      ARG  49   4.924   1.937  10.213
  772   2HH2  ARG  49          2HH2      ARG  49   6.450   1.925  11.034
  773    H    ASP  50           H        ASP  50   4.243  -1.819   9.283
  774    HA   ASP  50           HA       ASP  50   6.658  -1.068  10.661
  775   1HB   ASP  50          1HB       ASP  50   4.275  -0.299  11.066
  776   2HB   ASP  50          2HB       ASP  50   3.965  -1.871  11.807
  777    H    GLN  51           H        GLN  51   4.713  -4.031  10.544
  778    HA   GLN  51           HA       GLN  51   6.210  -5.392  12.647
  779   1HB   GLN  51          2HB       GLN  51   4.421  -6.449  10.430
  780   2HB   GLN  51          1HB       GLN  51   4.843  -7.296  11.919
  781   1HG   GLN  51          1HG       GLN  51   3.695  -5.623  13.258
  782   2HG   GLN  51          2HG       GLN  51   3.378  -4.644  11.824
  783   2HE2  GLN  51          2HE2      GLN  51   3.060  -8.204  12.267
  784   1HE2  GLN  51          1HE2      GLN  51   1.411  -8.256  11.870
  785    H    LEU  52           H        LEU  52   6.271  -5.314   9.094
  786    HA   LEU  52           HA       LEU  52   8.218  -7.407   8.732
  787   1HB   LEU  52          1HB       LEU  52   6.616  -5.653   7.205
  788   2HB   LEU  52          2HB       LEU  52   8.277  -5.318   6.721
  789    HG   LEU  52           HG       LEU  52   7.290  -7.118   5.343
  790   1HD1  LEU  52          1HD1      LEU  52   9.439  -8.045   7.276
  791   2HD1  LEU  52          2HD1      LEU  52   9.079  -8.800   5.723
  792   3HD1  LEU  52          3HD1      LEU  52   9.706  -7.153   5.778
  793   1HD2  LEU  52          1HD2      LEU  52   6.186  -7.917   7.808
  794   2HD2  LEU  52          2HD2      LEU  52   6.040  -8.757   6.264
  795   3HD2  LEU  52          3HD2      LEU  52   7.335  -9.186   7.381
  796    H    HIS  53           H        HIS  53   8.490  -3.852   8.971
  797    HA   HIS  53           HA       HIS  53  11.366  -3.792   8.627
  798   1HB   HIS  53          1HB       HIS  53   9.719  -1.934   8.210
  799   2HB   HIS  53          2HB       HIS  53   9.493  -1.805   9.955
  800    HD1  HIS  53           HD1      HIS  53  11.727  -0.770   7.219
  801    HD2  HIS  53           HD2      HIS  53  11.953  -1.028  11.373
  802    HE1  HIS  53           HE1      HIS  53  13.735   0.607   7.913
  803    H    GLN  54           H        GLN  54   9.198  -3.788  11.459
  804    HA   GLN  54           HA       GLN  54  11.272  -3.453  13.435
  805   1HB   GLN  54          1HB       GLN  54   8.893  -2.987  13.823
  806   2HB   GLN  54          2HB       GLN  54   8.496  -4.682  13.535
  807   1HG   GLN  54          1HG       GLN  54   9.164  -5.315  15.611
  808   2HG   GLN  54          2HG       GLN  54  10.585  -4.271  15.570
  809   2HE2  GLN  54          2HE2      GLN  54   8.659  -4.537  17.817
  810   1HE2  GLN  54          1HE2      GLN  54   7.996  -2.994  18.057
  811    H    LEU  55           H        LEU  55   9.601  -6.337  12.134
  812    HA   LEU  55           HA       LEU  55  10.879  -8.294  13.759
  813   1HB   LEU  55          1HB       LEU  55   9.538  -8.170  11.079
  814   2HB   LEU  55          2HB       LEU  55  10.375  -9.656  11.528
  815    HG   LEU  55           HG       LEU  55   8.598  -8.461  13.592
  816   1HD1  LEU  55          1HD1      LEU  55   7.672  -8.973  10.916
  817   2HD1  LEU  55          2HD1      LEU  55   6.968 -10.164  12.010
  818   3HD1  LEU  55          3HD1      LEU  55   6.743  -8.443  12.319
  819   1HD2  LEU  55          1HD2      LEU  55   9.570 -11.136  12.681
  820   2HD2  LEU  55          2HD2      LEU  55   9.458 -10.480  14.315
  821   3HD2  LEU  55          3HD2      LEU  55   8.010 -11.073  13.501
  822    H    ARG  56           H        ARG  56  12.044  -6.453  11.025
  823    HA   ARG  56           HA       ARG  56  14.103  -8.075  10.002
  824   1HB   ARG  56          1HB       ARG  56  13.390  -5.889   9.114
  825   2HB   ARG  56          2HB       ARG  56  14.044  -5.087  10.541
  826   1HG   ARG  56          1HG       ARG  56  16.230  -6.477   9.776
  827   2HG   ARG  56          2HG       ARG  56  15.465  -6.246   8.202
  828   1HD   ARG  56          1HD       ARG  56  15.421  -3.834   8.506
  829   2HD   ARG  56          2HD       ARG  56  16.006  -3.996  10.174
  830    HE   ARG  56           HE       ARG  56  17.890  -5.366   8.662
  831   1HH1  ARG  56          1HH1      ARG  56  17.875  -3.843   6.351
  832   2HH1  ARG  56          2HH1      ARG  56  18.690  -2.362   6.728
  833   1HH2  ARG  56          1HH2      ARG  56  18.364  -2.745  10.158
  834   2HH2  ARG  56          2HH2      ARG  56  18.967  -1.741   8.882
  835    H    GLU  57           H        GLU  57  14.262  -5.806  12.771
  836    HA   GLU  57           HA       GLU  57  16.992  -6.313  13.461
  837   1HB   GLU  57          2HB       GLU  57  14.645  -5.552  15.232
  838   2HB   GLU  57          1HB       GLU  57  16.348  -5.224  15.556
  839   1HG   GLU  57          1HG       GLU  57  16.227  -4.050  13.178
  840   2HG   GLU  57          2HG       GLU  57  14.513  -3.934  13.576
  841    H    LEU  58           H        LEU  58  13.950  -7.774  14.637
  842    HA   LEU  58           HA       LEU  58  15.040  -9.510  16.596
  843   1HB   LEU  58          1HB       LEU  58  12.593  -9.151  15.033
  844   2HB   LEU  58          2HB       LEU  58  12.895 -10.846  15.416
  845    HG   LEU  58           HG       LEU  58  13.216  -8.787  17.573
  846   1HD1  LEU  58          1HD1      LEU  58  10.949  -8.582  16.279
  847   2HD1  LEU  58          2HD1      LEU  58  10.559 -10.108  17.073
  848   3HD1  LEU  58          3HD1      LEU  58  10.921  -8.678  18.040
  849   1HD2  LEU  58          1HD2      LEU  58  12.899 -11.717  17.286
  850   2HD2  LEU  58          2HD2      LEU  58  13.751 -10.793  18.524
  851   3HD2  LEU  58          3HD2      LEU  58  12.002 -10.998  18.624
  852    H    PHE  59           H        PHE  59  15.165  -9.671  13.114
  853    HA   PHE  59           HA       PHE  59  15.486 -12.421  12.610
  854   1HB   PHE  59          1HB       PHE  59  15.419 -10.404  11.034
  855   2HB   PHE  59          2HB       PHE  59  17.135 -10.197  11.381
  856    HD1  PHE  59           HD1      PHE  59  18.624 -12.377  11.135
  857    HD2  PHE  59           HD2      PHE  59  14.772 -11.812   9.269
  858    HE1  PHE  59           HE1      PHE  59  19.178 -14.137   9.461
  859    HE2  PHE  59           HE2      PHE  59  15.325 -13.573   7.594
  860    HZ   PHE  59           HZ       PHE  59  17.529 -14.736   7.690
  861    H    ILE  60           H        ILE  60  17.972 -10.049  13.613
  862    HA   ILE  60           HA       ILE  60  20.095 -12.045  13.730
  863    HB   ILE  60           HB       ILE  60  19.793  -9.221  14.807
  864   1HG1  ILE  60          1HG1      ILE  60  21.340 -10.171  12.387
  865   2HG1  ILE  60          2HG1      ILE  60  19.652  -9.671  12.281
  866   1HG2  ILE  60          1HG2      ILE  60  22.107 -11.144  14.720
  867   2HG2  ILE  60          2HG2      ILE  60  22.395  -9.407  14.629
  868   3HG2  ILE  60          3HG2      ILE  60  21.588 -10.094  16.039
  869   1HD1  ILE  60          1HD1      ILE  60  20.558  -7.557  13.618
  870   2HD1  ILE  60          2HD1      ILE  60  22.082  -8.029  12.867
  871   3HD1  ILE  60          3HD1      ILE  60  20.686  -7.644  11.860
  872    H    ALA  61           H        ALA  61  17.882 -10.536  16.065
  873    HA   ALA  61           HA       ALA  61  19.092 -11.460  18.473
  874   1HB   ALA  61          1HB       ALA  61  16.839 -10.034  17.641
  875   2HB   ALA  61          3HB       ALA  61  17.288 -10.370  19.312
  876   3HB   ALA  61          2HB       ALA  61  16.170 -11.440  18.467
  877    H    ALA  62           H        ALA  62  17.201 -13.127  16.050
  878    HA   ALA  62           HA       ALA  62  16.628 -15.436  17.797
  879   1HB   ALA  62          1HB       ALA  62  15.929 -16.197  15.299
  880   2HB   ALA  62          3HB       ALA  62  14.909 -15.155  16.291
  881   3HB   ALA  62          2HB       ALA  62  15.964 -14.448  15.067
  882    H    SER  63           H        SER  63  18.032 -15.393  14.513
  883    HA   SER  63           HA       SER  63  19.873 -17.582  15.332
  884   1HB   SER  63          1HB       SER  63  20.045 -17.939  12.933
  885   2HB   SER  63          2HB       SER  63  18.344 -17.707  13.332
  886    HG   SER  63           HG       SER  63  20.054 -16.156  11.841

  No H/Q in entry =         886
  Start of MODEL   12
    1    H    LEU   8           H        LEU   8 -34.639  15.010 -28.800
    2    HA   LEU   8           HA       LEU   8 -31.824  13.972 -28.678
    3   1HB   LEU   8          1HB       LEU   8 -33.165  14.228 -30.927
    4   2HB   LEU   8          2HB       LEU   8 -32.823  15.945 -30.717
    5    HG   LEU   8           HG       LEU   8 -30.477  14.256 -30.248
    6   1HD1  LEU   8          1HD1      LEU   8 -32.072  13.984 -32.757
    7   2HD1  LEU   8          2HD1      LEU   8 -30.320  14.104 -32.914
    8   3HD1  LEU   8          3HD1      LEU   8 -31.031  12.807 -31.955
    9   1HD2  LEU   8          1HD2      LEU   8 -31.193  16.677 -31.911
   10   2HD2  LEU   8          2HD2      LEU   8 -30.171  16.603 -30.475
   11   3HD2  LEU   8          3HD2      LEU   8 -29.598  15.929 -32.000
   12    H    GLU   9           H        GLU   9 -31.824  15.142 -26.524
   13    HA   GLU   9           HA       GLU   9 -31.174  18.030 -26.942
   14   1HB   GLU   9          1HB       GLU   9 -33.242  16.741 -25.208
   15   2HB   GLU   9          2HB       GLU   9 -32.399  18.149 -24.561
   16   1HG   GLU   9          1HG       GLU   9 -33.007  19.447 -26.565
   17   2HG   GLU   9          2HG       GLU   9 -33.844  18.040 -27.225
   18    HA   PRO  10           HA       PRO  10 -28.311  15.526 -24.122
   19   1HB   PRO  10          1HB       PRO  10 -26.137  15.363 -25.776
   20   2HB   PRO  10          2HB       PRO  10 -27.411  14.128 -25.732
   21   1HG   PRO  10          2HG       PRO  10 -26.976  16.329 -27.685
   22   2HG   PRO  10          1HG       PRO  10 -27.532  14.670 -27.957
   23   1HD   PRO  10          1HD       PRO  10 -29.195  16.838 -27.898
   24   2HD   PRO  10          2HD       PRO  10 -29.708  15.185 -27.489
   25    H    ASP  11           H        ASP  11 -27.201  17.920 -26.551
   26    HA   ASP  11           HA       ASP  11 -26.072  19.974 -26.283
   27   1HB   ASP  11          1HB       ASP  11 -27.907  19.609 -24.077
   28   2HB   ASP  11          2HB       ASP  11 -26.481  20.493 -23.529
   29    H    ASN  12           H        ASN  12 -25.623  18.848 -22.946
   30    HA   ASN  12           HA       ASN  12 -22.960  17.782 -23.362
   31   1HB   ASN  12          1HB       ASN  12 -23.011  20.429 -23.697
   32   2HB   ASN  12          2HB       ASN  12 -22.929  20.414 -21.936
   33   2HD2  ASN  12          2HD2      ASN  12 -21.306  18.063 -21.597
   34   1HD2  ASN  12          1HD2      ASN  12 -19.760  18.395 -22.216
   35    H    VAL  13           H        VAL  13 -25.425  17.161 -21.851
   36    HA   VAL  13           HA       VAL  13 -24.818  17.673 -19.030
   37    HB   VAL  13           HB       VAL  13 -26.957  16.397 -20.685
   38   1HG1  VAL  13          1HG1      VAL  13 -26.353  15.647 -17.830
   39   2HG1  VAL  13          2HG1      VAL  13 -28.021  15.700 -18.400
   40   3HG1  VAL  13          3HG1      VAL  13 -26.863  14.608 -19.161
   41   1HG2  VAL  13          1HG2      VAL  13 -26.993  18.774 -19.953
   42   2HG2  VAL  13          2HG2      VAL  13 -28.368  17.857 -19.338
   43   3HG2  VAL  13          3HG2      VAL  13 -27.010  18.230 -18.275
   44    HA   PRO  14           HA       PRO  14 -23.627  13.091 -19.122
   45   1HB   PRO  14          1HB       PRO  14 -23.623  11.725 -21.484
   46   2HB   PRO  14          2HB       PRO  14 -25.075  11.890 -20.478
   47   1HG   PRO  14          2HG       PRO  14 -24.380  13.219 -23.011
   48   2HG   PRO  14          1HG       PRO  14 -25.967  12.868 -22.312
   49   1HD   PRO  14          1HD       PRO  14 -24.627  15.352 -22.316
   50   2HD   PRO  14          2HD       PRO  14 -26.101  14.927 -21.435
   51    H    MET  15           H        MET  15 -22.746  14.523 -22.266
   52    HA   MET  15           HA       MET  15 -20.173  13.461 -22.584
   53   1HB   MET  15          1HB       MET  15 -21.677  15.000 -24.051
   54   2HB   MET  15          2HB       MET  15 -20.866  16.324 -23.213
   55   1HG   MET  15          1HG       MET  15 -18.666  15.342 -23.893
   56   2HG   MET  15          2HG       MET  15 -19.539  14.133 -24.836
   57   1HE   MET  15          1HE       MET  15 -19.470  14.304 -27.107
   58   2HE   MET  15          2HE       MET  15 -21.165  14.726 -26.873
   59   3HE   MET  15          3HE       MET  15 -20.188  15.601 -28.060
   60    H    ASP  16           H        ASP  16 -18.286  13.739 -21.445
   61    HA   ASP  16           HA       ASP  16 -16.788  14.572 -19.814
   62   1HB   ASP  16          1HB       ASP  16 -17.274  16.438 -21.683
   63   2HB   ASP  16          2HB       ASP  16 -17.914  17.299 -20.281
   64    H    MET  17           H        MET  17 -18.939  13.518 -18.534
   65    HA   MET  17           HA       MET  17 -20.600  15.190 -16.974
   66   1HB   MET  17          2HB       MET  17 -20.714  13.198 -15.501
   67   2HB   MET  17          1HB       MET  17 -20.778  12.735 -17.202
   68   1HG   MET  17          1HG       MET  17 -18.318  12.309 -17.135
   69   2HG   MET  17          2HG       MET  17 -18.336  12.658 -15.406
   70   1HE   MET  17          1HE       MET  17 -17.527  11.018 -14.501
   71   2HE   MET  17          2HE       MET  17 -18.887  10.396 -13.569
   72   3HE   MET  17          3HE       MET  17 -17.920   9.294 -14.546
   73    H    SER  18           H        SER  18 -17.226  14.218 -16.477
   74    HA   SER  18           HA       SER  18 -17.090  15.489 -13.823
   75   1HB   SER  18          1HB       SER  18 -14.838  14.469 -15.565
   76   2HB   SER  18          2HB       SER  18 -14.887  14.565 -13.808
   77    HG   SER  18           HG       SER  18 -16.765  13.077 -14.051
   78    HA   PRO  19           HA       PRO  19 -15.537  19.320 -15.335
   79   1HB   PRO  19          1HB       PRO  19 -13.940  20.120 -13.270
   80   2HB   PRO  19          2HB       PRO  19 -15.710  20.073 -13.169
   81   1HG   PRO  19          1HG       PRO  19 -13.725  18.304 -11.946
   82   2HG   PRO  19          2HG       PRO  19 -15.396  18.616 -11.477
   83   1HD   PRO  19          1HD       PRO  19 -14.374  16.366 -12.895
   84   2HD   PRO  19          2HD       PRO  19 -16.067  16.722 -12.492
   85    H    LYS  20           H        LYS  20 -13.751  16.782 -15.794
   86    HA   LYS  20           HA       LYS  20 -11.724  16.375 -16.923
   87   1HB   LYS  20          1HB       LYS  20 -12.652  18.515 -18.047
   88   2HB   LYS  20          2HB       LYS  20 -11.439  19.374 -17.100
   89   1HG   LYS  20          1HG       LYS  20 -10.686  16.984 -18.776
   90   2HG   LYS  20          2HG       LYS  20 -10.779  18.597 -19.484
   91   1HD   LYS  20          1HD       LYS  20  -9.311  19.239 -17.364
   92   2HD   LYS  20          2HD       LYS  20  -8.873  17.532 -17.438
   93   1HE   LYS  20          1HE       LYS  20  -8.190  17.806 -19.804
   94   2HE   LYS  20          2HE       LYS  20  -8.608  19.528 -19.717
   95   1HZ   LYS  20          1HZ       LYS  20  -7.112  19.659 -17.745
   96   2HZ   LYS  20          2HZ       LYS  20  -6.584  18.083 -18.094
   97   3HZ   LYS  20          3HZ       LYS  20  -6.306  19.339 -19.202
   98    H    ALA  21           H        ALA  21 -11.014  19.452 -15.211
   99    HA   ALA  21           HA       ALA  21  -8.386  18.972 -14.463
  100   1HB   ALA  21          1HB       ALA  21  -9.883  21.001 -14.104
  101   2HB   ALA  21          2HB       ALA  21  -8.784  20.635 -12.774
  102   3HB   ALA  21          3HB       ALA  21 -10.488  20.194 -12.658
  103    H    LEU  22           H        LEU  22 -11.280  17.987 -12.603
  104    HA   LEU  22           HA       LEU  22  -9.684  16.549 -10.606
  105   1HB   LEU  22          1HB       LEU  22 -12.614  16.917 -11.257
  106   2HB   LEU  22          2HB       LEU  22 -12.094  15.816  -9.981
  107    HG   LEU  22           HG       LEU  22 -10.792  17.734  -8.976
  108   1HD1  LEU  22          1HD1      LEU  22 -12.107  19.090 -11.297
  109   2HD1  LEU  22          2HD1      LEU  22 -11.895  20.002  -9.803
  110   3HD1  LEU  22          3HD1      LEU  22 -10.493  19.328 -10.633
  111   1HD2  LEU  22          1HD2      LEU  22 -13.315  16.985  -8.525
  112   2HD2  LEU  22          2HD2      LEU  22 -12.629  18.404  -7.732
  113   3HD2  LEU  22          3HD2      LEU  22 -13.652  18.597  -9.156
  114    H    GLN  23           H        GLN  23 -11.780  15.750 -13.349
  115    HA   GLN  23           HA       GLN  23 -11.884  12.948 -13.169
  116   1HB   GLN  23          1HB       GLN  23 -13.040  14.435 -14.809
  117   2HB   GLN  23          2HB       GLN  23 -11.506  14.662 -15.646
  118   1HG   GLN  23          1HG       GLN  23 -11.588  11.949 -15.520
  119   2HG   GLN  23          2HG       GLN  23 -13.311  12.314 -15.618
  120   2HE2  GLN  23          2HE2      GLN  23 -12.664  11.106 -17.848
  121   1HE2  GLN  23          1HE2      GLN  23 -12.320  12.160 -19.134
  122    H    GLN  24           H        GLN  24  -9.334  14.947 -14.692
  123    HA   GLN  24           HA       GLN  24  -7.694  12.669 -15.439
  124   1HB   GLN  24          1HB       GLN  24  -7.697  14.882 -16.563
  125   2HB   GLN  24          2HB       GLN  24  -7.054  15.617 -15.094
  126   1HG   GLN  24          2HG       GLN  24  -5.096  15.249 -16.299
  127   2HG   GLN  24          1HG       GLN  24  -5.189  13.770 -15.341
  128   2HE2  GLN  24          2HE2      GLN  24  -4.575  12.063 -16.682
  129   1HE2  GLN  24          1HE2      GLN  24  -5.114  11.838 -18.276
  130    H    LYS  25           H        LYS  25  -7.487  15.117 -12.831
  131    HA   LYS  25           HA       LYS  25  -5.122  14.169 -11.582
  132   1HB   LYS  25          1HB       LYS  25  -7.361  15.945 -11.067
  133   2HB   LYS  25          2HB       LYS  25  -6.869  15.120  -9.587
  134   1HG   LYS  25          2HG       LYS  25  -5.302  16.769  -9.471
  135   2HG   LYS  25          1HG       LYS  25  -4.438  15.771 -10.641
  136   1HD   LYS  25          1HD       LYS  25  -5.626  17.029 -12.475
  137   2HD   LYS  25          2HD       LYS  25  -6.261  18.116 -11.239
  138   1HE   LYS  25          1HE       LYS  25  -4.122  18.975 -10.717
  139   2HE   LYS  25          2HE       LYS  25  -3.291  17.595 -11.463
  140   1HZ   LYS  25          1HZ       LYS  25  -5.027  19.494 -12.947
  141   2HZ   LYS  25          2HZ       LYS  25  -3.336  19.608 -12.892
  142   3HZ   LYS  25          3HZ       LYS  25  -4.072  18.255 -13.608
  143    H    ILE  26           H        ILE  26  -8.534  13.263 -11.002
  144    HA   ILE  26           HA       ILE  26  -8.041  11.426  -8.862
  145    HB   ILE  26           HB       ILE  26 -10.205  11.583 -10.986
  146   1HG1  ILE  26          1HG1      ILE  26 -10.324  12.519  -8.114
  147   2HG1  ILE  26          2HG1      ILE  26  -9.745  13.571  -9.406
  148   1HG2  ILE  26          1HG2      ILE  26  -9.709   9.521  -9.145
  149   2HG2  ILE  26          2HG2      ILE  26 -10.989  10.487  -8.412
  150   3HG2  ILE  26          3HG2      ILE  26 -11.210   9.808 -10.025
  151   1HD1  ILE  26          1HD1      ILE  26 -12.332  12.131  -9.823
  152   2HD1  ILE  26          2HD1      ILE  26 -12.321  13.517  -8.732
  153   3HD1  ILE  26          3HD1      ILE  26 -11.822  13.714 -10.412
  154    H    HIS  27           H        HIS  27  -8.625  10.769 -12.344
  155    HA   HIS  27           HA       HIS  27  -8.121   7.973 -12.260
  156   1HB   HIS  27          1HB       HIS  27  -8.947   9.784 -14.090
  157   2HB   HIS  27          2HB       HIS  27  -7.288   9.551 -14.643
  158    HD1  HIS  27           HD1      HIS  27  -7.634   8.039 -16.637
  159    HD2  HIS  27           HD2      HIS  27  -9.630   6.658 -13.248
  160    HE1  HIS  27           HE1      HIS  27  -8.532   5.743 -17.220
  161    H    GLU  28           H        GLU  28  -5.923  10.704 -12.260
  162    HA   GLU  28           HA       GLU  28  -3.564   9.153 -13.036
  163   1HB   GLU  28          1HB       GLU  28  -4.184  11.922 -12.021
  164   2HB   GLU  28          2HB       GLU  28  -2.511  11.373 -12.129
  165   1HG   GLU  28          1HG       GLU  28  -4.400  11.110 -14.468
  166   2HG   GLU  28          2HG       GLU  28  -3.491  12.595 -14.184
  167    H    LEU  29           H        LEU  29  -4.711  10.644  -9.982
  168    HA   LEU  29           HA       LEU  29  -2.611   9.629  -8.325
  169   1HB   LEU  29          1HB       LEU  29  -5.248  10.916  -8.091
  170   2HB   LEU  29          2HB       LEU  29  -4.837   9.898  -6.711
  171    HG   LEU  29           HG       LEU  29  -2.635  11.073  -6.558
  172   1HD1  LEU  29          1HD1      LEU  29  -3.771  12.403  -8.970
  173   2HD1  LEU  29          2HD1      LEU  29  -2.871  13.422  -7.847
  174   3HD1  LEU  29          3HD1      LEU  29  -2.094  12.020  -8.583
  175   1HD2  LEU  29          1HD2      LEU  29  -5.279  12.433  -6.242
  176   2HD2  LEU  29          2HD2      LEU  29  -4.090  11.995  -5.015
  177   3HD2  LEU  29          3HD2      LEU  29  -3.826  13.412  -6.032
  178    H    GLU  30           H        GLU  30  -5.726   8.254  -9.326
  179    HA   GLU  30           HA       GLU  30  -5.869   6.064  -7.521
  180   1HB   GLU  30          1HB       GLU  30  -7.640   6.871  -9.076
  181   2HB   GLU  30          2HB       GLU  30  -6.705   6.246 -10.434
  182   1HG   GLU  30          1HG       GLU  30  -6.821   4.084  -8.701
  183   2HG   GLU  30          2HG       GLU  30  -8.420   4.812  -8.546
  184    H    GLY  31           H        GLY  31  -4.206   6.368 -10.663
  185   1HA   GLY  31          2HA       GLY  31  -2.765   4.850 -11.759
  186   2HA   GLY  31          1HA       GLY  31  -3.276   3.604 -10.621
  187    H    LEU  32           H        LEU  32  -2.038   6.724  -9.578
  188    HA   LEU  32           HA       LEU  32   0.721   6.006  -9.270
  189   1HB   LEU  32          1HB       LEU  32  -0.417   8.292  -9.236
  190   2HB   LEU  32          2HB       LEU  32  -0.902   7.925  -7.580
  191    HG   LEU  32           HG       LEU  32   1.647   7.372  -7.253
  192   1HD1  LEU  32          1HD1      LEU  32   2.215   7.588  -9.649
  193   2HD1  LEU  32          2HD1      LEU  32   1.691   9.272  -9.619
  194   3HD1  LEU  32          3HD1      LEU  32   3.096   8.768  -8.679
  195   1HD2  LEU  32          1HD2      LEU  32   0.086   9.440  -6.530
  196   2HD2  LEU  32          2HD2      LEU  32   1.819   9.417  -6.204
  197   3HD2  LEU  32          3HD2      LEU  32   1.195  10.300  -7.598
  198    H    MET  33           H        MET  33  -2.126   5.445  -7.272
  199    HA   MET  33           HA       MET  33  -0.844   4.826  -4.796
  200   1HB   MET  33          1HB       MET  33  -3.428   4.755  -6.011
  201   2HB   MET  33          2HB       MET  33  -3.154   3.186  -5.252
  202   1HG   MET  33          1HG       MET  33  -3.075   4.067  -3.134
  203   2HG   MET  33          2HG       MET  33  -2.362   5.585  -3.681
  204   1HE   MET  33          1HE       MET  33  -5.532   3.376  -3.513
  205   2HE   MET  33          2HE       MET  33  -6.761   4.379  -4.295
  206   3HE   MET  33          3HE       MET  33  -5.407   3.751  -5.229
  207    H    MET  34           H        MET  34  -2.116   2.511  -7.228
  208    HA   MET  34           HA       MET  34  -0.932   0.181  -6.126
  209   1HB   MET  34          2HB       MET  34  -1.514   0.872  -9.025
  210   2HB   MET  34          1HB       MET  34  -1.404  -0.753  -8.348
  211   1HG   MET  34          1HG       MET  34  -3.239   0.279  -6.670
  212   2HG   MET  34          2HG       MET  34  -3.581   1.260  -8.096
  213   1HE   MET  34          1HE       MET  34  -4.453  -1.622  -6.200
  214   2HE   MET  34          2HE       MET  34  -4.602  -3.029  -7.249
  215   3HE   MET  34          3HE       MET  34  -3.002  -2.415  -6.808
  216    H    GLN  35           H        GLN  35   0.415   2.646  -8.272
  217    HA   GLN  35           HA       GLN  35   2.688   1.323  -9.277
  218   1HB   GLN  35          1HB       GLN  35   1.957   3.557  -9.943
  219   2HB   GLN  35          2HB       GLN  35   2.292   4.180  -8.328
  220   1HG   GLN  35          2HG       GLN  35   4.343   4.709  -9.124
  221   2HG   GLN  35          1HG       GLN  35   4.688   2.981  -9.046
  222   2HE2  GLN  35          2HE2      GLN  35   4.190   5.661 -11.205
  223   1HE2  GLN  35          1HE2      GLN  35   4.304   4.783 -12.653
  224    H    HIS  36           H        HIS  36   3.041   3.677  -6.619
  225    HA   HIS  36           HA       HIS  36   5.475   2.639  -5.623
  226   1HB   HIS  36          1HB       HIS  36   3.203   4.264  -4.490
  227   2HB   HIS  36          2HB       HIS  36   4.611   3.876  -3.499
  228    HD1  HIS  36           HD1      HIS  36   3.555   6.650  -5.173
  229    HD2  HIS  36           HD2      HIS  36   7.021   4.379  -5.632
  230    HE1  HIS  36           HE1      HIS  36   5.250   8.151  -6.309
  231    H    ALA  37           H        ALA  37   2.144   2.008  -4.437
  232    HA   ALA  37           HA       ALA  37   2.666   0.286  -2.296
  233   1HB   ALA  37          1HB       ALA  37   0.452  -0.790  -3.139
  234   2HB   ALA  37          2HB       ALA  37   0.433   0.932  -2.759
  235   3HB   ALA  37          3HB       ALA  37   0.537   0.400  -4.438
  236    H    GLN  38           H        GLN  38   2.607  -0.482  -5.782
  237    HA   GLN  38           HA       GLN  38   2.977  -3.317  -5.544
  238   1HB   GLN  38          1HB       GLN  38   3.240  -1.173  -7.590
  239   2HB   GLN  38          2HB       GLN  38   4.115  -2.669  -7.921
  240   1HG   GLN  38          1HG       GLN  38   2.085  -3.975  -7.708
  241   2HG   GLN  38          2HG       GLN  38   1.179  -2.558  -7.175
  242   2HE2  GLN  38          2HE2      GLN  38   2.855  -3.967 -10.002
  243   1HE2  GLN  38          1HE2      GLN  38   2.054  -3.012 -11.154
  244    H    ASN  39           H        ASN  39   5.207  -0.575  -5.555
  245    HA   ASN  39           HA       ASN  39   7.578  -2.355  -5.490
  246   1HB   ASN  39          2HB       ASN  39   7.267   0.664  -5.344
  247   2HB   ASN  39          1HB       ASN  39   8.774  -0.208  -5.627
  248   2HD2  ASN  39          2HD2      ASN  39   7.546   1.700  -7.503
  249   1HD2  ASN  39          1HD2      ASN  39   7.180   0.830  -8.914
  250    H    LEU  40           H        LEU  40   5.405  -1.909  -3.260
  251    HA   LEU  40           HA       LEU  40   5.378  -1.833  -0.920
  252   1HB   LEU  40          1HB       LEU  40   8.134  -2.742  -1.701
  253   2HB   LEU  40          2HB       LEU  40   7.756  -2.491   0.002
  254    HG   LEU  40           HG       LEU  40   5.615  -3.918  -0.571
  255   1HD1  LEU  40          1HD1      LEU  40   7.411  -4.269  -2.914
  256   2HD1  LEU  40          2HD1      LEU  40   6.678  -5.736  -2.265
  257   3HD1  LEU  40          3HD1      LEU  40   5.655  -4.407  -2.810
  258   1HD2  LEU  40          1HD2      LEU  40   8.422  -5.023  -0.256
  259   2HD2  LEU  40          2HD2      LEU  40   7.274  -4.653   1.031
  260   3HD2  LEU  40          3HD2      LEU  40   6.963  -5.997  -0.069
  261    H    GLU  41           H        GLU  41   6.185   0.649  -2.530
  262    HA   GLU  41           HA       GLU  41   8.099   2.130  -0.943
  263   1HB   GLU  41          1HB       GLU  41   6.165   2.552  -3.140
  264   2HB   GLU  41          2HB       GLU  41   6.463   3.982  -2.149
  265   1HG   GLU  41          1HG       GLU  41   8.749   2.308  -3.179
  266   2HG   GLU  41          2HG       GLU  41   8.028   3.572  -4.176
  267    H    PHE  42           H        PHE  42   4.550   1.954  -1.013
  268    HA   PHE  42           HA       PHE  42   2.933   2.677   0.539
  269   1HB   PHE  42          1HB       PHE  42   5.263   1.521   2.020
  270   2HB   PHE  42          2HB       PHE  42   3.960   2.248   2.959
  271    HD1  PHE  42           HD1      PHE  42   1.551   1.639   1.417
  272    HD2  PHE  42           HD2      PHE  42   5.021  -0.816   2.176
  273    HE1  PHE  42           HE1      PHE  42   0.171  -0.412   1.099
  274    HE2  PHE  42           HE2      PHE  42   3.641  -2.865   1.856
  275    HZ   PHE  42           HZ       PHE  42   1.214  -2.660   1.322
  276    H    GLU  43           H        GLU  43   2.790   4.043   2.707
  277    HA   GLU  43           HA       GLU  43   2.935   6.124   3.761
  278   1HB   GLU  43          1HB       GLU  43   5.299   5.554   4.057
  279   2HB   GLU  43          2HB       GLU  43   5.661   6.068   2.413
  280   1HG   GLU  43          1HG       GLU  43   4.738   8.349   3.051
  281   2HG   GLU  43          2HG       GLU  43   4.765   7.789   4.725
  282    H    GLU  44           H        GLU  44   4.602   6.464   0.665
  283    HA   GLU  44           HA       GLU  44   3.118   8.918   0.018
  284   1HB   GLU  44          2HB       GLU  44   4.592   8.910  -1.942
  285   2HB   GLU  44          1HB       GLU  44   5.535   8.537  -0.500
  286   1HG   GLU  44          1HG       GLU  44   5.503   6.168  -1.017
  287   2HG   GLU  44          2HG       GLU  44   4.389   6.435  -2.358
  288    H    ALA  45           H        ALA  45   3.072   5.494  -0.841
  289    HA   ALA  45           HA       ALA  45   1.240   5.835  -3.098
  290   1HB   ALA  45          1HB       ALA  45   1.594   3.230  -1.705
  291   2HB   ALA  45          3HB       ALA  45   3.054   3.986  -2.341
  292   3HB   ALA  45          2HB       ALA  45   1.714   3.611  -3.423
  293    H    ALA  46           H        ALA  46   0.942   4.543   0.231
  294    HA   ALA  46           HA       ALA  46  -1.907   4.043  -0.029
  295   1HB   ALA  46          1HB       ALA  46  -0.200   2.905   1.472
  296   2HB   ALA  46          3HB       ALA  46  -0.249   4.349   2.485
  297   3HB   ALA  46          2HB       ALA  46  -1.703   3.373   2.267
  298    H    GLN  47           H        GLN  47  -0.022   6.862   0.765
  299    HA   GLN  47           HA       GLN  47  -2.038   8.223   2.346
  300   1HB   GLN  47          1HB       GLN  47   0.537   8.826   0.979
  301   2HB   GLN  47          2HB       GLN  47  -0.509  10.199   1.336
  302   1HG   GLN  47          1HG       GLN  47  -0.611   9.549   3.695
  303   2HG   GLN  47          2HG       GLN  47   0.372   8.122   3.362
  304   2HE2  GLN  47          2HE2      GLN  47   2.307   8.660   4.465
  305   1HE2  GLN  47          1HE2      GLN  47   3.225  10.048   4.132
  306    H    ILE  48           H        ILE  48  -1.208   8.161  -1.120
  307    HA   ILE  48           HA       ILE  48  -2.787  10.254  -2.111
  308    HB   ILE  48           HB       ILE  48  -2.269   7.458  -3.177
  309   1HG1  ILE  48          1HG1      ILE  48  -0.260   8.819  -2.693
  310   2HG1  ILE  48          2HG1      ILE  48  -0.467   8.586  -4.429
  311   1HG2  ILE  48          1HG2      ILE  48  -3.776   9.743  -4.282
  312   2HG2  ILE  48          2HG2      ILE  48  -2.550   9.084  -5.366
  313   3HG2  ILE  48          3HG2      ILE  48  -3.823   8.039  -4.735
  314   1HD1  ILE  48          1HD1      ILE  48  -1.943  10.888  -3.876
  315   2HD1  ILE  48          2HD1      ILE  48  -0.495  11.058  -2.885
  316   3HD1  ILE  48          3HD1      ILE  48  -0.349  10.831  -4.627
  317    H    ARG  49           H        ARG  49  -3.791   7.140  -0.837
  318    HA   ARG  49           HA       ARG  49  -6.423   6.925  -1.838
  319   1HB   ARG  49          1HB       ARG  49  -5.460   5.141  -0.595
  320   2HB   ARG  49          2HB       ARG  49  -5.033   6.195   0.747
  321   1HG   ARG  49          1HG       ARG  49  -7.883   6.301   0.335
  322   2HG   ARG  49          2HG       ARG  49  -7.373   4.618   0.462
  323   1HD   ARG  49          1HD       ARG  49  -7.894   5.643   2.697
  324   2HD   ARG  49          2HD       ARG  49  -6.207   5.103   2.577
  325    HE   ARG  49           HE       ARG  49  -5.603   7.482   2.052
  326   1HH1  ARG  49          1HH1      ARG  49  -8.876   7.630   2.005
  327   2HH1  ARG  49          2HH1      ARG  49  -9.055   8.830   3.241
  328   1HH2  ARG  49          1HH2      ARG  49  -5.744   8.663   4.256
  329   2HH2  ARG  49          2HH2      ARG  49  -7.283   9.415   4.515
  330    H    ASP  50           H        ASP  50  -5.055   9.143   0.497
  331    HA   ASP  50           HA       ASP  50  -7.607   9.990   1.645
  332   1HB   ASP  50          1HB       ASP  50  -5.244  10.056   2.657
  333   2HB   ASP  50          2HB       ASP  50  -4.960  11.458   1.624
  334    H    GLN  51           H        GLN  51  -5.476  11.052  -0.974
  335    HA   GLN  51           HA       GLN  51  -6.920  13.547  -1.459
  336   1HB   GLN  51          2HB       GLN  51  -4.985  11.955  -3.177
  337   2HB   GLN  51          1HB       GLN  51  -5.395  13.659  -3.380
  338   1HG   GLN  51          1HG       GLN  51  -4.498  14.119  -1.105
  339   2HG   GLN  51          2HG       GLN  51  -4.021  12.426  -0.973
  340   2HE2  GLN  51          2HE2      GLN  51  -3.769  14.694  -3.765
  341   1HE2  GLN  51          1HE2      GLN  51  -2.090  14.521  -3.943
  342    H    LEU  52           H        LEU  52  -6.830  10.302  -2.938
  343    HA   LEU  52           HA       LEU  52  -8.589  10.833  -5.128
  344   1HB   LEU  52          1HB       LEU  52  -7.100   8.730  -4.089
  345   2HB   LEU  52          2HB       LEU  52  -8.763   8.164  -3.922
  346    HG   LEU  52           HG       LEU  52  -7.830   7.530  -6.118
  347   1HD1  LEU  52          1HD1      LEU  52 -10.288   8.458  -5.656
  348   2HD1  LEU  52          2HD1      LEU  52  -9.760   9.719  -6.769
  349   3HD1  LEU  52          3HD1      LEU  52  -9.762   8.032  -7.284
  350   1HD2  LEU  52          1HD2      LEU  52  -6.648  10.064  -5.983
  351   2HD2  LEU  52          2HD2      LEU  52  -6.609   8.968  -7.365
  352   3HD2  LEU  52          3HD2      LEU  52  -7.855  10.213  -7.261
  353    H    HIS  53           H        HIS  53  -9.218   9.740  -1.792
  354    HA   HIS  53           HA       HIS  53 -12.075   9.410  -2.157
  355   1HB   HIS  53          1HB       HIS  53 -10.046   9.385   0.009
  356   2HB   HIS  53          2HB       HIS  53 -11.695   9.748   0.517
  357    HD1  HIS  53           HD1      HIS  53  -9.539   7.003  -0.774
  358    HD2  HIS  53           HD2      HIS  53 -13.589   7.626  -0.008
  359    HE1  HIS  53           HE1      HIS  53 -10.640   4.724  -0.844
  360    H    GLN  54           H        GLN  54 -10.026  12.017  -0.829
  361    HA   GLN  54           HA       GLN  54 -12.178  13.750  -0.036
  362   1HB   GLN  54          1HB       GLN  54  -9.240  13.898  -0.550
  363   2HB   GLN  54          2HB       GLN  54 -10.119  15.425  -0.470
  364   1HG   GLN  54          1HG       GLN  54 -11.168  14.403   1.703
  365   2HG   GLN  54          2HG       GLN  54  -9.763  13.338   1.663
  366   2HE2  GLN  54          2HE2      GLN  54 -10.756  16.747   1.941
  367   1HE2  GLN  54          1HE2      GLN  54  -9.268  17.305   2.539
  368    H    LEU  55           H        LEU  55 -10.350  13.397  -3.069
  369    HA   LEU  55           HA       LEU  55 -11.399  15.708  -4.405
  370   1HB   LEU  55          1HB       LEU  55  -9.900  13.242  -4.994
  371   2HB   LEU  55          2HB       LEU  55 -10.850  13.834  -6.357
  372    HG   LEU  55           HG       LEU  55  -9.723  16.148  -5.327
  373   1HD1  LEU  55          1HD1      LEU  55  -7.818  13.815  -5.077
  374   2HD1  LEU  55          2HD1      LEU  55  -7.243  15.465  -5.321
  375   3HD1  LEU  55          3HD1      LEU  55  -8.179  15.060  -3.882
  376   1HD2  LEU  55          1HD2      LEU  55  -9.987  15.245  -7.727
  377   2HD2  LEU  55          2HD2      LEU  55  -8.555  16.218  -7.397
  378   3HD2  LEU  55          3HD2      LEU  55  -8.428  14.461  -7.476
  379    H    ARG  56           H        ARG  56 -12.767  12.579  -3.708
  380    HA   ARG  56           HA       ARG  56 -14.693  12.348  -5.793
  381   1HB   ARG  56          1HB       ARG  56 -14.079  10.598  -4.156
  382   2HB   ARG  56          2HB       ARG  56 -14.820  11.544  -2.866
  383   1HG   ARG  56          1HG       ARG  56 -16.949  11.483  -4.379
  384   2HG   ARG  56          2HG       ARG  56 -16.148  10.117  -5.158
  385   1HD   ARG  56          1HD       ARG  56 -16.171   8.818  -3.181
  386   2HD   ARG  56          2HD       ARG  56 -16.448  10.236  -2.151
  387    HE   ARG  56           HE       ARG  56 -18.639  10.296  -3.784
  388   1HH1  ARG  56          1HH1      ARG  56 -18.674   7.507  -4.428
  389   2HH1  ARG  56          2HH1      ARG  56 -19.447   6.752  -3.074
  390   1HH2  ARG  56          1HH2      ARG  56 -18.970   9.457  -0.957
  391   2HH2  ARG  56          2HH2      ARG  56 -19.615   7.857  -1.109
  392    H    GLU  57           H        GLU  57 -15.345  13.455  -2.442
  393    HA   GLU  57           HA       GLU  57 -17.905  14.542  -2.911
  394   1HB   GLU  57          1HB       GLU  57 -17.409  15.828  -0.837
  395   2HB   GLU  57          2HB       GLU  57 -16.881  14.150  -0.707
  396   1HG   GLU  57          1HG       GLU  57 -14.596  14.739  -1.100
  397   2HG   GLU  57          2HG       GLU  57 -15.035  16.373  -1.601
  398    H    LEU  58           H        LEU  58 -14.755  15.809  -3.740
  399    HA   LEU  58           HA       LEU  58 -15.461  18.588  -4.018
  400   1HB   LEU  58          1HB       LEU  58 -13.267  16.745  -4.609
  401   2HB   LEU  58          2HB       LEU  58 -13.424  18.009  -5.830
  402    HG   LEU  58           HG       LEU  58 -13.662  18.896  -3.008
  403   1HD1  LEU  58          1HD1      LEU  58 -11.060  17.923  -4.222
  404   2HD1  LEU  58          2HD1      LEU  58 -11.159  18.954  -2.793
  405   3HD1  LEU  58          3HD1      LEU  58 -11.832  17.324  -2.753
  406   1HD2  LEU  58          1HD2      LEU  58 -12.432  19.870  -5.586
  407   2HD2  LEU  58          2HD2      LEU  58 -13.722  20.608  -4.636
  408   3HD2  LEU  58          3HD2      LEU  58 -12.060  20.654  -4.051
  409    H    PHE  59           H        PHE  59 -16.103  15.780  -5.969
  410    HA   PHE  59           HA       PHE  59 -16.303  16.812  -8.575
  411   1HB   PHE  59          1HB       PHE  59 -16.603  14.459  -7.918
  412   2HB   PHE  59          2HB       PHE  59 -18.105  14.870  -7.091
  413    HD1  PHE  59           HD1      PHE  59 -20.004  15.941  -8.478
  414    HD2  PHE  59           HD2      PHE  59 -16.597  13.955 -10.235
  415    HE1  PHE  59           HE1      PHE  59 -21.256  15.685 -10.618
  416    HE2  PHE  59           HE2      PHE  59 -17.848  13.700 -12.376
  417    HZ   PHE  59           HZ       PHE  59 -20.178  14.565 -12.567
  418    H    ILE  60           H        ILE  60 -18.656  17.038  -5.904
  419    HA   ILE  60           HA       ILE  60 -20.678  18.400  -7.493
  420    HB   ILE  60           HB       ILE  60 -20.233  18.204  -4.495
  421   1HG1  ILE  60          1HG1      ILE  60 -22.287  16.492  -5.621
  422   2HG1  ILE  60          2HG1      ILE  60 -20.727  16.169  -6.378
  423   1HG2  ILE  60          1HG2      ILE  60 -22.435  19.226  -6.226
  424   2HG2  ILE  60          2HG2      ILE  60 -22.898  18.300  -4.798
  425   3HG2  ILE  60          3HG2      ILE  60 -21.925  19.760  -4.625
  426   1HD1  ILE  60          1HD1      ILE  60 -19.828  16.238  -3.911
  427   2HD1  ILE  60          2HD1      ILE  60 -21.512  15.928  -3.489
  428   3HD1  ILE  60          3HD1      ILE  60 -20.632  14.783  -4.502
  429    H    ALA  61           H        ALA  61 -18.255  19.459  -5.084
  430    HA   ALA  61           HA       ALA  61 -18.933  22.226  -5.049
  431   1HB   ALA  61          1HB       ALA  61 -16.836  20.427  -4.162
  432   2HB   ALA  61          3HB       ALA  61 -17.367  21.946  -3.441
  433   3HB   ALA  61          2HB       ALA  61 -16.145  21.954  -4.713
  434    H    ALA  62           H        ALA  62 -17.204  20.302  -7.406
  435    HA   ALA  62           HA       ALA  62 -16.280  22.761  -8.828
  436   1HB   ALA  62          1HB       ALA  62 -15.036  20.412  -8.200
  437   2HB   ALA  62          3HB       ALA  62 -14.560  21.436  -9.555
  438   3HB   ALA  62          2HB       ALA  62 -15.617  20.051  -9.826
  439    H    SER  63           H        SER  63 -17.618  19.571  -9.789
  440    HA   SER  63           HA       SER  63 -18.868  20.807 -12.166
  441   1HB   SER  63          1HB       SER  63 -17.664  18.666 -12.299
  442   2HB   SER  63          2HB       SER  63 -18.738  17.969 -11.090
  443    HG   SER  63           HG       SER  63 -19.491  18.993 -13.634
  444    H    LEU   8           H        LEU   8  34.332 -32.291   5.252
  445    HA   LEU   8           HA       LEU   8  31.497 -31.850   4.366
  446   1HB   LEU   8          1HB       LEU   8  32.805 -34.090   3.928
  447   2HB   LEU   8          2HB       LEU   8  32.506 -34.381   5.641
  448    HG   LEU   8           HG       LEU   8  30.131 -33.422   4.220
  449   1HD1  LEU   8          1HD1      LEU   8  31.677 -35.761   3.196
  450   2HD1  LEU   8          2HD1      LEU   8  29.926 -35.930   3.312
  451   3HD1  LEU   8          3HD1      LEU   8  30.625 -34.645   2.327
  452   1HD2  LEU   8          1HD2      LEU   8  30.872 -35.720   6.040
  453   2HD2  LEU   8          2HD2      LEU   8  29.872 -34.314   6.410
  454   3HD2  LEU   8          3HD2      LEU   8  29.260 -35.574   5.339
  455    H    GLU   9           H        GLU   9  31.559 -30.125   6.105
  456    HA   GLU   9           HA       GLU   9  30.966 -31.351   8.766
  457   1HB   GLU   9          1HB       GLU   9  33.032 -29.339   7.979
  458   2HB   GLU   9          2HB       GLU   9  32.230 -29.117   9.534
  459   1HG   GLU   9          1HG       GLU   9  32.835 -31.416  10.184
  460   2HG   GLU   9          2HG       GLU   9  33.629 -31.650   8.627
  461    HA   PRO  10           HA       PRO  10  28.094 -27.903   7.254
  462   1HB   PRO  10          1HB       PRO  10  25.890 -29.419   6.679
  463   2HB   PRO  10          2HB       PRO  10  27.138 -29.034   5.476
  464   1HG   PRO  10          2HG       PRO  10  26.718 -31.533   7.032
  465   2HG   PRO  10          1HG       PRO  10  27.233 -31.321   5.352
  466   1HD   PRO  10          1HD       PRO  10  28.945 -31.905   7.400
  467   2HD   PRO  10          2HD       PRO  10  29.428 -31.042   5.924
  468    H    ASP  11           H        ASP  11  26.996 -30.909   8.877
  469    HA   ASP  11           HA       ASP  11  25.918 -31.233  10.949
  470   1HB   ASP  11          1HB       ASP  11  27.780 -29.033  11.187
  471   2HB   ASP  11          2HB       ASP  11  26.384 -28.749  12.228
  472    H    ASN  12           H        ASN  12  25.499 -27.708  10.843
  473    HA   ASN  12           HA       ASN  12  22.807 -27.775   9.771
  474   1HB   ASN  12          1HB       ASN  12  22.911 -28.859  12.208
  475   2HB   ASN  12          2HB       ASN  12  22.857 -27.166  12.702
  476   2HD2  ASN  12          2HD2      ASN  12  21.188 -26.151  10.591
  477   1HD2  ASN  12          1HD2      ASN  12  19.641 -26.825  10.770
  478    H    VAL  13           H        VAL  13  25.281 -26.172   9.547
  479    HA   VAL  13           HA       VAL  13  24.733 -23.613  10.866
  480    HB   VAL  13           HB       VAL  13  26.815 -24.849   9.112
  481   1HG1  VAL  13          1HG1      VAL  13  26.242 -21.894   9.232
  482   2HG1  VAL  13          2HG1      VAL  13  27.901 -22.472   9.075
  483   3HG1  VAL  13          3HG1      VAL  13  26.706 -22.874   7.842
  484   1HG2  VAL  13          1HG2      VAL  13  26.915 -24.834  11.597
  485   2HG2  VAL  13          2HG2      VAL  13  28.280 -23.994  10.861
  486   3HG2  VAL  13          3HG2      VAL  13  26.949 -23.071  11.559
  487    HA   PRO  14           HA       PRO  14  23.440 -22.369   6.482
  488   1HB   PRO  14          1HB       PRO  14  23.367 -24.237   4.496
  489   2HB   PRO  14          2HB       PRO  14  24.839 -23.335   4.907
  490   1HG   PRO  14          2HG       PRO  14  24.132 -26.137   5.467
  491   2HG   PRO  14          1HG       PRO  14  25.721 -25.382   5.291
  492   1HD   PRO  14          1HD       PRO  14  24.437 -26.089   7.703
  493   2HD   PRO  14          2HD       PRO  14  25.915 -25.136   7.512
  494    H    MET  15           H        MET  15  22.538 -25.785   6.971
  495    HA   MET  15           HA       MET  15  19.937 -25.759   5.930
  496   1HB   MET  15          1HB       MET  15  21.452 -27.622   6.944
  497   2HB   MET  15          2HB       MET  15  20.684 -27.193   8.473
  498   1HG   MET  15          1HG       MET  15  18.452 -27.541   7.393
  499   2HG   MET  15          2HG       MET  15  19.283 -28.103   5.942
  500   1HE   MET  15          1HE       MET  15  19.181 -30.327   5.453
  501   2HE   MET  15          2HE       MET  15  20.888 -30.239   5.881
  502   3HE   MET  15          3HE       MET  15  19.912 -31.618   6.403
  503    H    ASP  16           H        ASP  16  18.076 -24.731   6.572
  504    HA   ASP  16           HA       ASP  16  16.624 -23.395   7.878
  505   1HB   ASP  16          1HB       ASP  16  17.120 -25.727   9.115
  506   2HB   ASP  16          2HB       ASP  16  17.803 -24.640  10.325
  507    H    MET  17           H        MET  17  18.772 -21.886   7.183
  508    HA   MET  17           HA       MET  17  20.495 -20.889   9.189
  509   1HB   MET  17          2HB       MET  17  20.589 -18.906   7.704
  510   2HB   MET  17          1HB       MET  17  20.614 -20.402   6.768
  511   1HG   MET  17          1HG       MET  17  18.147 -20.192   6.443
  512   2HG   MET  17          2HG       MET  17  18.201 -18.637   7.274
  513   1HE   MET  17          1HE       MET  17  17.372 -17.290   5.986
  514   2HE   MET  17          2HE       MET  17  18.733 -16.232   5.624
  515   3HE   MET  17          3HE       MET  17  17.726 -16.840   4.312
  516    H    SER  18           H        SER  18  17.109 -20.102   8.489
  517    HA   SER  18           HA       SER  18  17.044 -17.925  10.473
  518   1HB   SER  18          1HB       SER  18  14.743 -19.279   9.052
  519   2HB   SER  18          2HB       SER  18  14.821 -17.623   9.650
  520    HG   SER  18           HG       SER  18  16.662 -17.445   8.107
  521    HA   PRO  19           HA       PRO  19  15.551 -20.462  13.746
  522   1HB   PRO  19          1HB       PRO  19  14.007 -18.701  15.147
  523   2HB   PRO  19          2HB       PRO  19  15.776 -18.607  15.086
  524   1HG   PRO  19          1HG       PRO  19  13.773 -16.909  13.794
  525   2HG   PRO  19          2HG       PRO  19  15.458 -16.564  14.185
  526   1HD   PRO  19          1HD       PRO  19  14.363 -17.264  11.649
  527   2HD   PRO  19          2HD       PRO  19  16.070 -16.997  12.062
  528    H    LYS  20           H        LYS  20  13.702 -20.155  11.229
  529    HA   LYS  20           HA       LYS  20  11.649 -21.100  10.566
  530   1HB   LYS  20          1HB       LYS  20  12.605 -22.801  12.268
  531   2HB   LYS  20          2HB       LYS  20  11.426 -22.130  13.395
  532   1HG   LYS  20          1HG       LYS  20  10.595 -23.039  10.644
  533   2HG   LYS  20          2HG       LYS  20  10.711 -24.183  11.981
  534   1HD   LYS  20          1HD       LYS  20   9.293 -22.324  13.244
  535   2HD   LYS  20          2HD       LYS  20   8.815 -21.900  11.600
  536   1HE   LYS  20          1HE       LYS  20   8.102 -24.239  11.199
  537   2HE   LYS  20          2HE       LYS  20   8.558 -24.654  12.864
  538   1HZ   LYS  20          1HZ       LYS  20   7.097 -22.789  13.594
  539   2HZ   LYS  20          2HZ       LYS  20   6.530 -22.667  11.997
  540   3HZ   LYS  20          3HZ       LYS  20   6.261 -24.087  12.890
  541    H    ALA  21           H        ALA  21  11.034 -20.340  14.024
  542    HA   ALA  21           HA       ALA  21   8.409 -19.460  13.847
  543   1HB   ALA  21          1HB       ALA  21  10.567 -18.103  15.483
  544   2HB   ALA  21          3HB       ALA  21   8.872 -18.327  15.915
  545   3HB   ALA  21          2HB       ALA  21   9.957 -19.716  15.855
  546    H    LEU  22           H        LEU  22  11.312 -17.424  13.365
  547    HA   LEU  22           HA       LEU  22   9.717 -15.082  12.604
  548   1HB   LEU  22          1HB       LEU  22  12.644 -15.838  12.693
  549   2HB   LEU  22          2HB       LEU  22  12.119 -14.294  12.019
  550    HG   LEU  22           HG       LEU  22  10.877 -13.872  14.180
  551   1HD1  LEU  22          1HD1      LEU  22  12.184 -16.498  14.776
  552   2HD1  LEU  22          2HD1      LEU  22  12.016 -15.329  16.085
  553   3HD1  LEU  22          3HD1      LEU  22  10.586 -15.915  15.236
  554   1HD2  LEU  22          1HD2      LEU  22  13.390 -13.248  13.527
  555   2HD2  LEU  22          2HD2      LEU  22  12.749 -12.892  15.132
  556   3HD2  LEU  22          3HD2      LEU  22  13.753 -14.319  14.880
  557    H    GLN  23           H        GLN  23  11.749 -17.498  10.997
  558    HA   GLN  23           HA       GLN  23  11.795 -16.519   8.363
  559   1HB   GLN  23          1HB       GLN  23  12.958 -18.528   9.285
  560   2HB   GLN  23          2HB       GLN  23  11.413 -19.381   9.301
  561   1HG   GLN  23          1HG       GLN  23  11.438 -18.480   6.738
  562   2HG   GLN  23          2HG       GLN  23  13.168 -18.695   7.014
  563   2HE2  GLN  23          2HE2      GLN  23  12.457 -20.476   5.233
  564   1HE2  GLN  23          1HE2      GLN  23  12.115 -22.008   5.880
  565    H    GLN  24           H        GLN  24   9.265 -18.530   9.904
  566    HA   GLN  24           HA       GLN  24   7.563 -18.574   7.550
  567   1HB   GLN  24          1HB       GLN  24   7.596 -20.288   9.345
  568   2HB   GLN  24          2HB       GLN  24   6.994 -19.086  10.489
  569   1HG   GLN  24          2HG       GLN  24   5.009 -20.116   9.839
  570   2HG   GLN  24          1HG       GLN  24   5.084 -18.774   8.697
  571   2HE2  GLN  24          2HE2      GLN  24   4.412 -19.560   6.693
  572   1HE2  GLN  24          1HE2      GLN  24   4.919 -21.026   6.005
  573    H    LYS  25           H        LYS  25   7.453 -16.780  10.650
  574    HA   LYS  25           HA       LYS  25   5.088 -15.288  10.163
  575   1HB   LYS  25          1HB       LYS  25   7.373 -15.328  11.955
  576   2HB   LYS  25          2HB       LYS  25   6.888 -13.669  11.602
  577   1HG   LYS  25          2HG       LYS  25   5.359 -14.018  13.255
  578   2HG   LYS  25          1HG       LYS  25   4.455 -14.843  11.984
  579   1HD   LYS  25          1HD       LYS  25   5.639 -16.972  12.632
  580   2HD   LYS  25          2HD       LYS  25   6.319 -16.108  14.011
  581   1HE   LYS  25          1HE       LYS  25   4.209 -15.836  15.039
  582   2HE   LYS  25          2HE       LYS  25   3.335 -16.144  13.525
  583   1HZ   LYS  25          1HZ       LYS  25   5.088 -18.130  14.870
  584   2HZ   LYS  25          2HZ       LYS  25   3.400 -18.094  15.038
  585   3HZ   LYS  25          3HZ       LYS  25   4.095 -18.395  13.517
  586    H    ILE  26           H        ILE  26   8.489 -14.504   9.375
  587    HA   ILE  26           HA       ILE  26   7.990 -11.921   8.244
  588    HB   ILE  26           HB       ILE  26  10.122 -14.020   7.727
  589   1HG1  ILE  26          1HG1      ILE  26  10.309 -11.542   9.447
  590   2HG1  ILE  26          2HG1      ILE  26   9.732 -13.076  10.098
  591   1HG2  ILE  26          1HG2      ILE  26   9.610 -11.659   6.296
  592   2HG2  ILE  26          2HG2      ILE  26  10.925 -11.248   7.398
  593   3HG2  ILE  26          3HG2      ILE  26  11.103 -12.598   6.278
  594   1HD1  ILE  26          1HD1      ILE  26  12.279 -13.085   8.532
  595   2HD1  ILE  26          2HD1      ILE  26  12.315 -12.440  10.174
  596   3HD1  ILE  26          3HD1      ILE  26  11.794 -14.101   9.890
  597    H    HIS  27           H        HIS  27   8.502 -15.072   6.599
  598    HA   HIS  27           HA       HIS  27   7.938 -14.180   3.959
  599   1HB   HIS  27          1HB       HIS  27   8.775 -16.463   5.145
  600   2HB   HIS  27          2HB       HIS  27   7.103 -16.910   4.805
  601    HD1  HIS  27           HD1      HIS  27   7.382 -18.387   2.774
  602    HD2  HIS  27           HD2      HIS  27   9.401 -14.762   2.377
  603    HE1  HIS  27           HE1      HIS  27   8.218 -18.292   0.385
  604    H    GLU  28           H        GLU  28   5.802 -14.947   6.630
  605    HA   GLU  28           HA       GLU  28   3.397 -15.222   4.983
  606   1HB   GLU  28          1HB       GLU  28   4.095 -15.054   7.909
  607   2HB   GLU  28          2HB       GLU  28   2.408 -14.983   7.397
  608   1HG   GLU  28          1HG       GLU  28   4.252 -17.165   6.423
  609   2HG   GLU  28          2HG       GLU  28   3.379 -17.313   7.950
  610    H    LEU  29           H        LEU  29   4.626 -12.738   7.260
  611    HA   LEU  29           HA       LEU  29   2.532 -10.840   6.819
  612   1HB   LEU  29          1HB       LEU  29   5.200 -11.011   8.051
  613   2HB   LEU  29          2HB       LEU  29   4.789  -9.393   7.483
  614    HG   LEU  29           HG       LEU  29   2.616  -9.563   8.709
  615   1HD1  LEU  29          1HD1      LEU  29   3.742 -12.266   9.259
  616   2HD1  LEU  29          2HD1      LEU  29   2.882 -11.476  10.581
  617   3HD1  LEU  29          3HD1      LEU  29   2.062 -11.770   9.047
  618   1HD2  LEU  29          1HD2      LEU  29   5.294  -9.676  10.033
  619   2HD2  LEU  29          2HD2      LEU  29   4.115  -8.364   9.998
  620   3HD2  LEU  29          3HD2      LEU  29   3.867  -9.744  11.068
  621    H    GLU  30           H        GLU  30   5.598 -11.432   5.133
  622    HA   GLU  30           HA       GLU  30   5.722  -9.073   3.553
  623   1HB   GLU  30          1HB       GLU  30   7.485 -10.811   3.833
  624   2HB   GLU  30          2HB       GLU  30   6.514 -11.924   2.866
  625   1HG   GLU  30          1HG       GLU  30   6.611  -9.640   1.293
  626   2HG   GLU  30          2HG       GLU  30   8.228  -9.717   1.994
  627    H    GLY  31           H        GLY  31   4.015 -12.154   2.983
  628   1HA   GLY  31          2HA       GLY  31   2.522 -12.754   1.253
  629   2HA   GLY  31          1HA       GLY  31   3.026 -11.310   0.373
  630    H    LEU  32           H        LEU  32   1.874 -11.199   3.692
  631    HA   LEU  32           HA       LEU  32  -0.895 -10.671   3.165
  632   1HB   LEU  32          1HB       LEU  32   0.292 -11.306   5.335
  633   2HB   LEU  32          2HB       LEU  32   0.797  -9.619   5.446
  634    HG   LEU  32           HG       LEU  32  -1.757  -9.123   5.077
  635   1HD1  LEU  32          1HD1      LEU  32  -2.361 -11.474   4.608
  636   2HD1  LEU  32          2HD1      LEU  32  -1.799 -11.935   6.216
  637   3HD1  LEU  32          3HD1      LEU  32  -3.198 -10.876   6.041
  638   1HD2  LEU  32          1HD2      LEU  32  -0.139  -9.041   7.224
  639   2HD2  LEU  32          2HD2      LEU  32  -1.867  -8.706   7.340
  640   3HD2  LEU  32          3HD2      LEU  32  -1.247 -10.301   7.769
  641    H    MET  33           H        MET  33   1.970  -8.622   3.130
  642    HA   MET  33           HA       MET  33   0.715  -6.062   3.282
  643   1HB   MET  33          1HB       MET  33   3.277  -7.229   2.794
  644   2HB   MET  33          2HB       MET  33   2.980  -6.041   1.524
  645   1HG   MET  33          1HG       MET  33   2.953  -4.274   2.988
  646   2HG   MET  33          2HG       MET  33   2.266  -5.235   4.297
  647   1HE   MET  33          1HE       MET  33   5.386  -4.462   2.149
  648   2HE   MET  33          2HE       MET  33   6.627  -5.510   2.851
  649   3HE   MET  33          3HE       MET  33   5.245  -6.213   2.016
  650    H    MET  34           H        MET  34   1.897  -7.734   0.332
  651    HA   MET  34           HA       MET  34   0.682  -5.996  -1.550
  652   1HB   MET  34          2HB       MET  34   1.231  -8.976  -1.737
  653   2HB   MET  34          1HB       MET  34   1.096  -7.860  -3.096
  654   1HG   MET  34          1HG       MET  34   2.980  -6.567  -1.671
  655   2HG   MET  34          2HG       MET  34   3.320  -8.217  -1.152
  656   1HE   MET  34          1HE       MET  34   4.159  -5.580  -3.388
  657   2HE   MET  34          2HE       MET  34   4.261  -6.180  -5.042
  658   3HE   MET  34          3HE       MET  34   2.683  -5.920  -4.286
  659    H    GLN  35           H        GLN  35  -0.647  -8.749   0.227
  660    HA   GLN  35           HA       GLN  35  -2.965  -9.308  -1.271
  661   1HB   GLN  35          1HB       GLN  35  -2.196 -10.596   0.659
  662   2HB   GLN  35          2HB       GLN  35  -2.491  -9.226   1.727
  663   1HG   GLN  35          2HG       GLN  35  -4.542 -10.120   2.058
  664   2HG   GLN  35          1HG       GLN  35  -4.924  -9.546   0.435
  665   2HE2  GLN  35          2HE2      GLN  35  -4.401 -12.389   2.367
  666   1HE2  GLN  35          1HE2      GLN  35  -4.559 -13.522   1.112
  667    H    HIS  36           H        HIS  36  -3.222  -7.437   1.756
  668    HA   HIS  36           HA       HIS  36  -5.662  -6.164   1.114
  669   1HB   HIS  36          1HB       HIS  36  -3.337  -5.567   2.937
  670   2HB   HIS  36          2HB       HIS  36  -4.737  -4.493   2.886
  671    HD1  HIS  36           HD1      HIS  36  -3.647  -6.905   5.032
  672    HD2  HIS  36           HD2      HIS  36  -7.169  -6.658   2.816
  673    HE1  HIS  36           HE1      HIS  36  -5.326  -8.409   6.186
  674    H    ALA  37           H        ALA  37  -2.327  -4.875   0.764
  675    HA   ALA  37           HA       ALA  37  -2.854  -2.324  -0.255
  676   1HB   ALA  37          1HB       ALA  37  -0.616  -2.974   0.173
  677   2HB   ALA  37          3HB       ALA  37  -0.758  -4.427  -0.817
  678   3HB   ALA  37          2HB       ALA  37  -0.678  -2.841  -1.585
  679    H    GLN  38           H        GLN  38  -2.866  -5.441  -1.995
  680    HA   GLN  38           HA       GLN  38  -3.294  -4.394  -4.632
  681   1HB   GLN  38          1HB       GLN  38  -3.544  -6.969  -3.161
  682   2HB   GLN  38          2HB       GLN  38  -4.456  -6.847  -4.665
  683   1HG   GLN  38          1HG       GLN  38  -2.451  -6.285  -5.906
  684   2HG   GLN  38          2HG       GLN  38  -1.508  -6.191  -4.419
  685   2HE2  GLN  38          2HE2      GLN  38  -3.258  -8.477  -6.539
  686   1HE2  GLN  38          1HE2      GLN  38  -2.457  -9.863  -5.977
  687    H    ASN  39           H        ASN  39  -5.463  -5.171  -1.952
  688    HA   ASN  39           HA       ASN  39  -7.871  -4.575  -3.577
  689   1HB   ASN  39          2HB       ASN  39  -7.492  -5.307  -0.652
  690   2HB   ASN  39          1HB       ASN  39  -9.023  -5.313  -1.530
  691   2HD2  ASN  39          2HD2      ASN  39  -7.784  -7.671  -0.274
  692   1HD2  ASN  39          1HD2      ASN  39  -7.460  -8.776  -1.523
  693    H    LEU  40           H        LEU  40  -5.652  -2.589  -2.564
  694    HA   LEU  40           HA       LEU  40  -5.583  -0.372  -1.818
  695   1HB   LEU  40          1HB       LEU  40  -8.371  -0.830  -2.843
  696   2HB   LEU  40          2HB       LEU  40  -7.960   0.726  -2.121
  697    HG   LEU  40           HG       LEU  40  -5.860   0.571  -3.708
  698   1HD1  LEU  40          1HD1      LEU  40  -7.699  -1.558  -4.671
  699   2HD1  LEU  40          2HD1      LEU  40  -6.990  -0.520  -5.908
  700   3HD1  LEU  40          3HD1      LEU  40  -5.946  -1.434  -4.818
  701   1HD2  LEU  40          1HD2      LEU  40  -8.687   1.212  -4.603
  702   2HD2  LEU  40          2HD2      LEU  40  -7.511   2.329  -3.908
  703   3HD2  LEU  40          3HD2      LEU  40  -7.247   1.660  -5.518
  704    H    GLU  41           H        GLU  41  -6.365  -2.619   0.114
  705    HA   GLU  41           HA       GLU  41  -8.219  -1.508   2.039
  706   1HB   GLU  41          1HB       GLU  41  -6.312  -3.752   1.762
  707   2HB   GLU  41          2HB       GLU  41  -6.563  -3.211   3.423
  708   1HG   GLU  41          1HG       GLU  41  -8.902  -3.696   1.583
  709   2HG   GLU  41          2HG       GLU  41  -8.169  -5.021   2.487
  710    H    PHE  42           H        PHE  42  -4.677  -1.556   1.757
  711    HA   PHE  42           HA       PHE  42  -3.018  -0.293   2.853
  712   1HB   PHE  42          1HB       PHE  42  -5.349   1.480   2.232
  713   2HB   PHE  42          2HB       PHE  42  -4.016   2.158   3.167
  714    HD1  PHE  42           HD1      PHE  42  -1.646   0.833   2.076
  715    HD2  PHE  42           HD2      PHE  42  -5.155   2.307   0.034
  716    HE1  PHE  42           HE1      PHE  42  -0.316   1.107  -0.013
  717    HE2  PHE  42           HE2      PHE  42  -3.822   2.581  -2.055
  718    HZ   PHE  42           HZ       PHE  42  -1.401   1.982  -2.075
  719    H    GLU  43           H        GLU  43  -2.811   1.388   4.783
  720    HA   GLU  43           HA       GLU  43  -2.893   1.796   7.082
  721   1HB   GLU  43          1HB       GLU  43  -5.263   2.267   6.683
  722   2HB   GLU  43          2HB       GLU  43  -5.640   0.547   6.711
  723   1HG   GLU  43          1HG       GLU  43  -4.657   0.493   9.056
  724   2HG   GLU  43          2HG       GLU  43  -4.669   2.257   9.001
  725    H    GLU  44           H        GLU  44  -4.602  -1.250   6.561
  726    HA   GLU  44           HA       GLU  44  -3.075  -2.589   8.685
  727   1HB   GLU  44          2HB       GLU  44  -4.580  -4.450   8.153
  728   2HB   GLU  44          1HB       GLU  44  -5.508  -2.954   8.234
  729   1HG   GLU  44          1HG       GLU  44  -5.537  -2.767   5.817
  730   2HG   GLU  44          2HG       GLU  44  -4.439  -4.139   5.657
  731    H    ALA  45           H        ALA  45  -3.117  -2.427   5.159
  732    HA   ALA  45           HA       ALA  45  -1.317  -4.706   4.789
  733   1HB   ALA  45          1HB       ALA  45  -3.158  -3.430   3.284
  734   2HB   ALA  45          2HB       ALA  45  -1.845  -4.371   2.578
  735   3HB   ALA  45          3HB       ALA  45  -1.704  -2.618   2.705
  736    H    ALA  46           H        ALA  46  -0.993  -1.149   4.506
  737    HA   ALA  46           HA       ALA  46   1.840  -1.280   3.878
  738   1HB   ALA  46          1HB       ALA  46   1.657   1.114   3.906
  739   2HB   ALA  46          3HB       ALA  46   0.135   0.499   3.261
  740   3HB   ALA  46          2HB       ALA  46   0.225   1.052   4.935
  741    H    GLN  47           H        GLN  47   0.029  -1.314   6.853
  742    HA   GLN  47           HA       GLN  47   2.102  -0.210   8.559
  743   1HB   GLN  47          1HB       GLN  47  -0.483  -1.668   8.809
  744   2HB   GLN  47          2HB       GLN  47   0.600  -1.732  10.200
  745   1HG   GLN  47          1HG       GLN  47   0.726   0.713  10.253
  746   2HG   GLN  47          2HG       GLN  47  -0.293   0.815   8.816
  747   2HE2  GLN  47          2HE2      GLN  47  -2.197   1.734   9.699
  748   1HE2  GLN  47          1HE2      GLN  47  -3.090   1.023  10.956
  749    H    ILE  48           H        ILE  48   1.214  -3.503   7.523
  750    HA   ILE  48           HA       ILE  48   2.822  -5.070   9.201
  751    HB   ILE  48           HB       ILE  48   2.225  -5.280   6.233
  752   1HG1  ILE  48          1HG1      ILE  48   0.255  -5.190   7.727
  753   2HG1  ILE  48          2HG1      ILE  48   0.428  -6.787   6.998
  754   1HG2  ILE  48          1HG2      ILE  48   3.764  -7.011   8.061
  755   2HG2  ILE  48          2HG2      ILE  48   2.506  -7.847   7.151
  756   3HG2  ILE  48          3HG2      ILE  48   3.766  -6.953   6.299
  757   1HD1  ILE  48          1HD1      ILE  48   1.964  -6.935   9.323
  758   2HD1  ILE  48          2HD1      ILE  48   0.536  -6.021   9.808
  759   3HD1  ILE  48          3HD1      ILE  48   0.357  -7.623   9.093
  760    H    ARG  49           H        ARG  49   3.778  -2.961   6.560
  761    HA   ARG  49           HA       ARG  49   6.389  -3.884   6.000
  762   1HB   ARG  49          1HB       ARG  49   5.406  -2.171   4.673
  763   2HB   ARG  49          2HB       ARG  49   5.025  -1.186   6.079
  764   1HG   ARG  49          1HG       ARG  49   7.869  -1.636   5.989
  765   2HG   ARG  49          2HG       ARG  49   7.324  -1.026   4.428
  766   1HD   ARG  49          1HD       ARG  49   7.905   0.815   6.038
  767   2HD   ARG  49          2HD       ARG  49   6.205   0.870   5.531
  768    HE   ARG  49           HE       ARG  49   5.644  -0.311   7.673
  769   1HH1  ARG  49          1HH1      ARG  49   8.918  -0.429   7.716
  770   2HH1  ARG  49          2HH1      ARG  49   9.145   0.407   9.216
  771   1HH2  ARG  49          1HH2      ARG  49   5.848   1.457   9.433
  772   2HH2  ARG  49          2HH2      ARG  49   7.406   1.475  10.189
  773    H    ASP  50           H        ASP  50   5.108  -2.274   8.830
  774    HA   ASP  50           HA       ASP  50   7.697  -1.442   9.904
  775   1HB   ASP  50          1HB       ASP  50   5.353  -0.470  10.320
  776   2HB   ASP  50          2HB       ASP  50   5.082  -1.860  11.372
  777    H    GLN  51           H        GLN  51   5.547  -4.237  10.223
  778    HA   GLN  51           HA       GLN  51   7.038  -5.434  12.434
  779   1HB   GLN  51          2HB       GLN  51   5.041  -6.601  10.465
  780   2HB   GLN  51          1HB       GLN  51   5.484  -7.291  12.028
  781   1HG   GLN  51          1HG       GLN  51   4.634  -5.236  13.146
  782   2HG   GLN  51          2HG       GLN  51   4.123  -4.618  11.574
  783   2HE2  GLN  51          2HE2      GLN  51   3.875  -7.942  12.951
  784   1HE2  GLN  51          1HE2      GLN  51   2.189  -8.047  12.777
  785    H    LEU  52           H        LEU  52   6.851  -5.914   8.904
  786    HA   LEU  52           HA       LEU  52   8.587  -8.180   8.737
  787   1HB   LEU  52          1HB       LEU  52   7.069  -6.566   7.061
  788   2HB   LEU  52          2HB       LEU  52   8.721  -6.258   6.525
  789    HG   LEU  52           HG       LEU  52   7.739  -8.170   5.311
  790   1HD1  LEU  52          1HD1      LEU  52  10.224  -8.017   6.268
  791   2HD1  LEU  52          2HD1      LEU  52   9.705  -9.441   7.170
  792   3HD1  LEU  52          3HD1      LEU  52   9.662  -9.449   5.407
  793   1HD2  LEU  52          1HD2      LEU  52   6.614  -8.760   7.805
  794   2HD2  LEU  52          2HD2      LEU  52   6.531  -9.767   6.360
  795   3HD2  LEU  52          3HD2      LEU  52   7.804 -10.036   7.550
  796    H    HIS  53           H        HIS  53   9.246  -4.676   8.634
  797    HA   HIS  53           HA       HIS  53  12.089  -4.957   8.140
  798   1HB   HIS  53          1HB       HIS  53  10.094  -2.857   8.791
  799   2HB   HIS  53          2HB       HIS  53  11.759  -2.491   9.243
  800    HD1  HIS  53           HD1      HIS  53   9.522  -2.917   6.299
  801    HD2  HIS  53           HD2      HIS  53  13.597  -2.400   7.011
  802    HE1  HIS  53           HE1      HIS  53  10.572  -2.337   4.068
  803    H    GLN  54           H        GLN  54  10.119  -4.417  11.071
  804    HA   GLN  54           HA       GLN  54  12.320  -4.178  12.902
  805   1HB   GLN  54          1HB       GLN  54   9.379  -4.685  12.972
  806   2HB   GLN  54          2HB       GLN  54  10.293  -5.057  14.434
  807   1HG   GLN  54          1HG       GLN  54  11.355  -2.692  14.054
  808   2HG   GLN  54          2HG       GLN  54   9.926  -2.410  13.059
  809   2HE2  GLN  54          2HE2      GLN  54  10.998  -3.134  16.377
  810   1HE2  GLN  54          1HE2      GLN  54   9.532  -2.708  17.122
  811    H    LEU  55           H        LEU  55  10.436  -6.963  11.739
  812    HA   LEU  55           HA       LEU  55  11.514  -8.918  13.540
  813   1HB   LEU  55          1HB       LEU  55   9.951  -8.757  11.049
  814   2HB   LEU  55          2HB       LEU  55  10.893 -10.242  11.197
  815    HG   LEU  55           HG       LEU  55   9.833  -9.912  13.739
  816   1HD1  LEU  55          1HD1      LEU  55   7.880  -8.984  11.626
  817   2HD1  LEU  55          2HD1      LEU  55   7.340  -9.686  13.150
  818   3HD1  LEU  55          3HD1      LEU  55   8.289  -8.200  13.152
  819   1HD2  LEU  55          1HD2      LEU  55  10.038 -11.953  12.177
  820   2HD2  LEU  55          2HD2      LEU  55   8.632 -11.904  13.241
  821   3HD2  LEU  55          3HD2      LEU  55   8.467 -11.472  11.538
  822    H    ARG  56           H        ARG  56  12.824  -7.362  10.709
  823    HA   ARG  56           HA       ARG  56  14.710  -9.309   9.839
  824   1HB   ARG  56          1HB       ARG  56  14.084  -7.232   8.650
  825   2HB   ARG  56          2HB       ARG  56  14.867  -6.277   9.908
  826   1HG   ARG  56          1HG       ARG  56  16.969  -7.728   9.358
  827   2HG   ARG  56          2HG       ARG  56  16.125  -8.073   7.848
  828   1HD   ARG  56          1HD       ARG  56  16.152  -5.805   7.173
  829   2HD   ARG  56          2HD       ARG  56  16.478  -5.230   8.820
  830    HE   ARG  56           HE       ARG  56  18.642  -6.831   8.350
  831   1HH1  ARG  56          1HH1      ARG  56  18.605  -6.646   5.494
  832   2HH1  ARG  56          2HH1      ARG  56  19.383  -5.139   5.141
  833   1HH2  ARG  56          1HH2      ARG  56  19.001  -3.886   8.352
  834   2HH2  ARG  56          2HH2      ARG  56  19.607  -3.577   6.759
  835    H    GLU  57           H        GLU  57  15.441  -6.426  11.846
  836    HA   GLU  57           HA       GLU  57  18.017  -7.212  12.686
  837   1HB   GLU  57          1HB       GLU  57  17.582  -5.592  14.527
  838   2HB   GLU  57          2HB       GLU  57  17.020  -4.978  12.971
  839   1HG   GLU  57          1HG       GLU  57  14.742  -5.504  13.480
  840   2HG   GLU  57          2HG       GLU  57  15.208  -6.458  14.889
  841    H    LEU  58           H        LEU  58  14.882  -8.343  13.741
  842    HA   LEU  58           HA       LEU  58  15.645  -9.415  16.302
  843   1HB   LEU  58          1HB       LEU  58  13.401  -9.430  14.425
  844   2HB   LEU  58          2HB       LEU  58  13.566 -10.964  15.281
  845    HG   LEU  58           HG       LEU  58  13.869  -8.520  16.936
  846   1HD1  LEU  58          1HD1      LEU  58  11.227  -9.378  15.722
  847   2HD1  LEU  58          2HD1      LEU  58  11.371  -8.309  17.117
  848   3HD1  LEU  58          3HD1      LEU  58  12.009  -7.806  15.551
  849   1HD2  LEU  58          1HD2      LEU  58  12.619 -11.258  17.158
  850   2HD2  LEU  58          2HD2      LEU  58  13.941 -10.574  18.104
  851   3HD2  LEU  58          3HD2      LEU  58  12.289 -10.010  18.360
  852    H    PHE  59           H        PHE  59  16.192 -10.480  13.038
  853    HA   PHE  59           HA       PHE  59  16.373 -13.274  13.269
  854   1HB   PHE  59          1HB       PHE  59  16.631 -11.970  11.198
  855   2HB   PHE  59          2HB       PHE  59  18.155 -11.310  11.792
  856    HD1  PHE  59           HD1      PHE  59  20.054 -12.966  12.368
  857    HD2  PHE  59           HD2      PHE  59  16.574 -14.044  10.049
  858    HE1  PHE  59           HE1      PHE  59  21.265 -14.952  11.475
  859    HE2  PHE  59           HE2      PHE  59  17.786 -16.031   9.157
  860    HZ   PHE  59           HZ       PHE  59  20.131 -16.486   9.869
  861    H    ILE  60           H        ILE  60  18.773 -10.804  14.194
  862    HA   ILE  60           HA       ILE  60  20.799 -12.736  14.988
  863    HB   ILE  60           HB       ILE  60  20.398  -9.805  15.675
  864   1HG1  ILE  60          1HG1      ILE  60  22.395 -10.409  13.659
  865   2HG1  ILE  60          2HG1      ILE  60  20.816 -11.027  13.172
  866   1HG2  ILE  60          1HG2      ILE  60  22.594 -11.778  16.099
  867   2HG2  ILE  60          2HG2      ILE  60  23.060 -10.148  15.611
  868   3HG2  ILE  60          3HG2      ILE  60  22.122 -10.393  17.084
  869   1HD1  ILE  60          1HD1      ILE  60  19.959  -8.676  13.972
  870   2HD1  ILE  60          2HD1      ILE  60  21.642  -8.197  13.752
  871   3HD1  ILE  60          3HD1      ILE  60  20.721  -8.830  12.388
  872    H    ALA  61           H        ALA  61  18.438 -10.712  16.758
  873    HA   ALA  61           HA       ALA  61  19.178 -11.482  19.399
  874   1HB   ALA  61          1HB       ALA  61  17.057 -10.096  17.987
  875   2HB   ALA  61          3HB       ALA  61  17.633  -9.847  19.635
  876   3HB   ALA  61          2HB       ALA  61  16.391 -11.056  19.307
  877    H    ALA  62           H        ALA  62  17.367 -13.168  16.923
  878    HA   ALA  62           HA       ALA  62  16.476 -15.230  18.892
  879   1HB   ALA  62          1HB       ALA  62  15.737 -15.398  16.027
  880   2HB   ALA  62          2HB       ALA  62  15.190 -13.941  16.857
  881   3HB   ALA  62          3HB       ALA  62  14.715 -15.530  17.458
  882    H    SER  63           H        SER  63  17.728 -15.243  15.527
  883    HA   SER  63           HA       SER  63  18.966 -17.887  15.994
  884   1HB   SER  63          1HB       SER  63  17.711 -17.387  13.937
  885   2HB   SER  63          2HB       SER  63  18.791 -16.038  13.591
  886    HG   SER  63           HG       SER  63  19.525 -18.777  13.820

  No H/Q in entry =         886
  Start of MODEL   13
    1    H    LEU   8           H        LEU   8 -23.889  30.483 -23.819
    2    HA   LEU   8           HA       LEU   8 -24.416  27.846 -24.602
    3   1HB   LEU   8          1HB       LEU   8 -22.472  27.317 -23.143
    4   2HB   LEU   8          2HB       LEU   8 -22.205  28.797 -24.066
    5    HG   LEU   8           HG       LEU   8 -23.499  29.647 -21.734
    6   1HD1  LEU   8          1HD1      LEU   8 -21.784  27.261 -21.268
    7   2HD1  LEU   8          2HD1      LEU   8 -21.554  28.620 -20.169
    8   3HD1  LEU   8          3HD1      LEU   8 -23.143  27.873 -20.324
    9   1HD2  LEU   8          1HD2      LEU   8 -20.749  29.745 -22.895
   10   2HD2  LEU   8          2HD2      LEU   8 -21.844  31.067 -22.491
   11   3HD2  LEU   8          3HD2      LEU   8 -20.935  30.255 -21.217
   12    H    GLU   9           H        GLU   9 -25.526  26.144 -23.677
   13    HA   GLU   9           HA       GLU   9 -26.151  26.152 -20.787
   14   1HB   GLU   9          2HB       GLU   9 -28.582  26.090 -21.229
   15   2HB   GLU   9          1HB       GLU   9 -27.873  27.576 -21.858
   16   1HG   GLU   9          1HG       GLU   9 -27.602  25.785 -23.968
   17   2HG   GLU   9          2HG       GLU   9 -29.188  25.401 -23.298
   18    HA   PRO  10           HA       PRO  10 -25.747  22.026 -22.997
   19   1HB   PRO  10          1HB       PRO  10 -23.507  21.147 -21.696
   20   2HB   PRO  10          2HB       PRO  10 -23.442  22.086 -23.201
   21   1HG   PRO  10          2HG       PRO  10 -23.018  22.977 -20.395
   22   2HG   PRO  10          1HG       PRO  10 -22.183  23.469 -21.876
   23   1HD   PRO  10          1HD       PRO  10 -24.118  24.964 -20.658
   24   2HD   PRO  10          2HD       PRO  10 -23.759  25.040 -22.397
   25    H    ASP  11           H        ASP  11 -24.887  22.732 -19.593
   26    HA   ASP  11           HA       ASP  11 -25.694  21.810 -17.579
   27   1HB   ASP  11          1HB       ASP  11 -27.845  21.899 -19.505
   28   2HB   ASP  11          2HB       ASP  11 -28.040  20.489 -18.463
   29    H    ASN  12           H        ASN  12 -27.095  19.344 -19.718
   30    HA   ASN  12           HA       ASN  12 -24.946  17.422 -19.041
   31   1HB   ASN  12          1HB       ASN  12 -26.928  17.701 -17.265
   32   2HB   ASN  12          2HB       ASN  12 -27.748  16.609 -18.383
   33   2HD2  ASN  12          2HD2      ASN  12 -25.238  15.239 -19.204
   34   1HD2  ASN  12          1HD2      ASN  12 -24.776  14.274 -17.886
   35    H    VAL  13           H        VAL  13 -26.180  18.631 -21.510
   36    HA   VAL  13           HA       VAL  13 -27.722  16.493 -22.772
   37    HB   VAL  13           HB       VAL  13 -26.683  19.220 -23.403
   38   1HG1  VAL  13          1HG1      VAL  13 -27.197  17.109 -25.490
   39   2HG1  VAL  13          2HG1      VAL  13 -27.585  18.797 -25.823
   40   3HG1  VAL  13          3HG1      VAL  13 -25.926  18.333 -25.442
   41   1HG2  VAL  13          1HG2      VAL  13 -28.972  18.656 -22.500
   42   2HG2  VAL  13          2HG2      VAL  13 -28.982  19.603 -23.989
   43   3HG2  VAL  13          3HG2      VAL  13 -29.313  17.871 -24.042
   44    HA   PRO  14           HA       PRO  14 -23.613  15.691 -25.019
   45   1HB   PRO  14          1HB       PRO  14 -21.369  17.046 -24.257
   46   2HB   PRO  14          2HB       PRO  14 -22.504  17.676 -25.467
   47   1HG   PRO  14          2HG       PRO  14 -22.123  18.469 -22.649
   48   2HG   PRO  14          1HG       PRO  14 -22.670  19.424 -24.032
   49   1HD   PRO  14          1HD       PRO  14 -24.296  18.349 -22.027
   50   2HD   PRO  14          2HD       PRO  14 -24.833  18.993 -23.587
   51    H    MET  15           H        MET  15 -22.527  16.777 -21.781
   52    HA   MET  15           HA       MET  15 -22.483  14.141 -20.642
   53   1HB   MET  15          1HB       MET  15 -20.590  14.335 -22.500
   54   2HB   MET  15          2HB       MET  15 -19.711  15.142 -21.201
   55   1HG   MET  15          1HG       MET  15 -19.670  13.235 -19.862
   56   2HG   MET  15          2HG       MET  15 -21.092  12.537 -20.636
   57   1HE   MET  15          1HE       MET  15 -20.845  10.532 -21.582
   58   2HE   MET  15          2HE       MET  15 -19.398   9.792 -22.260
   59   3HE   MET  15          3HE       MET  15 -19.446  10.211 -20.550
   60    H    ASP  16           H        ASP  16 -21.638  14.198 -18.429
   61    HA   ASP  16           HA       ASP  16 -20.384  16.520 -17.280
   62   1HB   ASP  16          1HB       ASP  16 -22.532  17.545 -17.856
   63   2HB   ASP  16          2HB       ASP  16 -23.400  16.245 -17.040
   64    H    MET  17           H        MET  17 -19.297  14.532 -16.464
   65    HA   MET  17           HA       MET  17 -20.793  13.239 -14.209
   66   1HB   MET  17          1HB       MET  17 -19.189  11.364 -14.605
   67   2HB   MET  17          2HB       MET  17 -20.153  11.732 -16.035
   68   1HG   MET  17          1HG       MET  17 -18.332  12.988 -17.019
   69   2HG   MET  17          2HG       MET  17 -17.381  12.853 -15.538
   70   1HE   MET  17          1HE       MET  17 -15.971  11.572 -15.018
   71   2HE   MET  17          2HE       MET  17 -15.696   9.863 -15.375
   72   3HE   MET  17          3HE       MET  17 -15.071  11.103 -16.457
   73    H    SER  18           H        SER  18 -18.000  15.106 -15.126
   74    HA   SER  18           HA       SER  18 -17.298  15.524 -12.303
   75   1HB   SER  18          1HB       SER  18 -15.492  14.057 -14.250
   76   2HB   SER  18          2HB       SER  18 -14.963  14.665 -12.684
   77    HG   SER  18           HG       SER  18 -15.586  12.548 -12.415
   78    HA   PRO  19           HA       PRO  19 -15.700  19.199 -14.123
   79   1HB   PRO  19          1HB       PRO  19 -13.898  20.010 -12.239
   80   2HB   PRO  19          2HB       PRO  19 -15.653  20.059 -11.991
   81   1HG   PRO  19          1HG       PRO  19 -13.657  18.244 -10.853
   82   2HG   PRO  19          2HG       PRO  19 -15.262  18.670 -10.258
   83   1HD   PRO  19          1HD       PRO  19 -14.488  16.301 -11.634
   84   2HD   PRO  19          2HD       PRO  19 -16.121  16.775 -11.120
   85    H    LYS  20           H        LYS  20 -14.070  16.546 -14.572
   86    HA   LYS  20           HA       LYS  20 -12.170  15.977 -15.842
   87   1HB   LYS  20          1HB       LYS  20 -13.109  18.120 -16.988
   88   2HB   LYS  20          2HB       LYS  20 -11.735  18.934 -16.239
   89   1HG   LYS  20          1HG       LYS  20 -11.193  16.383 -17.689
   90   2HG   LYS  20          2HG       LYS  20 -11.552  17.811 -18.662
   91   1HD   LYS  20          1HD       LYS  20  -9.658  18.275 -16.443
   92   2HD   LYS  20          2HD       LYS  20  -9.064  17.198 -17.707
   93   1HE   LYS  20          1HE       LYS  20 -10.448  19.654 -18.657
   94   2HE   LYS  20          2HE       LYS  20  -8.862  19.890 -17.896
   95   1HZ   LYS  20          1HZ       LYS  20  -8.033  18.034 -19.293
   96   2HZ   LYS  20          2HZ       LYS  20  -9.518  18.032 -20.119
   97   3HZ   LYS  20          3HZ       LYS  20  -8.509  19.393 -20.195
   98    H    ALA  21           H        ALA  21 -11.190  19.112 -14.388
   99    HA   ALA  21           HA       ALA  21  -8.527  18.559 -13.839
  100   1HB   ALA  21          1HB       ALA  21  -9.355  20.727 -13.426
  101   2HB   ALA  21          2HB       ALA  21 -10.667  20.130 -12.410
  102   3HB   ALA  21          3HB       ALA  21  -9.010  20.120 -11.806
  103    H    LEU  22           H        LEU  22 -11.294  17.776 -11.711
  104    HA   LEU  22           HA       LEU  22  -9.588  16.416  -9.750
  105   1HB   LEU  22          1HB       LEU  22 -12.547  16.833 -10.207
  106   2HB   LEU  22          2HB       LEU  22 -11.966  15.782  -8.914
  107    HG   LEU  22           HG       LEU  22 -10.551  17.703  -8.096
  108   1HD1  LEU  22          1HD1      LEU  22 -11.952  18.983 -10.409
  109   2HD1  LEU  22          2HD1      LEU  22 -11.619  19.966  -8.982
  110   3HD1  LEU  22          3HD1      LEU  22 -10.293  19.193  -9.852
  111   1HD2  LEU  22          1HD2      LEU  22 -12.795  17.132  -7.134
  112   2HD2  LEU  22          2HD2      LEU  22 -12.413  18.849  -7.011
  113   3HD2  LEU  22          3HD2      LEU  22 -13.527  18.279  -8.255
  114    H    GLN  23           H        GLN  23 -11.906  15.513 -12.271
  115    HA   GLN  23           HA       GLN  23 -12.070  12.733 -11.916
  116   1HB   GLN  23          1HB       GLN  23 -13.332  14.068 -13.558
  117   2HB   GLN  23          2HB       GLN  23 -11.853  14.351 -14.476
  118   1HG   GLN  23          1HG       GLN  23 -11.653  11.782 -14.598
  119   2HG   GLN  23          2HG       GLN  23 -13.340  11.753 -14.080
  120   2HE2  GLN  23          2HE2      GLN  23 -12.278  10.935 -16.740
  121   1HE2  GLN  23          1HE2      GLN  23 -13.043  11.936 -17.878
  122    H    GLN  24           H        GLN  24  -9.617  14.509 -13.840
  123    HA   GLN  24           HA       GLN  24  -8.083  12.116 -14.449
  124   1HB   GLN  24          1HB       GLN  24  -8.251  14.327 -15.725
  125   2HB   GLN  24          2HB       GLN  24  -7.183  15.007 -14.495
  126   1HG   GLN  24          2HG       GLN  24  -5.691  14.315 -16.182
  127   2HG   GLN  24          1HG       GLN  24  -5.642  12.985 -15.025
  128   2HE2  GLN  24          2HE2      GLN  24  -6.221  10.926 -15.797
  129   1HE2  GLN  24          1HE2      GLN  24  -6.912  10.636 -17.320
  130    H    LYS  25           H        LYS  25  -8.004  14.564 -11.905
  131    HA   LYS  25           HA       LYS  25  -5.381  13.910 -10.879
  132   1HB   LYS  25          1HB       LYS  25  -7.805  15.449 -10.073
  133   2HB   LYS  25          2HB       LYS  25  -6.670  15.022  -8.792
  134   1HG   LYS  25          1HG       LYS  25  -4.902  16.215  -9.787
  135   2HG   LYS  25          2HG       LYS  25  -5.691  16.245 -11.365
  136   1HD   LYS  25          1HD       LYS  25  -6.675  18.205 -10.872
  137   2HD   LYS  25          2HD       LYS  25  -7.411  17.499  -9.433
  138   1HE   LYS  25          2HE       LYS  25  -6.066  19.252  -8.565
  139   2HE   LYS  25          1HE       LYS  25  -5.041  17.817  -8.362
  140   1HZ   LYS  25          1HZ       LYS  25  -5.016  19.462 -10.827
  141   2HZ   LYS  25          2HZ       LYS  25  -3.970  19.767  -9.525
  142   3HZ   LYS  25          3HZ       LYS  25  -3.890  18.284 -10.345
  143    H    ILE  26           H        ILE  26  -8.689  12.938  -9.919
  144    HA   ILE  26           HA       ILE  26  -7.842  11.235  -7.745
  145    HB   ILE  26           HB       ILE  26 -10.357  11.277  -9.448
  146   1HG1  ILE  26          1HG1      ILE  26  -9.879  12.567  -6.750
  147   2HG1  ILE  26          2HG1      ILE  26  -9.645  13.433  -8.269
  148   1HG2  ILE  26          1HG2      ILE  26  -9.887   9.225  -7.969
  149   2HG2  ILE  26          2HG2      ILE  26 -10.068  10.317  -6.596
  150   3HG2  ILE  26          3HG2      ILE  26 -11.418  10.059  -7.702
  151   1HD1  ILE  26          1HD1      ILE  26 -12.221  12.083  -7.410
  152   2HD1  ILE  26          2HD1      ILE  26 -11.912  13.818  -7.348
  153   3HD1  ILE  26          3HD1      ILE  26 -11.976  12.988  -8.903
  154    H    HIS  27           H        HIS  27  -8.791  10.564 -11.131
  155    HA   HIS  27           HA       HIS  27  -8.449   7.713 -10.975
  156   1HB   HIS  27          1HB       HIS  27  -8.764   9.839 -13.036
  157   2HB   HIS  27          2HB       HIS  27  -8.102   8.301 -13.592
  158    HD1  HIS  27           HD1      HIS  27 -10.659   8.515 -14.813
  159    HD2  HIS  27           HD2      HIS  27 -10.450   7.426 -10.795
  160    HE1  HIS  27           HE1      HIS  27 -12.864   7.399 -14.258
  161    H    GLU  28           H        GLU  28  -6.198  10.358 -11.365
  162    HA   GLU  28           HA       GLU  28  -4.043   8.735 -12.498
  163   1HB   GLU  28          1HB       GLU  28  -4.475  11.524 -11.491
  164   2HB   GLU  28          2HB       GLU  28  -2.818  10.949 -11.681
  165   1HG   GLU  28          1HG       GLU  28  -4.798  10.549 -13.907
  166   2HG   GLU  28          2HG       GLU  28  -4.008  12.114 -13.708
  167    H    LEU  29           H        LEU  29  -4.928   9.956  -9.272
  168    HA   LEU  29           HA       LEU  29  -2.508   8.951  -7.991
  169   1HB   LEU  29          1HB       LEU  29  -5.001  10.382  -7.325
  170   2HB   LEU  29          2HB       LEU  29  -4.387   9.362  -6.023
  171    HG   LEU  29           HG       LEU  29  -2.122  10.434  -6.378
  172   1HD1  LEU  29          1HD1      LEU  29  -3.657  11.691  -8.527
  173   2HD1  LEU  29          2HD1      LEU  29  -2.841  12.873  -7.504
  174   3HD1  LEU  29          3HD1      LEU  29  -1.910  11.605  -8.300
  175   1HD2  LEU  29          1HD2      LEU  29  -4.575  11.847  -5.405
  176   2HD2  LEU  29          2HD2      LEU  29  -3.160  11.309  -4.500
  177   3HD2  LEU  29          3HD2      LEU  29  -3.072  12.765  -5.491
  178    H    GLU  30           H        GLU  30  -5.846   7.798  -8.397
  179    HA   GLU  30           HA       GLU  30  -5.870   5.628  -6.601
  180   1HB   GLU  30          1HB       GLU  30  -7.756   6.516  -7.978
  181   2HB   GLU  30          2HB       GLU  30  -7.021   5.786  -9.406
  182   1HG   GLU  30          1HG       GLU  30  -7.203   3.837  -7.277
  183   2HG   GLU  30          2HG       GLU  30  -8.787   4.549  -7.590
  184    H    GLY  31           H        GLY  31  -4.737   5.679 -10.000
  185   1HA   GLY  31          2HA       GLY  31  -3.416   4.133 -11.179
  186   2HA   GLY  31          1HA       GLY  31  -3.908   2.916  -9.998
  187    H    LEU  32           H        LEU  32  -2.378   5.925  -9.041
  188    HA   LEU  32           HA       LEU  32   0.350   5.102  -9.024
  189   1HB   LEU  32          1HB       LEU  32  -1.218   7.310  -8.309
  190   2HB   LEU  32          2HB       LEU  32  -0.433   6.826  -6.805
  191    HG   LEU  32           HG       LEU  32   1.743   6.718  -8.169
  192   1HD1  LEU  32          1HD1      LEU  32   0.273   6.890 -10.343
  193   2HD1  LEU  32          2HD1      LEU  32   0.350   8.624 -10.028
  194   3HD1  LEU  32          3HD1      LEU  32   1.835   7.707 -10.283
  195   1HD2  LEU  32          1HD2      LEU  32   0.219   9.124  -7.299
  196   2HD2  LEU  32          2HD2      LEU  32   1.784   8.526  -6.750
  197   3HD2  LEU  32          3HD2      LEU  32   1.664   9.413  -8.270
  198    H    MET  33           H        MET  33  -2.217   4.750  -6.578
  199    HA   MET  33           HA       MET  33  -0.751   3.796  -4.387
  200   1HB   MET  33          1HB       MET  33  -3.482   3.368  -5.538
  201   2HB   MET  33          2HB       MET  33  -2.993   2.364  -4.174
  202   1HG   MET  33          1HG       MET  33  -2.858   4.165  -2.719
  203   2HG   MET  33          2HG       MET  33  -2.503   5.313  -4.010
  204   1HE   MET  33          1HE       MET  33  -5.080   2.519  -3.877
  205   2HE   MET  33          2HE       MET  33  -5.306   3.152  -2.241
  206   3HE   MET  33          3HE       MET  33  -6.595   3.300  -3.434
  207    H    MET  34           H        MET  34  -1.795   2.028  -7.292
  208    HA   MET  34           HA       MET  34  -0.838  -0.559  -6.310
  209   1HB   MET  34          1HB       MET  34  -2.736  -0.322  -7.845
  210   2HB   MET  34          2HB       MET  34  -1.698   0.473  -9.030
  211   1HG   MET  34          1HG       MET  34  -0.716  -1.486  -9.684
  212   2HG   MET  34          2HG       MET  34  -0.760  -2.168  -8.059
  213   1HE   MET  34          1HE       MET  34  -2.703  -2.943  -6.876
  214   2HE   MET  34          2HE       MET  34  -3.942  -1.752  -7.294
  215   3HE   MET  34          3HE       MET  34  -4.244  -3.469  -7.546
  216    H    GLN  35           H        GLN  35   0.430   2.047  -8.330
  217    HA   GLN  35           HA       GLN  35   2.521   0.838  -9.709
  218   1HB   GLN  35          1HB       GLN  35   1.921   3.194  -9.873
  219   2HB   GLN  35          2HB       GLN  35   2.434   3.475  -8.211
  220   1HG   GLN  35          2HG       GLN  35   4.463   3.997  -9.053
  221   2HG   GLN  35          1HG       GLN  35   4.655   2.280  -9.405
  222   2HE2  GLN  35          2HE2      GLN  35   3.267   5.273 -10.858
  223   1HE2  GLN  35          1HE2      GLN  35   3.575   4.812 -12.462
  224    H    HIS  36           H        HIS  36   3.449   2.657  -6.797
  225    HA   HIS  36           HA       HIS  36   5.804   1.178  -6.289
  226   1HB   HIS  36          1HB       HIS  36   4.058   3.126  -4.938
  227   2HB   HIS  36          2HB       HIS  36   4.990   2.119  -3.832
  228    HD1  HIS  36           HD1      HIS  36   6.374   2.951  -7.208
  229    HD2  HIS  36           HD2      HIS  36   6.820   4.246  -3.271
  230    HE1  HIS  36           HE1      HIS  36   8.427   4.433  -7.171
  231    H    ALA  37           H        ALA  37   2.473   0.594  -5.227
  232    HA   ALA  37           HA       ALA  37   2.822  -1.284  -3.175
  233   1HB   ALA  37          1HB       ALA  37   0.846  -1.103  -5.468
  234   2HB   ALA  37          3HB       ALA  37   0.638  -2.207  -4.108
  235   3HB   ALA  37          2HB       ALA  37   0.655  -0.464  -3.836
  236    H    GLN  38           H        GLN  38   2.985  -1.797  -6.700
  237    HA   GLN  38           HA       GLN  38   3.212  -4.629  -6.727
  238   1HB   GLN  38          1HB       GLN  38   3.992  -2.319  -8.458
  239   2HB   GLN  38          2HB       GLN  38   4.666  -3.900  -8.858
  240   1HG   GLN  38          1HG       GLN  38   2.224  -4.757  -8.626
  241   2HG   GLN  38          2HG       GLN  38   1.774  -3.057  -8.772
  242   2HE2  GLN  38          2HE2      GLN  38   0.776  -4.215 -10.868
  243   1HE2  GLN  38          1HE2      GLN  38   1.759  -4.154 -12.250
  244    H    ASN  39           H        ASN  39   5.709  -2.109  -6.354
  245    HA   ASN  39           HA       ASN  39   7.831  -4.152  -6.063
  246   1HB   ASN  39          1HB       ASN  39   7.618  -1.162  -6.280
  247   2HB   ASN  39          2HB       ASN  39   9.109  -1.876  -5.668
  248   2HD2  ASN  39          2HD2      ASN  39   8.950  -0.484  -8.211
  249   1HD2  ASN  39          1HD2      ASN  39   9.262  -1.617  -9.436
  250    H    LEU  40           H        LEU  40   5.509  -3.481  -4.034
  251    HA   LEU  40           HA       LEU  40   5.287  -3.421  -1.692
  252   1HB   LEU  40          1HB       LEU  40   7.912  -4.719  -2.314
  253   2HB   LEU  40          2HB       LEU  40   7.545  -4.357  -0.627
  254    HG   LEU  40           HG       LEU  40   5.187  -5.450  -1.387
  255   1HD1  LEU  40          1HD1      LEU  40   7.354  -6.755  -3.057
  256   2HD1  LEU  40          2HD1      LEU  40   5.785  -7.493  -2.739
  257   3HD1  LEU  40          3HD1      LEU  40   5.881  -5.982  -3.643
  258   1HD2  LEU  40          1HD2      LEU  40   7.715  -6.621  -0.262
  259   2HD2  LEU  40          2HD2      LEU  40   6.179  -6.305   0.547
  260   3HD2  LEU  40          3HD2      LEU  40   6.333  -7.676  -0.553
  261    H    GLU  41           H        GLU  41   6.624  -1.100  -3.229
  262    HA   GLU  41           HA       GLU  41   8.093   0.152  -0.934
  263   1HB   GLU  41          1HB       GLU  41   8.032   0.569  -3.928
  264   2HB   GLU  41          2HB       GLU  41   8.745   1.763  -2.843
  265   1HG   GLU  41          1HG       GLU  41   9.552  -1.124  -2.613
  266   2HG   GLU  41          2HG       GLU  41  10.271  -0.114  -3.867
  267    H    PHE  42           H        PHE  42   5.052  -0.088  -1.543
  268    HA   PHE  42           HA       PHE  42   4.238   2.581  -2.120
  269   1HB   PHE  42          1HB       PHE  42   1.994   1.653  -1.710
  270   2HB   PHE  42          2HB       PHE  42   2.949   0.613  -2.752
  271    HD1  PHE  42           HD1      PHE  42   4.412   0.129   0.419
  272    HD2  PHE  42           HD2      PHE  42   0.781  -0.748  -1.762
  273    HE1  PHE  42           HE1      PHE  42   3.956  -1.776   1.937
  274    HE2  PHE  42           HE2      PHE  42   0.340  -2.662  -0.234
  275    HZ   PHE  42           HZ       PHE  42   1.923  -3.174   1.612
  276    H    GLU  43           H        GLU  43   5.915   2.106   0.451
  277    HA   GLU  43           HA       GLU  43   4.356   2.516   2.773
  278   1HB   GLU  43          1HB       GLU  43   6.762   2.171   2.836
  279   2HB   GLU  43          2HB       GLU  43   7.041   3.613   1.862
  280   1HG   GLU  43          1HG       GLU  43   5.966   4.960   3.713
  281   2HG   GLU  43          2HG       GLU  43   5.983   3.495   4.697
  282    H    GLU  44           H        GLU  44   5.854   4.984   0.672
  283    HA   GLU  44           HA       GLU  44   4.131   7.114   1.731
  284   1HB   GLU  44          1HB       GLU  44   5.431   8.477   0.129
  285   2HB   GLU  44          2HB       GLU  44   6.508   7.447   1.074
  286   1HG   GLU  44          1HG       GLU  44   6.808   5.925  -0.727
  287   2HG   GLU  44          2HG       GLU  44   5.436   6.583  -1.617
  288    H    ALA  45           H        ALA  45   4.185   4.863  -0.967
  289    HA   ALA  45           HA       ALA  45   2.395   6.300  -2.726
  290   1HB   ALA  45          1HB       ALA  45   2.511   4.333  -3.995
  291   2HB   ALA  45          3HB       ALA  45   3.995   4.230  -3.049
  292   3HB   ALA  45          2HB       ALA  45   2.577   3.297  -2.566
  293    H    ALA  46           H        ALA  46   1.791   3.591  -0.439
  294    HA   ALA  46           HA       ALA  46  -1.000   3.389  -0.832
  295   1HB   ALA  46          1HB       ALA  46   0.913   2.187   0.704
  296   2HB   ALA  46          3HB       ALA  46  -0.816   1.900   0.893
  297   3HB   ALA  46          2HB       ALA  46   0.005   3.066   1.933
  298    H    GLN  47           H        GLN  47   0.842   5.786   0.967
  299    HA   GLN  47           HA       GLN  47  -1.188   6.831   2.651
  300   1HB   GLN  47          1HB       GLN  47   1.128   8.085   1.153
  301   2HB   GLN  47          2HB       GLN  47   0.176   8.965   2.349
  302   1HG   GLN  47          1HG       GLN  47   0.718   6.712   3.755
  303   2HG   GLN  47          2HG       GLN  47   2.160   6.794   2.740
  304   2HE2  GLN  47          2HE2      GLN  47   0.216   8.736   5.050
  305   1HE2  GLN  47          1HE2      GLN  47   1.502   9.736   5.528
  306    H    ILE  48           H        ILE  48  -0.632   7.193  -0.812
  307    HA   ILE  48           HA       ILE  48  -2.230   9.434  -1.426
  308    HB   ILE  48           HB       ILE  48  -1.814   6.787  -2.858
  309   1HG1  ILE  48          1HG1      ILE  48  -0.473   9.476  -3.265
  310   2HG1  ILE  48          2HG1      ILE  48   0.212   8.182  -2.280
  311   1HG2  ILE  48          1HG2      ILE  48  -3.322   9.231  -3.584
  312   2HG2  ILE  48          2HG2      ILE  48  -2.217   8.631  -4.821
  313   3HG2  ILE  48          3HG2      ILE  48  -3.488   7.583  -4.192
  314   1HD1  ILE  48          1HD1      ILE  48   0.008   6.675  -4.314
  315   2HD1  ILE  48          2HD1      ILE  48  -0.376   8.121  -5.248
  316   3HD1  ILE  48          3HD1      ILE  48   1.194   7.971  -4.460
  317    H    ARG  49           H        ARG  49  -3.143   6.198  -0.441
  318    HA   ARG  49           HA       ARG  49  -5.829   6.039  -1.280
  319   1HB   ARG  49          1HB       ARG  49  -4.733   4.181  -0.248
  320   2HB   ARG  49          2HB       ARG  49  -4.305   5.126   1.174
  321   1HG   ARG  49          1HG       ARG  49  -7.160   5.190   0.856
  322   2HG   ARG  49          2HG       ARG  49  -6.616   3.514   0.782
  323   1HD   ARG  49          1HD       ARG  49  -7.081   4.253   3.130
  324   2HD   ARG  49          2HD       ARG  49  -5.379   3.808   2.900
  325    HE   ARG  49           HE       ARG  49  -4.892   6.253   2.630
  326   1HH1  ARG  49          1HH1      ARG  49  -8.178   6.207   2.726
  327   2HH1  ARG  49          2HH1      ARG  49  -8.364   7.276   4.076
  328   1HH2  ARG  49          1HH2      ARG  49  -5.000   7.227   4.918
  329   2HH2  ARG  49          2HH2      ARG  49  -6.566   7.854   5.317
  330    H    ASP  50           H        ASP  50  -4.344   8.006   1.216
  331    HA   ASP  50           HA       ASP  50  -6.828   8.733   2.563
  332   1HB   ASP  50          1HB       ASP  50  -4.471   8.728   3.504
  333   2HB   ASP  50          2HB       ASP  50  -4.147  10.151   2.514
  334    H    GLN  51           H        GLN  51  -4.849  10.076  -0.050
  335    HA   GLN  51           HA       GLN  51  -6.361  12.575  -0.216
  336   1HB   GLN  51          2HB       GLN  51  -4.468  11.216  -2.164
  337   2HB   GLN  51          1HB       GLN  51  -4.919  12.921  -2.172
  338   1HG   GLN  51          1HG       GLN  51  -3.815  13.315  -0.080
  339   2HG   GLN  51          2HG       GLN  51  -3.593  11.586   0.199
  340   2HE2  GLN  51          2HE2      GLN  51  -3.070  13.189  -2.944
  341   1HE2  GLN  51          1HE2      GLN  51  -1.397  12.912  -2.994
  342    H    LEU  52           H        LEU  52  -6.455   9.397  -1.742
  343    HA   LEU  52           HA       LEU  52  -8.138  10.027  -3.972
  344   1HB   LEU  52          1HB       LEU  52  -6.862   7.813  -2.796
  345   2HB   LEU  52          2HB       LEU  52  -8.576   7.398  -2.809
  346    HG   LEU  52           HG       LEU  52  -7.462   6.695  -4.905
  347   1HD1  LEU  52          1HD1      LEU  52  -9.430   8.990  -5.152
  348   2HD1  LEU  52          2HD1      LEU  52  -9.015   7.898  -6.473
  349   3HD1  LEU  52          3HD1      LEU  52  -9.817   7.273  -5.031
  350   1HD2  LEU  52          1HD2      LEU  52  -6.157   9.178  -4.627
  351   2HD2  LEU  52          2HD2      LEU  52  -5.989   8.038  -5.962
  352   3HD2  LEU  52          3HD2      LEU  52  -7.174   9.340  -6.059
  353    H    HIS  53           H        HIS  53  -8.890   9.020  -0.633
  354    HA   HIS  53           HA       HIS  53 -11.780   9.022  -1.094
  355   1HB   HIS  53          1HB       HIS  53 -10.282   7.672   0.567
  356   2HB   HIS  53          2HB       HIS  53 -10.378   9.117   1.572
  357    HD1  HIS  53           HD1      HIS  53 -12.437   9.363   2.978
  358    HD2  HIS  53           HD2      HIS  53 -12.988   6.615  -0.108
  359    HE1  HIS  53           HE1      HIS  53 -14.720   8.327   3.339
  360    H    GLN  54           H        GLN  54  -9.369  11.320   0.019
  361    HA   GLN  54           HA       GLN  54 -11.306  13.164   1.217
  362   1HB   GLN  54          1HB       GLN  54  -8.374  13.018   0.643
  363   2HB   GLN  54          2HB       GLN  54  -9.072  14.608   0.951
  364   1HG   GLN  54          1HG       GLN  54  -9.748  12.340   2.796
  365   2HG   GLN  54          2HG       GLN  54  -8.189  13.150   2.965
  366   2HE2  GLN  54          2HE2      GLN  54  -8.328  15.633   3.155
  367   1HE2  GLN  54          1HE2      GLN  54  -9.662  16.281   3.981
  368    H    LEU  55           H        LEU  55  -9.616  12.847  -1.885
  369    HA   LEU  55           HA       LEU  55 -10.276  15.422  -2.952
  370   1HB   LEU  55          1HB       LEU  55  -9.182  12.842  -3.806
  371   2HB   LEU  55          2HB       LEU  55 -10.077  13.662  -5.087
  372    HG   LEU  55           HG       LEU  55  -8.624  15.722  -3.953
  373   1HD1  LEU  55          1HD1      LEU  55  -7.023  13.155  -3.899
  374   2HD1  LEU  55          2HD1      LEU  55  -6.263  14.744  -3.994
  375   3HD1  LEU  55          3HD1      LEU  55  -7.246  14.319  -2.593
  376   1HD2  LEU  55          1HD2      LEU  55  -8.770  14.252  -6.415
  377   2HD2  LEU  55          2HD2      LEU  55  -8.242  15.916  -6.165
  378   3HD2  LEU  55          3HD2      LEU  55  -7.076  14.597  -6.065
  379    H    ARG  56           H        ARG  56 -12.138  12.445  -2.703
  380    HA   ARG  56           HA       ARG  56 -14.069  12.939  -4.740
  381   1HB   ARG  56          1HB       ARG  56 -15.352  11.272  -3.541
  382   2HB   ARG  56          2HB       ARG  56 -13.649  10.840  -3.400
  383   1HG   ARG  56          2HG       ARG  56 -14.157  10.676  -1.179
  384   2HG   ARG  56          1HG       ARG  56 -13.918  12.423  -1.211
  385   1HD   ARG  56          2HD       ARG  56 -16.046  12.077  -0.146
  386   2HD   ARG  56          1HD       ARG  56 -16.427  12.584  -1.804
  387    HE   ARG  56           HE       ARG  56 -16.144   9.792  -1.908
  388   1HH1  ARG  56          1HH1      ARG  56 -17.541  10.910   0.814
  389   2HH1  ARG  56          2HH1      ARG  56 -19.161  10.413   0.455
  390   1HH2  ARG  56          1HH2      ARG  56 -18.481   9.663  -2.862
  391   2HH2  ARG  56          2HH2      ARG  56 -19.694   9.707  -1.625
  392    H    GLU  57           H        GLU  57 -13.646  14.372  -1.576
  393    HA   GLU  57           HA       GLU  57 -16.349  15.416  -1.313
  394   1HB   GLU  57          1HB       GLU  57 -13.729  16.304  -0.062
  395   2HB   GLU  57          2HB       GLU  57 -15.346  16.628   0.563
  396   1HG   GLU  57          1HG       GLU  57 -15.700  14.138   0.722
  397   2HG   GLU  57          2HG       GLU  57 -13.998  13.928   0.304
  398    H    LEU  58           H        LEU  58 -13.258  16.687  -2.532
  399    HA   LEU  58           HA       LEU  58 -13.975  19.402  -2.901
  400   1HB   LEU  58          1HB       LEU  58 -12.082  17.433  -4.127
  401   2HB   LEU  58          2HB       LEU  58 -12.274  18.999  -4.916
  402    HG   LEU  58           HG       LEU  58 -12.071  19.579  -2.174
  403   1HD1  LEU  58          1HD1      LEU  58 -10.026  17.517  -3.056
  404   2HD1  LEU  58          2HD1      LEU  58  -9.901  18.496  -1.594
  405   3HD1  LEU  58          3HD1      LEU  58 -11.210  17.326  -1.762
  406   1HD2  LEU  58          1HD2      LEU  58 -11.055  20.516  -4.502
  407   2HD2  LEU  58          2HD2      LEU  58 -10.415  20.981  -2.925
  408   3HD2  LEU  58          3HD2      LEU  58  -9.623  19.712  -3.859
  409    H    PHE  59           H        PHE  59 -15.057  16.565  -4.595
  410    HA   PHE  59           HA       PHE  59 -15.692  17.436  -7.164
  411   1HB   PHE  59          1HB       PHE  59 -16.076  15.181  -6.319
  412   2HB   PHE  59          2HB       PHE  59 -17.294  15.776  -5.191
  413    HD1  PHE  59           HD1      PHE  59 -16.522  15.990  -8.878
  414    HD2  PHE  59           HD2      PHE  59 -19.530  15.527  -5.815
  415    HE1  PHE  59           HE1      PHE  59 -18.274  15.748 -10.634
  416    HE2  PHE  59           HE2      PHE  59 -21.282  15.287  -7.571
  417    HZ   PHE  59           HZ       PHE  59 -20.654  15.397  -9.982
  418    H    ILE  60           H        ILE  60 -17.550  18.046  -4.171
  419    HA   ILE  60           HA       ILE  60 -19.654  19.530  -5.526
  420    HB   ILE  60           HB       ILE  60 -18.760  19.329  -2.631
  421   1HG1  ILE  60          1HG1      ILE  60 -21.165  18.004  -3.868
  422   2HG1  ILE  60          2HG1      ILE  60 -19.573  17.258  -4.019
  423   1HG2  ILE  60          1HG2      ILE  60 -20.598  21.119  -3.838
  424   2HG2  ILE  60          2HG2      ILE  60 -21.561  19.893  -3.013
  425   3HG2  ILE  60          3HG2      ILE  60 -20.362  20.824  -2.115
  426   1HD1  ILE  60          1HD1      ILE  60 -20.357  18.201  -1.306
  427   2HD1  ILE  60          2HD1      ILE  60 -21.192  16.776  -1.923
  428   3HD1  ILE  60          3HD1      ILE  60 -19.436  16.773  -1.778
  429    H    ALA  61           H        ALA  61 -16.628  20.369  -3.883
  430    HA   ALA  61           HA       ALA  61 -17.127  23.240  -3.878
  431   1HB   ALA  61          1HB       ALA  61 -15.158  21.304  -2.979
  432   2HB   ALA  61          2HB       ALA  61 -15.484  22.921  -2.357
  433   3HB   ALA  61          3HB       ALA  61 -14.368  22.704  -3.705
  434    H    ALA  62           H        ALA  62 -15.968  20.954  -6.222
  435    HA   ALA  62           HA       ALA  62 -14.766  23.128  -7.879
  436   1HB   ALA  62          1HB       ALA  62 -13.769  20.751  -7.226
  437   2HB   ALA  62          3HB       ALA  62 -13.492  21.429  -8.831
  438   3HB   ALA  62          2HB       ALA  62 -14.749  20.216  -8.591
  439    H    SER  63           H        SER  63 -16.898  20.273  -8.333
  440    HA   SER  63           HA       SER  63 -17.928  21.202 -10.874
  441   1HB   SER  63          1HB       SER  63 -17.788  18.834 -10.029
  442   2HB   SER  63          2HB       SER  63 -19.079  19.213  -8.893
  443    HG   SER  63           HG       SER  63 -19.146  18.841 -11.640
  444    H    LEU   8           H        LEU   8  23.742 -31.999  21.923
  445    HA   LEU   8           HA       LEU   8  24.201 -32.010  19.161
  446   1HB   LEU   8          1HB       LEU   8  22.287 -30.425  19.115
  447   2HB   LEU   8          2HB       LEU   8  22.022 -31.724  20.277
  448    HG   LEU   8           HG       LEU   8  23.389 -29.755  21.724
  449   1HD1  LEU   8          1HD1      LEU   8  21.646 -28.598  19.609
  450   2HD1  LEU   8          2HD1      LEU   8  21.467 -27.924  21.229
  451   3HD1  LEU   8          3HD1      LEU   8  23.039 -27.892  20.430
  452   1HD2  LEU   8          1HD2      LEU   8  20.614 -30.843  21.554
  453   2HD2  LEU   8          2HD2      LEU   8  21.742 -30.852  22.910
  454   3HD2  LEU   8          3HD2      LEU   8  20.851 -29.383  22.514
  455    H    GLU   9           H        GLU   9  25.305 -30.661  17.765
  456    HA   GLU   9           HA       GLU   9  26.003 -27.906  18.578
  457   1HB   GLU   9          2HB       GLU   9  28.422 -28.360  18.334
  458   2HB   GLU   9          1HB       GLU   9  27.722 -29.372  19.599
  459   1HG   GLU   9          1HG       GLU   9  27.367 -30.879  17.289
  460   2HG   GLU   9          2HG       GLU   9  28.962 -30.159  17.073
  461    HA   PRO  10           HA       PRO  10  25.471 -28.845  14.005
  462   1HB   PRO  10          1HB       PRO  10  23.249 -27.304  13.585
  463   2HB   PRO  10          2HB       PRO  10  23.164 -29.012  14.059
  464   1HG   PRO  10          2HG       PRO  10  22.827 -26.567  15.720
  465   2HG   PRO  10          1HG       PRO  10  21.962 -28.110  15.792
  466   1HD   PRO  10          1HD       PRO  10  23.953 -27.406  17.525
  467   2HD   PRO  10          2HD       PRO  10  23.552 -29.088  17.112
  468    H    ASP  11           H        ASP  11  24.710 -25.765  15.668
  469    HA   ASP  11           HA       ASP  11  25.552 -23.588  15.336
  470   1HB   ASP  11          1HB       ASP  11  27.654 -25.502  14.823
  471   2HB   ASP  11          2HB       ASP  11  27.852 -24.107  13.762
  472    H    ASN  12           H        ASN  12  26.855 -24.965  12.332
  473    HA   ASN  12           HA       ASN  12  24.691 -23.728  10.732
  474   1HB   ASN  12          1HB       ASN  12  26.722 -22.143  11.457
  475   2HB   ASN  12          2HB       ASN  12  27.493 -22.920  10.074
  476   2HD2  ASN  12          2HD2      ASN  12  24.939 -23.270   8.586
  477   1HD2  ASN  12          1HD2      ASN  12  24.495 -21.723   8.046
  478    H    VAL  13           H        VAL  13  25.882 -26.462  11.162
  479    HA   VAL  13           HA       VAL  13  27.353 -27.095   8.717
  480    HB   VAL  13           HB       VAL  13  26.347 -28.454  11.177
  481   1HG1  VAL  13          1HG1      VAL  13  26.771 -29.866   8.550
  482   2HG1  VAL  13          2HG1      VAL  13  27.179 -30.673  10.064
  483   3HG1  VAL  13          3HG1      VAL  13  25.523 -30.143   9.766
  484   1HG2  VAL  13          1HG2      VAL  13  28.648 -27.474  10.838
  485   2HG2  VAL  13          2HG2      VAL  13  28.637 -29.170  11.323
  486   3HG2  VAL  13          3HG2      VAL  13  28.936 -28.735   9.639
  487    HA   PRO  14           HA       PRO  14  23.176 -28.942   7.410
  488   1HB   PRO  14          1HB       PRO  14  20.976 -28.552   8.980
  489   2HB   PRO  14          2HB       PRO  14  22.090 -29.912   9.212
  490   1HG   PRO  14          2HG       PRO  14  21.795 -27.429  10.781
  491   2HG   PRO  14          1HG       PRO  14  22.324 -29.037  11.291
  492   1HD   PRO  14          1HD       PRO  14  23.981 -26.841  10.791
  493   2HD   PRO  14          2HD       PRO  14  24.490 -28.531  10.953
  494    H    MET  15           H        MET  15  22.191 -26.125   9.396
  495    HA   MET  15           HA       MET  15  22.131 -24.283   7.193
  496   1HB   MET  15          1HB       MET  15  20.195 -26.083   6.897
  497   2HB   MET  15          2HB       MET  15  19.363 -25.049   8.060
  498   1HG   MET  15          1HG       MET  15  19.322 -23.223   6.614
  499   2HG   MET  15          2HG       MET  15  20.712 -23.795   5.690
  500   1HE   MET  15          1HE       MET  15  20.406 -24.128   3.506
  501   2HE   MET  15          2HE       MET  15  18.929 -24.539   2.639
  502   3HE   MET  15          3HE       MET  15  19.028 -23.019   3.525
  503    H    ASP  16           H        ASP  16  21.344 -22.161   7.895
  504    HA   ASP  16           HA       ASP  16  20.161 -21.695  10.477
  505   1HB   ASP  16          1HB       ASP  16  22.310 -22.581  11.245
  506   2HB   ASP  16          2HB       ASP  16  23.176 -21.446  10.209
  507    H    MET  17           H        MET  17  19.059 -20.327   8.830
  508    HA   MET  17           HA       MET  17  20.590 -17.827   8.193
  509   1HB   MET  17          1HB       MET  17  18.943 -17.642   6.322
  510   2HB   MET  17          2HB       MET  17  19.876 -19.137   6.246
  511   1HG   MET  17          1HG       MET  17  18.053 -20.402   7.215
  512   2HG   MET  17          2HG       MET  17  17.139 -18.926   7.527
  513   1HE   MET  17          1HE       MET  17  15.720 -18.036   6.482
  514   2HE   MET  17          2HE       MET  17  15.406 -17.886   4.748
  515   3HE   MET  17          3HE       MET  17  14.776 -19.265   5.645
  516    H    SER  18           H        SER  18  17.807 -19.182   9.790
  517    HA   SER  18           HA       SER  18  17.184 -16.582  11.007
  518   1HB   SER  18          1HB       SER  18  15.304 -17.996   9.092
  519   2HB   SER  18          2HB       SER  18  14.826 -16.658  10.134
  520    HG   SER  18           HG       SER  18  15.419 -15.810   8.165
  521    HA   PRO  19           HA       PRO  19  15.606 -19.339  14.054
  522   1HB   PRO  19          1HB       PRO  19  13.867 -17.729  15.409
  523   2HB   PRO  19          2HB       PRO  19  15.628 -17.538  15.484
  524   1HG   PRO  19          1HG       PRO  19  13.630 -15.894  14.115
  525   2HG   PRO  19          2HG       PRO  19  15.256 -15.475  14.653
  526   1HD   PRO  19          1HD       PRO  19  14.407 -16.106  12.010
  527   2HD   PRO  19          2HD       PRO  19  16.060 -15.779  12.572
  528    H    LYS  20           H        LYS  20  13.919 -18.984  11.423
  529    HA   LYS  20           HA       LYS  20  11.977 -20.003  10.563
  530   1HB   LYS  20          1HB       LYS  20  12.924 -21.728  12.269
  531   2HB   LYS  20          2HB       LYS  20  11.584 -21.215  13.293
  532   1HG   LYS  20          1HG       LYS  20  10.961 -21.870  10.451
  533   2HG   LYS  20          2HG       LYS  20  11.319 -23.214  11.535
  534   1HD   LYS  20          1HD       LYS  20   9.492 -21.183  12.655
  535   2HD   LYS  20          2HD       LYS  20   8.847 -22.076  11.277
  536   1HE   LYS  20          1HE       LYS  20  10.248 -23.712  13.330
  537   2HE   LYS  20          2HE       LYS  20   8.685 -23.019  13.810
  538   1HZ   LYS  20          1HZ       LYS  20   7.790 -23.814  11.655
  539   2HZ   LYS  20          2HZ       LYS  20   9.253 -24.634  11.382
  540   3HZ   LYS  20          3HZ       LYS  20   8.266 -25.075  12.689
  541    H    ALA  21           H        ALA  21  11.090 -19.479  14.004
  542    HA   ALA  21           HA       ALA  21   8.432 -18.745  13.693
  543   1HB   ALA  21          1HB       ALA  21  10.634 -17.863  15.552
  544   2HB   ALA  21          3HB       ALA  21   8.993 -17.250  15.754
  545   3HB   ALA  21          2HB       ALA  21   9.308 -18.981  15.869
  546    H    LEU  22           H        LEU  22  11.237 -16.537  13.480
  547    HA   LEU  22           HA       LEU  22   9.559 -14.237  12.772
  548   1HB   LEU  22          1HB       LEU  22  12.512 -14.851  12.972
  549   2HB   LEU  22          2HB       LEU  22  11.946 -13.303  12.345
  550    HG   LEU  22           HG       LEU  22  10.587 -13.035  14.452
  551   1HD1  LEU  22          1HD1      LEU  22  11.950 -15.644  14.990
  552   2HD1  LEU  22          2HD1      LEU  22  11.671 -14.549  16.345
  553   3HD1  LEU  22          3HD1      LEU  22  10.311 -15.138  15.389
  554   1HD2  LEU  22          1HD2      LEU  22  12.843 -11.996  14.124
  555   2HD2  LEU  22          2HD2      LEU  22  12.495 -12.358  15.814
  556   3HD2  LEU  22          3HD2      LEU  22  13.567 -13.410  14.888
  557    H    GLN  23           H        GLN  23  11.795 -16.443  11.135
  558    HA   GLN  23           HA       GLN  23  11.919 -15.315   8.568
  559   1HB   GLN  23          1HB       GLN  23  13.163 -17.292   9.351
  560   2HB   GLN  23          2HB       GLN  23  11.667 -18.225   9.398
  561   1HG   GLN  23          1HG       GLN  23  11.418 -17.607   6.905
  562   2HG   GLN  23          2HG       GLN  23  13.117 -17.137   6.985
  563   2HE2  GLN  23          2HE2      GLN  23  11.973 -19.433   5.472
  564   1HE2  GLN  23          1HE2      GLN  23  12.727 -20.823   6.090
  565    H    GLN  24           H        GLN  24   9.450 -17.617   9.784
  566    HA   GLN  24           HA       GLN  24   7.860 -17.490   7.354
  567   1HB   GLN  24          1HB       GLN  24   8.033 -19.346   9.108
  568   2HB   GLN  24          2HB       GLN  24   7.010 -18.339  10.134
  569   1HG   GLN  24          2HG       GLN  24   5.464 -19.731   9.028
  570   2HG   GLN  24          1HG       GLN  24   5.421 -18.242   8.082
  571   2HE2  GLN  24          2HE2      GLN  24   5.943 -18.409   5.875
  572   1HE2  GLN  24          1HE2      GLN  24   6.590 -19.800   5.149
  573    H    LYS  25           H        LYS  25   7.888 -15.746  10.424
  574    HA   LYS  25           HA       LYS  25   5.281 -14.525  10.151
  575   1HB   LYS  25          1HB       LYS  25   7.752 -14.238  11.798
  576   2HB   LYS  25          2HB       LYS  25   6.643 -12.866  11.778
  577   1HG   LYS  25          1HG       LYS  25   4.871 -14.125  12.682
  578   2HG   LYS  25          2HG       LYS  25   5.619 -15.661  12.244
  579   1HD   LYS  25          1HD       LYS  25   6.651 -15.765  14.239
  580   2HD   LYS  25          2HD       LYS  25   7.411 -14.198  13.953
  581   1HE   LYS  25          2HE       LYS  25   6.118 -13.838  15.912
  582   2HE   LYS  25          1HE       LYS  25   5.074 -13.217  14.618
  583   1HZ   LYS  25          1HZ       LYS  25   5.015 -16.047  15.497
  584   2HZ   LYS  25          2HZ       LYS  25   4.007 -14.864  16.184
  585   3HZ   LYS  25          3HZ       LYS  25   3.881 -15.228  14.532
  586    H    ILE  26           H        ILE  26   8.596 -13.393   9.412
  587    HA   ILE  26           HA       ILE  26   7.775 -10.810   8.417
  588    HB   ILE  26           HB       ILE  26  10.245 -12.502   7.913
  589   1HG1  ILE  26          1HG1      ILE  26   9.860 -10.273   9.927
  590   2HG1  ILE  26          2HG1      ILE  26   9.601 -11.971  10.332
  591   1HG2  ILE  26          1HG2      ILE  26   9.777 -10.493   6.377
  592   2HG2  ILE  26          2HG2      ILE  26  10.013  -9.490   7.809
  593   3HG2  ILE  26          3HG2      ILE  26  11.329 -10.504   7.216
  594   1HD1  ILE  26          1HD1      ILE  26  12.175 -10.814   9.219
  595   2HD1  ILE  26          2HD1      ILE  26  11.898 -11.241  10.908
  596   3HD1  ILE  26          3HD1      ILE  26  11.909 -12.498   9.669
  597    H    HIS  27           H        HIS  27   8.625 -13.884   6.791
  598    HA   HIS  27           HA       HIS  27   8.236 -12.916   4.109
  599   1HB   HIS  27          1HB       HIS  27   8.536 -15.502   5.556
  600   2HB   HIS  27          2HB       HIS  27   7.833 -15.585   3.939
  601    HD1  HIS  27           HD1      HIS  27  10.363 -16.866   3.737
  602    HD2  HIS  27           HD2      HIS  27  10.237 -12.701   3.838
  603    HE1  HIS  27           HE1      HIS  27  12.561 -16.060   2.771
  604    H    GLU  28           H        GLU  28   6.024 -13.997   6.588
  605    HA   GLU  28           HA       GLU  28   3.812 -14.581   4.762
  606   1HB   GLU  28          1HB       GLU  28   4.318 -14.416   7.712
  607   2HB   GLU  28          2HB       GLU  28   2.648 -14.403   7.147
  608   1HG   GLU  28          1HG       GLU  28   4.563 -16.462   6.085
  609   2HG   GLU  28          2HG       GLU  28   3.805 -16.700   7.660
  610    H    LEU  29           H        LEU  29   4.800 -11.853   6.828
  611    HA   LEU  29           HA       LEU  29   2.397 -10.292   6.285
  612   1HB   LEU  29          1HB       LEU  29   4.930 -10.109   7.786
  613   2HB   LEU  29          2HB       LEU  29   4.332  -8.559   7.193
  614    HG   LEU  29           HG       LEU  29   2.079  -9.159   8.174
  615   1HD1  LEU  29          1HD1      LEU  29   3.580 -11.607   8.733
  616   2HD1  LEU  29          2HD1      LEU  29   2.810 -10.947  10.176
  617   3HD1  LEU  29          3HD1      LEU  29   1.837 -11.331   8.756
  618   1HD2  LEU  29          1HD2      LEU  29   4.579  -8.676   9.745
  619   2HD2  LEU  29          2HD2      LEU  29   3.178  -7.629   9.520
  620   3HD2  LEU  29          3HD2      LEU  29   3.091  -8.990  10.637
  621    H    GLU  30           H        GLU  30   5.703 -10.419   4.985
  622    HA   GLU  30           HA       GLU  30   5.735  -8.081   3.414
  623   1HB   GLU  30          1HB       GLU  30   7.600  -9.690   3.828
  624   2HB   GLU  30          2HB       GLU  30   6.816 -10.837   2.742
  625   1HG   GLU  30          1HG       GLU  30   7.019  -8.247   1.474
  626   2HG   GLU  30          2HG       GLU  30   8.606  -8.779   2.028
  627    H    GLY  31           H        GLY  31   4.516 -11.331   2.527
  628   1HA   GLY  31          2HA       GLY  31   3.139 -11.996   0.739
  629   2HA   GLY  31          1HA       GLY  31   3.639 -10.530  -0.103
  630    H    LEU  32           H        LEU  32   2.188 -10.437   3.090
  631    HA   LEU  32           HA       LEU  32  -0.554 -10.133   2.371
  632   1HB   LEU  32          1HB       LEU  32   1.070 -10.105   4.652
  633   2HB   LEU  32          2HB       LEU  32   0.315  -8.511   4.635
  634    HG   LEU  32           HG       LEU  32  -1.896  -9.745   4.196
  635   1HD1  LEU  32          1HD1      LEU  32  -0.479 -11.907   3.709
  636   2HD1  LEU  32          2HD1      LEU  32  -0.517 -12.096   5.462
  637   3HD1  LEU  32          3HD1      LEU  32  -2.024 -12.050   4.547
  638   1HD2  LEU  32          1HD2      LEU  32  -0.308  -9.625   6.713
  639   2HD2  LEU  32          2HD2      LEU  32  -1.869  -8.898   6.334
  640   3HD2  LEU  32          3HD2      LEU  32  -1.772 -10.609   6.750
  641    H    MET  33           H        MET  33   2.069  -7.739   2.667
  642    HA   MET  33           HA       MET  33   0.642  -5.339   2.408
  643   1HB   MET  33          1HB       MET  33   3.335  -6.374   1.605
  644   2HB   MET  33          2HB       MET  33   2.862  -4.771   1.042
  645   1HG   MET  33          1HG       MET  33   2.796  -3.886   3.184
  646   2HG   MET  33          2HG       MET  33   2.430  -5.443   3.927
  647   1HE   MET  33          1HE       MET  33   4.960  -4.573   1.223
  648   2HE   MET  33          2HE       MET  33   5.237  -3.186   2.286
  649   3HE   MET  33          3HE       MET  33   6.499  -4.395   2.062
  650    H    MET  34           H        MET  34   1.581  -7.641  -0.136
  651    HA   MET  34           HA       MET  34   0.603  -5.946  -2.314
  652   1HB   MET  34          1HB       MET  34   2.466  -7.522  -2.567
  653   2HB   MET  34          2HB       MET  34   1.412  -8.864  -2.118
  654   1HG   MET  34          1HG       MET  34   0.381  -8.915  -4.157
  655   2HG   MET  34          2HG       MET  34   0.454  -7.164  -4.353
  656   1HE   MET  34          1HE       MET  34   2.413  -5.846  -4.806
  657   2HE   MET  34          2HE       MET  34   3.660  -6.608  -3.810
  658   3HE   MET  34          3HE       MET  34   3.928  -6.370  -5.535
  659    H    GLN  35           H        GLN  35  -0.669  -8.598  -0.358
  660    HA   GLN  35           HA       GLN  35  -2.817  -9.537  -1.860
  661   1HB   GLN  35          1HB       GLN  35  -2.179 -10.375   0.338
  662   2HB   GLN  35          2HB       GLN  35  -2.644  -8.851   1.092
  663   1HG   GLN  35          2HG       GLN  35  -4.684  -9.768   1.403
  664   2HG   GLN  35          1HG       GLN  35  -4.916  -9.612  -0.337
  665   2HE2  GLN  35          2HE2      GLN  35  -3.513 -11.883   2.085
  666   1HE2  GLN  35          1HE2      GLN  35  -3.870 -13.284   1.196
  667    H    HIS  36           H        HIS  36  -3.637  -7.243   0.734
  668    HA   HIS  36           HA       HIS  36  -6.005  -6.291  -0.485
  669   1HB   HIS  36          1HB       HIS  36  -4.191  -5.583   1.725
  670   2HB   HIS  36          2HB       HIS  36  -5.112  -4.217   1.096
  671    HD1  HIS  36           HD1      HIS  36  -6.566  -7.665   0.969
  672    HD2  HIS  36           HD2      HIS  36  -6.890  -4.250   3.338
  673    HE1  HIS  36           HE1      HIS  36  -8.592  -8.010   2.450
  674    H    ALA  37           H        ALA  37  -2.657  -5.172  -0.821
  675    HA   ALA  37           HA       ALA  37  -2.987  -2.665  -2.031
  676   1HB   ALA  37          1HB       ALA  37  -0.822  -3.573  -1.486
  677   2HB   ALA  37          3HB       ALA  37  -1.067  -4.953  -2.556
  678   3HB   ALA  37          2HB       ALA  37  -0.843  -3.340  -3.234
  679    H    GLN  38           H        GLN  38  -3.249  -5.894  -3.519
  680    HA   GLN  38           HA       GLN  38  -3.527  -5.111  -6.236
  681   1HB   GLN  38          1HB       GLN  38  -4.308  -7.412  -4.494
  682   2HB   GLN  38          2HB       GLN  38  -5.020  -7.334  -6.106
  683   1HG   GLN  38          1HG       GLN  38  -2.590  -6.914  -6.922
  684   2HG   GLN  38          2HG       GLN  38  -2.113  -7.544  -5.345
  685   2HE2  GLN  38          2HE2      GLN  38  -1.189  -9.246  -7.073
  686   1HE2  GLN  38          1HE2      GLN  38  -2.206 -10.569  -7.382
  687    H    ASN  39           H        ASN  39  -5.968  -5.420  -3.653
  688    HA   ASN  39           HA       ASN  39  -8.118  -4.520  -5.479
  689   1HB   ASN  39          1HB       ASN  39  -7.857  -5.582  -2.679
  690   2HB   ASN  39          2HB       ASN  39  -9.347  -4.764  -3.155
  691   2HD2  ASN  39          2HD2      ASN  39  -9.227  -7.599  -2.545
  692   1HD2  ASN  39          1HD2      ASN  39  -9.590  -8.446  -3.971
  693    H    LEU  40           H        LEU  40  -5.733  -2.812  -4.318
  694    HA   LEU  40           HA       LEU  40  -5.452  -0.588  -3.600
  695   1HB   LEU  40          1HB       LEU  40  -8.114  -0.764  -4.957
  696   2HB   LEU  40          2HB       LEU  40  -7.698   0.743  -4.141
  697    HG   LEU  40           HG       LEU  40  -5.379   0.278  -5.462
  698   1HD1  LEU  40          1HD1      LEU  40  -7.612  -0.908  -7.134
  699   2HD1  LEU  40          2HD1      LEU  40  -6.048  -0.424  -7.789
  700   3HD1  LEU  40          3HD1      LEU  40  -6.142  -1.719  -6.595
  701   1HD2  LEU  40          1HD2      LEU  40  -7.898   1.740  -6.203
  702   2HD2  LEU  40          2HD2      LEU  40  -6.336   2.394  -5.709
  703   3HD2  LEU  40          3HD2      LEU  40  -6.541   1.733  -7.331
  704    H    GLU  41           H        GLU  41  -6.785  -2.694  -1.779
  705    HA   GLU  41           HA       GLU  41  -8.173  -0.823   0.107
  706   1HB   GLU  41          1HB       GLU  41  -8.182  -3.811  -0.343
  707   2HB   GLU  41          2HB       GLU  41  -8.846  -3.097   1.126
  708   1HG   GLU  41          1HG       GLU  41  -9.697  -2.040  -1.557
  709   2HG   GLU  41          2HG       GLU  41 -10.430  -3.516  -0.928
  710    H    PHE  42           H        PHE  42  -5.154  -1.397  -0.369
  711    HA   PHE  42           HA       PHE  42  -4.309  -2.725   2.006
  712   1HB   PHE  42          1HB       PHE  42  -2.070  -2.110   1.181
  713   2HB   PHE  42          2HB       PHE  42  -3.070  -2.796  -0.089
  714    HD1  PHE  42           HD1      PHE  42  -4.460   0.410   0.381
  715    HD2  PHE  42           HD2      PHE  42  -0.902  -1.502  -1.167
  716    HE1  PHE  42           HE1      PHE  42  -4.000   2.398  -1.026
  717    HE2  PHE  42           HE2      PHE  42  -0.457   0.498  -2.580
  718    HZ   PHE  42           HZ       PHE  42  -2.002   2.443  -2.509
  719    H    GLU  43           H        GLU  43  -5.928  -0.093   2.322
  720    HA   GLU  43           HA       GLU  43  -4.305   1.987   3.335
  721   1HB   GLU  43          1HB       GLU  43  -6.716   2.187   3.083
  722   2HB   GLU  43          2HB       GLU  43  -6.989   0.850   4.198
  723   1HG   GLU  43          1HG       GLU  43  -5.848   2.222   5.986
  724   2HG   GLU  43          2HG       GLU  43  -5.861   3.582   4.861
  725    H    GLU  44           H        GLU  44  -5.809  -0.699   5.143
  726    HA   GLU  44           HA       GLU  44  -4.023  -0.323   7.443
  727   1HB   GLU  44          2HB       GLU  44  -5.340  -2.221   8.325
  728   2HB   GLU  44          1HB       GLU  44  -6.408  -1.001   7.633
  729   1HG   GLU  44          1HG       GLU  44  -6.783  -2.288   5.669
  730   2HG   GLU  44          2HG       GLU  44  -5.422  -3.356   6.014
  731    H    ALA  45           H        ALA  45  -4.186  -2.267   4.521
  732    HA   ALA  45           HA       ALA  45  -2.416  -4.397   5.356
  733   1HB   ALA  45          1HB       ALA  45  -4.060  -4.087   3.318
  734   2HB   ALA  45          3HB       ALA  45  -2.599  -5.053   3.113
  735   3HB   ALA  45          2HB       ALA  45  -2.646  -3.387   2.526
  736    H    ALA  46           H        ALA  46  -1.802  -1.447   3.393
  737    HA   ALA  46           HA       ALA  46   0.975  -1.820   3.019
  738   1HB   ALA  46          1HB       ALA  46   0.808   0.259   2.086
  739   2HB   ALA  46          2HB       ALA  46   0.035   0.942   3.518
  740   3HB   ALA  46          3HB       ALA  46  -0.921   0.030   2.349
  741    H    GLN  47           H        GLN  47  -0.779  -0.741   5.872
  742    HA   GLN  47           HA       GLN  47   1.311   0.538   7.303
  743   1HB   GLN  47          1HB       GLN  47  -1.020  -1.210   8.136
  744   2HB   GLN  47          2HB       GLN  47  -0.022  -0.333   9.295
  745   1HG   GLN  47          1HG       GLN  47  -0.568   1.665   7.548
  746   2HG   GLN  47          2HG       GLN  47  -2.033   0.699   7.373
  747   2HE2  GLN  47          2HE2      GLN  47   0.002   2.323   9.844
  748   1HE2  GLN  47          1HE2      GLN  47  -1.254   2.522  10.969
  749    H    ILE  48           H        ILE  48   0.673  -2.875   6.682
  750    HA   ILE  48           HA       ILE  48   2.295  -4.131   8.617
  751    HB   ILE  48           HB       ILE  48   1.797  -4.744   5.684
  752   1HG1  ILE  48          1HG1      ILE  48   0.492  -5.871   8.178
  753   2HG1  ILE  48          2HG1      ILE  48  -0.189  -4.546   7.233
  754   1HG2  ILE  48          1HG2      ILE  48   3.327  -6.163   7.784
  755   2HG2  ILE  48          2HG2      ILE  48   2.181  -7.157   6.885
  756   3HG2  ILE  48          3HG2      ILE  48   3.448  -6.280   6.029
  757   1HD1  ILE  48          1HD1      ILE  48  -0.064  -6.072   5.207
  758   2HD1  ILE  48          2HD1      ILE  48   0.321  -7.386   6.319
  759   3HD1  ILE  48          3HD1      ILE  48  -1.231  -6.557   6.437
  760    H    ARG  49           H        ARG  49   3.175  -2.284   5.773
  761    HA   ARG  49           HA       ARG  49   5.837  -3.095   5.318
  762   1HB   ARG  49          1HB       ARG  49   4.735  -1.557   3.855
  763   2HB   ARG  49          2HB       ARG  49   4.359  -0.455   5.175
  764   1HG   ARG  49          1HG       ARG  49   7.206  -0.831   5.078
  765   2HG   ARG  49          2HG       ARG  49   6.632  -0.417   3.462
  766   1HD   ARG  49          1HD       ARG  49   7.168   1.616   4.824
  767   2HD   ARG  49          2HD       ARG  49   5.453   1.555   4.374
  768    HE   ARG  49           HE       ARG  49   5.002   0.612   6.652
  769   1HH1  ARG  49          1HH1      ARG  49   8.288   0.651   6.557
  770   2HH1  ARG  49          2HH1      ARG  49   8.528   1.635   7.961
  771   1HH2  ARG  49          1HH2      ARG  49   5.187   2.524   8.235
  772   2HH2  ARG  49          2HH2      ARG  49   6.773   2.696   8.911
  773    H    ASP  50           H        ASP  50   4.450  -1.234   7.947
  774    HA   ASP  50           HA       ASP  50   6.979  -0.197   8.966
  775   1HB   ASP  50          1HB       ASP  50   4.647   0.753   9.285
  776   2HB   ASP  50          2HB       ASP  50   4.325  -0.596  10.377
  777    H    GLN  51           H        GLN  51   4.959  -3.045   9.560
  778    HA   GLN  51           HA       GLN  51   6.510  -3.944  11.872
  779   1HB   GLN  51          2HB       GLN  51   4.544  -5.389  10.062
  780   2HB   GLN  51          1HB       GLN  51   5.025  -5.889  11.684
  781   1HG   GLN  51          1HG       GLN  51   3.981  -3.974  12.681
  782   2HG   GLN  51          2HG       GLN  51   3.736  -3.211  11.108
  783   2HE2  GLN  51          2HE2      GLN  51   3.161  -6.670  11.766
  784   1HE2  GLN  51          1HE2      GLN  51   1.482  -6.605  11.526
  785    H    LEU  52           H        LEU  52   6.509  -4.506   8.391
  786    HA   LEU  52           HA       LEU  52   8.145  -6.855   8.322
  787   1HB   LEU  52          1HB       LEU  52   6.861  -5.075   6.563
  788   2HB   LEU  52          2HB       LEU  52   8.567  -5.002   6.120
  789    HG   LEU  52           HG       LEU  52   7.387  -6.789   4.879
  790   1HD1  LEU  52          1HD1      LEU  52   9.388  -7.717   6.962
  791   2HD1  LEU  52          2HD1      LEU  52   8.920  -8.663   5.549
  792   3HD1  LEU  52          3HD1      LEU  52   9.748  -7.120   5.342
  793   1HD2  LEU  52          1HD2      LEU  52   6.135  -7.203   7.370
  794   2HD2  LEU  52          2HD2      LEU  52   5.911  -8.155   5.902
  795   3HD2  LEU  52          3HD2      LEU  52   7.117  -8.642   7.094
  796    H    HIS  53           H        HIS  53   8.964  -3.383   8.286
  797    HA   HIS  53           HA       HIS  53  11.841  -3.881   8.087
  798   1HB   HIS  53          1HB       HIS  53  10.362  -1.877   7.299
  799   2HB   HIS  53          2HB       HIS  53  10.509  -1.324   8.968
  800    HD1  HIS  53           HD1      HIS  53  12.608  -0.088   9.552
  801    HD2  HIS  53           HD2      HIS  53  13.031  -2.276   6.030
  802    HE1  HIS  53           HE1      HIS  53  14.881   0.508   8.608
  803    H    GLN  54           H        GLN  54   9.501  -3.422  10.664
  804    HA   GLN  54           HA       GLN  54  11.499  -2.835  12.724
  805   1HB   GLN  54          1HB       GLN  54   8.551  -3.285  12.492
  806   2HB   GLN  54          2HB       GLN  54   9.285  -3.456  14.088
  807   1HG   GLN  54          1HG       GLN  54   9.967  -1.056  12.421
  808   2HG   GLN  54          2HG       GLN  54   8.428  -1.094  13.281
  809   2HE2  GLN  54          2HE2      GLN  54   8.615  -1.620  15.713
  810   1HE2  GLN  54          1HE2      GLN  54   9.980  -1.038  16.536
  811    H    LEU  55           H        LEU  55   9.725  -5.684  11.582
  812    HA   LEU  55           HA       LEU  55  10.403  -7.451  13.732
  813   1HB   LEU  55          1HB       LEU  55   9.243  -7.516  11.043
  814   2HB   LEU  55          2HB       LEU  55  10.119  -8.994  11.444
  815    HG   LEU  55           HG       LEU  55   8.732  -8.464  13.775
  816   1HD1  LEU  55          1HD1      LEU  55   7.087  -7.652  11.368
  817   2HD1  LEU  55          2HD1      LEU  55   6.353  -8.180  12.882
  818   3HD1  LEU  55          3HD1      LEU  55   7.364  -6.735  12.849
  819   1HD2  LEU  55          1HD2      LEU  55   8.788 -10.409  11.664
  820   2HD2  LEU  55          2HD2      LEU  55   8.297 -10.632  13.342
  821   3HD2  LEU  55          3HD2      LEU  55   7.110 -10.139  12.135
  822    H    ARG  56           H        ARG  56  12.217  -6.403  10.904
  823    HA   ARG  56           HA       ARG  56  14.104  -8.534  10.753
  824   1HB   ARG  56          1HB       ARG  56  15.389  -6.936   9.465
  825   2HB   ARG  56          2HB       ARG  56  13.682  -6.646   9.131
  826   1HG   ARG  56          1HG       ARG  56  14.243  -4.479   9.591
  827   2HG   ARG  56          2HG       ARG  56  14.035  -5.002  11.264
  828   1HD   ARG  56          2HD       ARG  56  16.182  -3.924  11.182
  829   2HD   ARG  56          1HD       ARG  56  16.530  -5.665  11.188
  830    HE   ARG  56           HE       ARG  56  16.195  -4.965   8.490
  831   1HH1  ARG  56          1HH1      ARG  56  17.681  -2.703  10.300
  832   2HH1  ARG  56          2HH1      ARG  56  19.283  -2.936   9.683
  833   1HH2  ARG  56          1HH2      ARG  56  18.506  -5.888   8.040
  834   2HH2  ARG  56          2HH2      ARG  56  19.750  -4.739   8.404
  835    H    GLU  57           H        GLU  57  13.787  -5.901  13.034
  836    HA   GLU  57           HA       GLU  57  16.514  -5.996  14.045
  837   1HB   GLU  57          2HB       GLU  57  13.942  -4.999  15.314
  838   2HB   GLU  57          1HB       GLU  57  15.581  -4.524  15.763
  839   1HG   GLU  57          1HG       GLU  57  15.895  -3.670  13.412
  840   2HG   GLU  57          2HG       GLU  57  14.180  -3.978  13.133
  841    H    LEU  58           H        LEU  58  13.416  -7.467  14.992
  842    HA   LEU  58           HA       LEU  58  14.171  -8.606  17.473
  843   1HB   LEU  58          1HB       LEU  58  12.213  -9.185  15.282
  844   2HB   LEU  58          2HB       LEU  58  12.412 -10.390  16.555
  845    HG   LEU  58           HG       LEU  58  12.289  -7.923  17.894
  846   1HD1  LEU  58          1HD1      LEU  58  10.187  -8.142  15.716
  847   2HD1  LEU  58          2HD1      LEU  58  10.117  -7.017  17.073
  848   3HD1  LEU  58          3HD1      LEU  58  11.400  -6.870  15.872
  849   1HD2  LEU  58          1HD2      LEU  58  11.231 -10.400  18.157
  850   2HD2  LEU  58          2HD2      LEU  58  10.640  -9.008  19.064
  851   3HD2  LEU  58          3HD2      LEU  58   9.801  -9.527  17.602
  852    H    PHE  59           H        PHE  59  15.159  -9.444  14.247
  853    HA   PHE  59           HA       PHE  59  15.744 -12.167  14.337
  854   1HB   PHE  59          1HB       PHE  59  16.111 -10.724  12.405
  855   2HB   PHE  59          2HB       PHE  59  17.367  -9.835  13.268
  856    HD1  PHE  59           HD1      PHE  59  16.504 -13.415  12.445
  857    HD2  PHE  59           HD2      PHE  59  19.580 -10.406  12.799
  858    HE1  PHE  59           HE1      PHE  59  18.206 -15.064  11.673
  859    HE2  PHE  59           HE2      PHE  59  21.282 -12.056  12.027
  860    HZ   PHE  59           HZ       PHE  59  20.596 -14.385  11.464
  861    H    ILE  60           H        ILE  60  17.687  -9.507  15.727
  862    HA   ILE  60           HA       ILE  60  19.782 -11.269  16.715
  863    HB   ILE  60           HB       ILE  60  18.959  -8.420  17.364
  864   1HG1  ILE  60          1HG1      ILE  60  21.308  -9.275  15.685
  865   2HG1  ILE  60          2HG1      ILE  60  19.701  -9.176  14.966
  866   1HG2  ILE  60          1HG2      ILE  60  20.796 -10.120  18.693
  867   2HG2  ILE  60          2HG2      ILE  60  21.759  -8.999  17.729
  868   3HG2  ILE  60          3HG2      ILE  60  20.599  -8.380  18.905
  869   1HD1  ILE  60          1HD1      ILE  60  20.570  -6.860  16.620
  870   2HD1  ILE  60          2HD1      ILE  60  21.365  -7.063  15.060
  871   3HD1  ILE  60          3HD1      ILE  60  19.611  -6.888  15.141
  872    H    ALA  61           H        ALA  61  16.815  -9.874  18.058
  873    HA   ALA  61           HA       ALA  61  17.363 -10.694  20.799
  874   1HB   ALA  61          1HB       ALA  61  15.384  -9.244  19.244
  875   2HB   ALA  61          3HB       ALA  61  15.755  -9.113  20.964
  876   3HB   ALA  61          2HB       ALA  61  14.601 -10.322  20.400
  877    H    ALA  62           H        ALA  62  16.105 -12.269  17.971
  878    HA   ALA  62           HA       ALA  62  14.899 -14.452  19.614
  879   1HB   ALA  62          1HB       ALA  62  13.878 -13.131  17.544
  880   2HB   ALA  62          2HB       ALA  62  13.572 -14.856  17.745
  881   3HB   ALA  62          3HB       ALA  62  14.814 -14.307  16.620
  882    H    SER  63           H        SER  63  16.970 -14.117  16.697
  883    HA   SER  63           HA       SER  63  17.949 -16.837  16.842
  884   1HB   SER  63          1HB       SER  63  17.790 -15.352  14.815
  885   2HB   SER  63          2HB       SER  63  19.116 -14.395  15.469
  886    HG   SER  63           HG       SER  63  19.107 -16.924  14.332

  No H/Q in entry =         886
  Start of MODEL   14
    1    H    LEU   8           H        LEU   8 -24.164   9.446 -29.963
    2    HA   LEU   8           HA       LEU   8 -22.441  10.520 -31.182
    3   1HB   LEU   8          1HB       LEU   8 -24.757  12.449 -31.435
    4   2HB   LEU   8          2HB       LEU   8 -23.201  12.758 -32.206
    5    HG   LEU   8           HG       LEU   8 -23.544  10.238 -33.037
    6   1HD1  LEU   8          1HD1      LEU   8 -26.269  11.270 -32.299
    7   2HD1  LEU   8          2HD1      LEU   8 -26.089  10.214 -33.701
    8   3HD1  LEU   8          3HD1      LEU   8 -25.603   9.649 -32.103
    9   1HD2  LEU   8          1HD2      LEU   8 -24.169  12.895 -34.099
   10   2HD2  LEU   8          2HD2      LEU   8 -23.351  11.541 -34.881
   11   3HD2  LEU   8          3HD2      LEU   8 -25.113  11.621 -34.873
   12    H    GLU   9           H        GLU   9 -22.231  10.659 -28.426
   13    HA   GLU   9           HA       GLU   9 -21.343  13.489 -27.949
   14   1HB   GLU   9          1HB       GLU   9 -23.289  11.981 -26.646
   15   2HB   GLU   9          2HB       GLU   9 -21.883  11.836 -25.591
   16   1HG   GLU   9          1HG       GLU   9 -21.721  14.172 -25.285
   17   2HG   GLU   9          2HG       GLU   9 -22.737  14.513 -26.686
   18    HA   PRO  10           HA       PRO  10 -17.844  10.363 -27.524
   19   1HB   PRO  10          1HB       PRO  10 -16.233  11.374 -29.489
   20   2HB   PRO  10          2HB       PRO  10 -17.451  10.117 -29.790
   21   1HG   PRO  10          2HG       PRO  10 -17.569  13.039 -30.330
   22   2HG   PRO  10          1HG       PRO  10 -18.194  11.688 -31.287
   23   1HD   PRO  10          1HD       PRO  10 -19.753  13.264 -29.696
   24   2HD   PRO  10          2HD       PRO  10 -20.141  11.577 -30.098
   25    H    ASP  11           H        ASP  11 -17.671  13.838 -28.322
   26    HA   ASP  11           HA       ASP  11 -16.528  15.604 -27.241
   27   1HB   ASP  11          1HB       ASP  11 -17.264  13.672 -25.266
   28   2HB   ASP  11          2HB       ASP  11 -15.640  14.239 -24.875
   29    H    ASN  12           H        ASN  12 -14.656  12.888 -25.866
   30    HA   ASN  12           HA       ASN  12 -12.334  13.787 -27.530
   31   1HB   ASN  12          1HB       ASN  12 -12.605  13.008 -24.618
   32   2HB   ASN  12          2HB       ASN  12 -11.040  13.007 -25.433
   33   2HD2  ASN  12          2HD2      ASN  12 -12.916  14.940 -23.510
   34   1HD2  ASN  12          1HD2      ASN  12 -12.392  16.467 -24.036
   35    H    VAL  13           H        VAL  13 -14.126  11.119 -26.065
   36    HA   VAL  13           HA       VAL  13 -13.343   9.219 -28.047
   37    HB   VAL  13           HB       VAL  13 -11.541   9.745 -25.808
   38   1HG1  VAL  13          1HG1      VAL  13 -12.298   6.839 -26.309
   39   2HG1  VAL  13          2HG1      VAL  13 -10.939   7.387 -25.329
   40   3HG1  VAL  13          3HG1      VAL  13 -12.590   7.729 -24.815
   41   1HG2  VAL  13          1HG2      VAL  13 -11.388   9.230 -28.518
   42   2HG2  VAL  13          2HG2      VAL  13 -10.013   9.290 -27.415
   43   3HG2  VAL  13          3HG2      VAL  13 -10.762   7.742 -27.810
   44    HA   PRO  14           HA       PRO  14 -15.851   7.111 -24.662
   45   1HB   PRO  14          1HB       PRO  14 -15.892   8.116 -22.121
   46   2HB   PRO  14          2HB       PRO  14 -14.602   7.057 -22.720
   47   1HG   PRO  14          1HG       PRO  14 -14.521   9.907 -22.110
   48   2HG   PRO  14          2HG       PRO  14 -13.193   8.761 -22.313
   49   1HD   PRO  14          2HD       PRO  14 -14.203  10.694 -24.197
   50   2HD   PRO  14          1HD       PRO  14 -12.802   9.619 -24.354
   51    H    MET  15           H        MET  15 -16.337  10.085 -22.789
   52    HA   MET  15           HA       MET  15 -18.707  10.867 -24.351
   53   1HB   MET  15          1HB       MET  15 -19.008   8.893 -22.512
   54   2HB   MET  15          2HB       MET  15 -19.254  10.306 -21.483
   55   1HG   MET  15          1HG       MET  15 -21.241  10.822 -22.459
   56   2HG   MET  15          2HG       MET  15 -20.651  10.439 -24.076
   57   1HE   MET  15          1HE       MET  15 -23.522   9.878 -22.874
   58   2HE   MET  15          2HE       MET  15 -23.800   8.288 -22.165
   59   3HE   MET  15          3HE       MET  15 -22.892   9.514 -21.270
   60    H    ASP  16           H        ASP  16 -19.775  12.198 -21.846
   61    HA   ASP  16           HA       ASP  16 -17.616  14.074 -21.105
   62   1HB   ASP  16          1HB       ASP  16 -18.706  14.722 -23.347
   63   2HB   ASP  16          2HB       ASP  16 -20.160  15.068 -22.411
   64    H    MET  17           H        MET  17 -18.372  12.778 -19.130
   65    HA   MET  17           HA       MET  17 -20.779  14.066 -17.887
   66   1HB   MET  17          1HB       MET  17 -20.820  11.931 -16.535
   67   2HB   MET  17          2HB       MET  17 -21.069  11.688 -18.264
   68   1HG   MET  17          1HG       MET  17 -18.770  11.004 -18.571
   69   2HG   MET  17          2HG       MET  17 -18.369  11.442 -16.909
   70   1HE   MET  17          1HE       MET  17 -18.974  10.616 -15.041
   71   2HE   MET  17          2HE       MET  17 -19.816   9.124 -14.630
   72   3HE   MET  17          3HE       MET  17 -18.131   9.075 -15.162
   73    H    SER  18           H        SER  18 -17.360  13.480 -17.627
   74    HA   SER  18           HA       SER  18 -17.353  14.452 -14.798
   75   1HB   SER  18          1HB       SER  18 -15.042  13.312 -16.371
   76   2HB   SER  18          2HB       SER  18 -15.263  13.341 -14.623
   77    HG   SER  18           HG       SER  18 -15.866  11.394 -16.208
   78    HA   PRO  19           HA       PRO  19 -15.550  18.271 -16.004
   79   1HB   PRO  19          1HB       PRO  19 -13.759  18.751 -13.998
   80   2HB   PRO  19          2HB       PRO  19 -15.516  18.865 -13.771
   81   1HG   PRO  19          2HG       PRO  19 -13.650  16.673 -13.026
   82   2HG   PRO  19          1HG       PRO  19 -15.057  17.302 -12.155
   83   1HD   PRO  19          1HD       PRO  19 -15.069  14.993 -13.616
   84   2HD   PRO  19          2HD       PRO  19 -16.515  15.980 -13.311
   85    H    LYS  20           H        LYS  20 -13.756  15.467 -16.133
   86    HA   LYS  20           HA       LYS  20 -11.812  14.887 -17.336
   87   1HB   LYS  20          1HB       LYS  20 -12.929  16.704 -18.818
   88   2HB   LYS  20          2HB       LYS  20 -11.681  17.779 -18.189
   89   1HG   LYS  20          1HG       LYS  20 -11.083  15.111 -19.491
   90   2HG   LYS  20          2HG       LYS  20 -11.072  16.644 -20.362
   91   1HD   LYS  20          1HD       LYS  20  -9.524  17.245 -18.180
   92   2HD   LYS  20          2HD       LYS  20  -9.106  15.553 -18.454
   93   1HE   LYS  20          2HE       LYS  20  -7.580  16.775 -19.825
   94   2HE   LYS  20          1HE       LYS  20  -8.845  16.244 -20.953
   95   1HZ   LYS  20          1HZ       LYS  20  -8.805  18.848 -19.521
   96   2HZ   LYS  20          2HZ       LYS  20  -8.415  18.628 -21.160
   97   3HZ   LYS  20          3HZ       LYS  20  -9.996  18.333 -20.613
   98    H    ALA  21           H        ALA  21 -11.171  18.291 -16.375
   99    HA   ALA  21           HA       ALA  21  -8.461  18.011 -15.728
  100   1HB   ALA  21          1HB       ALA  21  -8.984  19.969 -14.172
  101   2HB   ALA  21          2HB       ALA  21  -9.535  20.157 -15.837
  102   3HB   ALA  21          3HB       ALA  21 -10.683  19.715 -14.571
  103    H    LEU  22           H        LEU  22 -11.087  18.039 -13.292
  104    HA   LEU  22           HA       LEU  22  -9.475  17.025 -11.156
  105   1HB   LEU  22          1HB       LEU  22 -11.436  18.106 -10.510
  106   2HB   LEU  22          2HB       LEU  22 -12.381  17.386 -11.805
  107    HG   LEU  22           HG       LEU  22 -12.431  15.245 -10.637
  108   1HD1  LEU  22          1HD1      LEU  22 -10.583  16.671  -8.717
  109   2HD1  LEU  22          2HD1      LEU  22 -11.470  15.214  -8.263
  110   3HD1  LEU  22          3HD1      LEU  22 -10.301  15.159  -9.582
  111   1HD2  LEU  22          1HD2      LEU  22 -13.269  17.744  -9.227
  112   2HD2  LEU  22          2HD2      LEU  22 -14.259  16.440  -9.881
  113   3HD2  LEU  22          3HD2      LEU  22 -13.412  16.220  -8.350
  114    H    GLN  23           H        GLN  23 -11.962  15.316 -13.101
  115    HA   GLN  23           HA       GLN  23 -11.623  12.711 -12.170
  116   1HB   GLN  23          1HB       GLN  23 -13.282  13.534 -13.832
  117   2HB   GLN  23          2HB       GLN  23 -11.998  13.633 -15.037
  118   1HG   GLN  23          1HG       GLN  23 -11.681  11.070 -14.117
  119   2HG   GLN  23          2HG       GLN  23 -13.431  11.269 -14.011
  120   2HE2  GLN  23          2HE2      GLN  23 -13.792   9.837 -15.864
  121   1HE2  GLN  23          1HE2      GLN  23 -13.425  10.337 -17.444
  122    H    GLN  24           H        GLN  24  -9.673  14.369 -14.668
  123    HA   GLN  24           HA       GLN  24  -7.998  12.138 -15.327
  124   1HB   GLN  24          1HB       GLN  24  -8.312  14.292 -16.592
  125   2HB   GLN  24          2HB       GLN  24  -7.362  15.105 -15.348
  126   1HG   GLN  24          1HG       GLN  24  -6.143  12.663 -16.511
  127   2HG   GLN  24          2HG       GLN  24  -6.268  14.051 -17.594
  128   2HE2  GLN  24          2HE2      GLN  24  -4.624  12.788 -14.767
  129   1HE2  GLN  24          1HE2      GLN  24  -3.591  14.115 -14.534
  130    H    LYS  25           H        LYS  25  -7.775  14.653 -12.829
  131    HA   LYS  25           HA       LYS  25  -5.118  13.969 -11.921
  132   1HB   LYS  25          1HB       LYS  25  -7.403  15.673 -11.173
  133   2HB   LYS  25          2HB       LYS  25  -6.451  15.120  -9.794
  134   1HG   LYS  25          2HG       LYS  25  -5.038  16.817 -10.287
  135   2HG   LYS  25          1HG       LYS  25  -4.513  15.821 -11.646
  136   1HD   LYS  25          1HD       LYS  25  -5.947  16.932 -13.164
  137   2HD   LYS  25          2HD       LYS  25  -6.913  17.637 -11.867
  138   1HE   LYS  25          1HE       LYS  25  -4.315  18.551 -11.352
  139   2HE   LYS  25          2HE       LYS  25  -4.497  18.683 -13.113
  140   1HZ   LYS  25          1HZ       LYS  25  -6.786  19.609 -12.600
  141   2HZ   LYS  25          2HZ       LYS  25  -6.249  19.803 -11.004
  142   3HZ   LYS  25          3HZ       LYS  25  -5.468  20.627 -12.268
  143    H    ILE  26           H        ILE  26  -8.383  13.169 -10.675
  144    HA   ILE  26           HA       ILE  26  -7.662  11.585  -8.464
  145    HB   ILE  26           HB       ILE  26  -9.909  11.289 -10.485
  146   1HG1  ILE  26          1HG1      ILE  26 -10.133  12.512  -7.750
  147   2HG1  ILE  26          2HG1      ILE  26  -9.475  13.473  -9.076
  148   1HG2  ILE  26          1HG2      ILE  26  -9.340   9.964  -7.856
  149   2HG2  ILE  26          2HG2      ILE  26 -11.012  10.330  -8.281
  150   3HG2  ILE  26          3HG2      ILE  26 -10.047   9.280  -9.320
  151   1HD1  ILE  26          1HD1      ILE  26 -11.984  11.956  -9.614
  152   2HD1  ILE  26          2HD1      ILE  26 -12.109  13.370  -8.568
  153   3HD1  ILE  26          3HD1      ILE  26 -11.478  13.539 -10.207
  154    H    HIS  27           H        HIS  27  -8.379  10.383 -11.774
  155    HA   HIS  27           HA       HIS  27  -7.635   7.688 -11.377
  156   1HB   HIS  27          1HB       HIS  27  -8.559   9.265 -13.413
  157   2HB   HIS  27          2HB       HIS  27  -6.917   8.933 -13.965
  158    HD1  HIS  27           HD1      HIS  27  -9.950   7.018 -12.668
  159    HD2  HIS  27           HD2      HIS  27  -6.632   6.435 -15.123
  160    HE1  HIS  27           HE1      HIS  27 -10.199   4.705 -13.670
  161    H    GLU  28           H        GLU  28  -5.642  10.536 -11.654
  162    HA   GLU  28           HA       GLU  28  -3.184   9.113 -12.358
  163   1HB   GLU  28          1HB       GLU  28  -4.182  11.761 -12.246
  164   2HB   GLU  28          2HB       GLU  28  -2.815  11.705 -11.133
  165   1HG   GLU  28          2HG       GLU  28  -2.013  12.272 -13.370
  166   2HG   GLU  28          1HG       GLU  28  -1.437  10.663 -12.931
  167    H    LEU  29           H        LEU  29  -4.677  10.382  -9.387
  168    HA   LEU  29           HA       LEU  29  -2.389   9.739  -7.696
  169   1HB   LEU  29          1HB       LEU  29  -5.278  10.531  -7.271
  170   2HB   LEU  29          2HB       LEU  29  -4.187  10.220  -5.919
  171    HG   LEU  29           HG       LEU  29  -3.374  12.108  -8.118
  172   1HD1  LEU  29          1HD1      LEU  29  -5.679  12.478  -6.576
  173   2HD1  LEU  29          2HD1      LEU  29  -4.441  13.424  -5.749
  174   3HD1  LEU  29          3HD1      LEU  29  -4.794  13.730  -7.450
  175   1HD2  LEU  29          1HD2      LEU  29  -2.439  11.276  -5.459
  176   2HD2  LEU  29          2HD2      LEU  29  -1.544  12.036  -6.776
  177   3HD2  LEU  29          3HD2      LEU  29  -2.488  13.028  -5.664
  178    H    GLU  30           H        GLU  30  -5.551   8.233  -8.381
  179    HA   GLU  30           HA       GLU  30  -5.355   6.083  -6.505
  180   1HB   GLU  30          1HB       GLU  30  -7.276   7.027  -8.055
  181   2HB   GLU  30          2HB       GLU  30  -6.672   5.823  -9.194
  182   1HG   GLU  30          1HG       GLU  30  -6.888   4.658  -6.561
  183   2HG   GLU  30          2HG       GLU  30  -8.427   5.385  -7.026
  184    H    GLY  31           H        GLY  31  -4.415   6.300  -9.949
  185   1HA   GLY  31          2HA       GLY  31  -2.994   4.935 -11.228
  186   2HA   GLY  31          1HA       GLY  31  -3.470   3.605 -10.170
  187    H    LEU  32           H        LEU  32  -1.948   6.603  -9.083
  188    HA   LEU  32           HA       LEU  32   0.760   5.649  -8.993
  189   1HB   LEU  32          1HB       LEU  32  -0.530   8.011  -8.653
  190   2HB   LEU  32          2HB       LEU  32  -0.219   7.594  -6.968
  191    HG   LEU  32           HG       LEU  32   2.195   7.161  -7.639
  192   1HD1  LEU  32          1HD1      LEU  32   1.009   7.910 -10.224
  193   2HD1  LEU  32          2HD1      LEU  32   2.482   8.802  -9.840
  194   3HD1  LEU  32          3HD1      LEU  32   2.506   7.039  -9.883
  195   1HD2  LEU  32          1HD2      LEU  32   1.012   9.936  -7.966
  196   2HD2  LEU  32          2HD2      LEU  32   1.595   9.207  -6.471
  197   3HD2  LEU  32          3HD2      LEU  32   2.733   9.616  -7.754
  198    H    MET  33           H        MET  33  -1.952   5.450  -6.726
  199    HA   MET  33           HA       MET  33  -0.562   4.591  -4.397
  200   1HB   MET  33          1HB       MET  33  -3.243   4.810  -5.426
  201   2HB   MET  33          2HB       MET  33  -3.067   3.261  -4.601
  202   1HG   MET  33          1HG       MET  33  -2.442   4.290  -2.558
  203   2HG   MET  33          2HG       MET  33  -2.092   5.828  -3.348
  204   1HE   MET  33          1HE       MET  33  -4.595   3.148  -3.448
  205   2HE   MET  33          2HE       MET  33  -5.265   3.576  -1.878
  206   3HE   MET  33          3HE       MET  33  -6.190   3.891  -3.354
  207    H    MET  34           H        MET  34  -2.349   2.512  -6.711
  208    HA   MET  34           HA       MET  34  -1.562  -0.005  -5.824
  209   1HB   MET  34          1HB       MET  34  -2.297   1.256  -8.420
  210   2HB   MET  34          2HB       MET  34  -1.604  -0.363  -8.501
  211   1HG   MET  34          1HG       MET  34  -3.285  -1.111  -6.800
  212   2HG   MET  34          2HG       MET  34  -4.028   0.487  -6.891
  213   1HE   MET  34          1HE       MET  34  -5.754  -1.792  -7.207
  214   2HE   MET  34          2HE       MET  34  -6.058  -2.495  -8.793
  215   3HE   MET  34          3HE       MET  34  -4.605  -2.942  -7.903
  216    H    GLN  35           H        GLN  35   0.269   2.147  -8.014
  217    HA   GLN  35           HA       GLN  35   2.392   0.473  -8.748
  218   1HB   GLN  35          1HB       GLN  35   2.062   2.732  -9.591
  219   2HB   GLN  35          2HB       GLN  35   2.328   3.410  -7.985
  220   1HG   GLN  35          1HG       GLN  35   4.508   3.589  -8.530
  221   2HG   GLN  35          2HG       GLN  35   4.591   1.829  -8.465
  222   2HE2  GLN  35          2HE2      GLN  35   4.881   4.536 -10.557
  223   1HE2  GLN  35          1HE2      GLN  35   4.910   3.686 -12.026
  224    H    HIS  36           H        HIS  36   2.881   2.903  -6.192
  225    HA   HIS  36           HA       HIS  36   5.101   1.725  -4.956
  226   1HB   HIS  36          1HB       HIS  36   2.803   3.384  -3.895
  227   2HB   HIS  36          2HB       HIS  36   4.261   3.061  -2.959
  228    HD1  HIS  36           HD1      HIS  36   2.977   5.044  -5.845
  229    HD2  HIS  36           HD2      HIS  36   6.643   4.298  -4.008
  230    HE1  HIS  36           HE1      HIS  36   4.601   6.754  -6.767
  231    H    ALA  37           H        ALA  37   1.668   1.344  -3.951
  232    HA   ALA  37           HA       ALA  37   1.951  -0.418  -1.805
  233   1HB   ALA  37          1HB       ALA  37  -0.235  -1.325  -3.356
  234   2HB   ALA  37          2HB       ALA  37  -0.053   0.386  -3.735
  235   3HB   ALA  37          3HB       ALA  37  -0.278  -0.127  -2.062
  236    H    GLN  38           H        GLN  38   2.240  -1.119  -5.262
  237    HA   GLN  38           HA       GLN  38   2.325  -4.016  -4.950
  238   1HB   GLN  38          1HB       GLN  38   2.441  -1.968  -7.028
  239   2HB   GLN  38          2HB       GLN  38   3.588  -3.271  -7.339
  240   1HG   GLN  38          1HG       GLN  38   1.907  -4.905  -7.425
  241   2HG   GLN  38          2HG       GLN  38   0.760  -3.907  -6.530
  242   2HE2  GLN  38          2HE2      GLN  38  -0.441  -2.283  -7.712
  243   1HE2  GLN  38          1HE2      GLN  38  -0.419  -2.204  -9.407
  244    H    ASN  39           H        ASN  39   4.701  -1.390  -5.138
  245    HA   ASN  39           HA       ASN  39   6.957  -3.313  -4.923
  246   1HB   ASN  39          2HB       ASN  39   6.825  -0.288  -5.171
  247   2HB   ASN  39          1HB       ASN  39   8.289  -1.264  -5.310
  248   2HD2  ASN  39          2HD2      ASN  39   8.845  -1.539  -7.469
  249   1HD2  ASN  39          1HD2      ASN  39   7.743  -1.751  -8.744
  250    H    LEU  40           H        LEU  40   4.924  -2.657  -2.719
  251    HA   LEU  40           HA       LEU  40   4.961  -2.322  -0.389
  252   1HB   LEU  40          1HB       LEU  40   7.900  -2.894  -0.896
  253   2HB   LEU  40          2HB       LEU  40   7.080  -3.039   0.658
  254    HG   LEU  40           HG       LEU  40   5.442  -4.599  -0.721
  255   1HD1  LEU  40          1HD1      LEU  40   7.930  -4.388  -2.385
  256   2HD1  LEU  40          2HD1      LEU  40   7.088  -5.935  -2.297
  257   3HD1  LEU  40          3HD1      LEU  40   6.248  -4.508  -2.904
  258   1HD2  LEU  40          1HD2      LEU  40   7.763  -4.994   0.915
  259   2HD2  LEU  40          2HD2      LEU  40   6.360  -6.048   0.739
  260   3HD2  LEU  40          3HD2      LEU  40   7.746  -6.239  -0.334
  261    H    GLU  41           H        GLU  41   5.432   0.020  -2.202
  262    HA   GLU  41           HA       GLU  41   7.125   1.726  -0.412
  263   1HB   GLU  41          1HB       GLU  41   6.204   1.968  -3.293
  264   2HB   GLU  41          2HB       GLU  41   7.108   3.226  -2.449
  265   1HG   GLU  41          1HG       GLU  41   8.238   0.482  -2.310
  266   2HG   GLU  41          2HG       GLU  41   8.310   1.278  -3.883
  267    H    PHE  42           H        PHE  42   4.099   0.863  -0.321
  268    HA   PHE  42           HA       PHE  42   2.456   3.119  -0.781
  269   1HB   PHE  42          1HB       PHE  42   0.951   1.914   0.847
  270   2HB   PHE  42          2HB       PHE  42   1.551   0.919  -0.474
  271    HD1  PHE  42           HD1      PHE  42   2.560   1.950   3.017
  272    HD2  PHE  42           HD2      PHE  42   2.435  -1.187   0.049
  273    HE1  PHE  42           HE1      PHE  42   3.526   0.351   4.660
  274    HE2  PHE  42           HE2      PHE  42   3.384  -2.780   1.696
  275    HZ   PHE  42           HZ       PHE  42   3.930  -2.013   4.003
  276    H    GLU  43           H        GLU  43   4.931   2.832   1.576
  277    HA   GLU  43           HA       GLU  43   3.893   4.040   3.886
  278   1HB   GLU  43          1HB       GLU  43   6.199   3.235   3.620
  279   2HB   GLU  43          2HB       GLU  43   6.523   4.498   2.433
  280   1HG   GLU  43          1HG       GLU  43   5.755   6.118   4.354
  281   2HG   GLU  43          2HG       GLU  43   6.135   4.750   5.402
  282    H    GLU  44           H        GLU  44   5.609   5.876   1.352
  283    HA   GLU  44           HA       GLU  44   4.216   8.358   2.093
  284   1HB   GLU  44          1HB       GLU  44   5.671   9.269   0.283
  285   2HB   GLU  44          2HB       GLU  44   6.590   8.311   1.445
  286   1HG   GLU  44          1HG       GLU  44   6.974   6.607  -0.052
  287   2HG   GLU  44          2HG       GLU  44   5.451   6.868  -0.902
  288    H    ALA  45           H        ALA  45   3.794   5.761  -0.171
  289    HA   ALA  45           HA       ALA  45   2.265   7.221  -2.171
  290   1HB   ALA  45          1HB       ALA  45   1.684   4.461  -2.245
  291   2HB   ALA  45          3HB       ALA  45   3.338   4.575  -1.643
  292   3HB   ALA  45          2HB       ALA  45   2.908   5.307  -3.191
  293    H    ALA  46           H        ALA  46   1.343   4.888   0.392
  294    HA   ALA  46           HA       ALA  46  -1.417   4.832  -0.003
  295   1HB   ALA  46          1HB       ALA  46   0.293   4.778   2.491
  296   2HB   ALA  46          3HB       ALA  46  -0.368   3.405   1.599
  297   3HB   ALA  46          2HB       ALA  46  -1.440   4.454   2.527
  298    H    GLN  47           H        GLN  47   0.530   7.451   1.292
  299    HA   GLN  47           HA       GLN  47  -1.344   8.972   2.728
  300   1HB   GLN  47          1HB       GLN  47   1.027   9.494   0.989
  301   2HB   GLN  47          2HB       GLN  47   0.035  10.884   1.432
  302   1HG   GLN  47          1HG       GLN  47   0.207   9.740   3.849
  303   2HG   GLN  47          2HG       GLN  47   1.708   9.120   3.161
  304   2HE2  GLN  47          2HE2      GLN  47   3.458  10.486   3.501
  305   1HE2  GLN  47          1HE2      GLN  47   3.366  12.173   3.660
  306    H    ILE  48           H        ILE  48  -1.174   8.322  -0.704
  307    HA   ILE  48           HA       ILE  48  -2.825  10.464  -1.666
  308    HB   ILE  48           HB       ILE  48  -2.306   7.633  -2.636
  309   1HG1  ILE  48          1HG1      ILE  48  -1.144  10.152  -3.794
  310   2HG1  ILE  48          2HG1      ILE  48  -0.430   9.458  -2.337
  311   1HG2  ILE  48          1HG2      ILE  48  -4.361   8.605  -3.634
  312   2HG2  ILE  48          2HG2      ILE  48  -3.432  10.017  -4.138
  313   3HG2  ILE  48          3HG2      ILE  48  -3.074   8.433  -4.827
  314   1HD1  ILE  48          1HD1      ILE  48  -0.624   7.217  -3.812
  315   2HD1  ILE  48          2HD1      ILE  48  -0.473   8.393  -5.117
  316   3HD1  ILE  48          3HD1      ILE  48   0.785   8.275  -3.887
  317    H    ARG  49           H        ARG  49  -3.533   7.364  -0.142
  318    HA   ARG  49           HA       ARG  49  -6.201   6.901  -0.843
  319   1HB   ARG  49          2HB       ARG  49  -6.339   5.752   1.294
  320   2HB   ARG  49          1HB       ARG  49  -4.701   5.560   0.676
  321   1HG   ARG  49          2HG       ARG  49  -4.162   6.231   2.803
  322   2HG   ARG  49          1HG       ARG  49  -4.356   7.831   2.085
  323   1HD   ARG  49          1HD       ARG  49  -6.907   7.454   2.756
  324   2HD   ARG  49          2HD       ARG  49  -6.181   6.364   3.954
  325    HE   ARG  49           HE       ARG  49  -4.723   8.850   3.844
  326   1HH1  ARG  49          1HH1      ARG  49  -7.908   9.100   4.098
  327   2HH1  ARG  49          2HH1      ARG  49  -8.001   9.434   5.795
  328   1HH2  ARG  49          1HH2      ARG  49  -4.708   8.543   6.420
  329   2HH2  ARG  49          2HH2      ARG  49  -6.189   9.119   7.109
  330    H    ASP  50           H        ASP  50  -4.907   9.458   1.188
  331    HA   ASP  50           HA       ASP  50  -7.488  10.268   2.294
  332   1HB   ASP  50          1HB       ASP  50  -4.807  10.662   2.848
  333   2HB   ASP  50          2HB       ASP  50  -5.292  12.226   2.190
  334    H    GLN  51           H        GLN  51  -5.301  11.488  -0.262
  335    HA   GLN  51           HA       GLN  51  -6.990  13.692  -1.049
  336   1HB   GLN  51          1HB       GLN  51  -4.896  12.102  -2.571
  337   2HB   GLN  51          2HB       GLN  51  -5.472  13.714  -2.999
  338   1HG   GLN  51          1HG       GLN  51  -4.445  14.715  -1.145
  339   2HG   GLN  51          2HG       GLN  51  -4.346  13.193  -0.258
  340   2HE2  GLN  51          2HE2      GLN  51  -3.407  13.584  -3.676
  341   1HE2  GLN  51          1HE2      GLN  51  -1.754  13.286  -3.428
  342    H    LEU  52           H        LEU  52  -6.703  10.313  -2.112
  343    HA   LEU  52           HA       LEU  52  -8.397  10.456  -4.409
  344   1HB   LEU  52          1HB       LEU  52  -7.047   8.515  -2.757
  345   2HB   LEU  52          2HB       LEU  52  -8.673   7.938  -3.121
  346    HG   LEU  52           HG       LEU  52  -7.053   7.231  -4.855
  347   1HD1  LEU  52          1HD1      LEU  52  -9.344   9.052  -5.423
  348   2HD1  LEU  52          2HD1      LEU  52  -8.295   8.636  -6.778
  349   3HD1  LEU  52          3HD1      LEU  52  -9.111   7.362  -5.873
  350   1HD2  LEU  52          1HD2      LEU  52  -5.827   9.600  -4.449
  351   2HD2  LEU  52          2HD2      LEU  52  -5.653   8.691  -5.951
  352   3HD2  LEU  52          3HD2      LEU  52  -6.801  10.025  -5.858
  353    H    HIS  53           H        HIS  53  -9.126   9.792  -0.977
  354    HA   HIS  53           HA       HIS  53 -11.945   9.303  -1.374
  355   1HB   HIS  53          1HB       HIS  53 -10.269  10.152   1.009
  356   2HB   HIS  53          2HB       HIS  53 -11.952   9.638   1.123
  357    HD1  HIS  53           HD1      HIS  53  -9.911   7.932   2.573
  358    HD2  HIS  53           HD2      HIS  53 -10.968   7.258  -1.403
  359    HE1  HIS  53           HE1      HIS  53  -9.337   5.515   2.080
  360    H    GLN  54           H        GLN  54 -10.127  12.173  -0.230
  361    HA   GLN  54           HA       GLN  54 -12.378  13.896   0.107
  362   1HB   GLN  54          1HB       GLN  54  -9.584  13.950   0.362
  363   2HB   GLN  54          2HB       GLN  54  -9.949  15.219  -0.809
  364   1HG   GLN  54          1HG       GLN  54 -11.567  16.218   0.731
  365   2HG   GLN  54          2HG       GLN  54 -11.293  14.920   1.893
  366   2HE2  GLN  54          2HE2      GLN  54 -10.410  18.071   1.263
  367   1HE2  GLN  54          1HE2      GLN  54  -8.899  18.095   2.036
  368    H    LEU  55           H        LEU  55 -10.216  13.401  -2.702
  369    HA   LEU  55           HA       LEU  55 -11.416  15.347  -4.418
  370   1HB   LEU  55          1HB       LEU  55  -9.726  12.886  -4.675
  371   2HB   LEU  55          2HB       LEU  55 -10.419  13.575  -6.144
  372    HG   LEU  55           HG       LEU  55  -9.250  15.595  -4.364
  373   1HD1  LEU  55          1HD1      LEU  55  -7.772  13.152  -4.871
  374   2HD1  LEU  55          2HD1      LEU  55  -6.976  14.529  -5.635
  375   3HD1  LEU  55          3HD1      LEU  55  -7.307  14.551  -3.903
  376   1HD2  LEU  55          1HD2      LEU  55  -9.056  14.813  -7.280
  377   2HD2  LEU  55          2HD2      LEU  55  -9.867  16.216  -6.584
  378   3HD2  LEU  55          3HD2      LEU  55  -8.105  16.132  -6.599
  379    H    ARG  56           H        ARG  56 -12.333  12.050  -3.586
  380    HA   ARG  56           HA       ARG  56 -14.064  11.408  -5.730
  381   1HB   ARG  56          1HB       ARG  56 -13.322   9.921  -3.874
  382   2HB   ARG  56          2HB       ARG  56 -14.359  10.821  -2.765
  383   1HG   ARG  56          1HG       ARG  56 -16.212  10.267  -4.585
  384   2HG   ARG  56          2HG       ARG  56 -15.119   8.935  -4.961
  385   1HD   ARG  56          1HD       ARG  56 -15.319   7.999  -2.794
  386   2HD   ARG  56          2HD       ARG  56 -15.970   9.505  -2.114
  387    HE   ARG  56           HE       ARG  56 -17.461   7.631  -3.880
  388   1HH1  ARG  56          1HH1      ARG  56 -18.284  10.374  -4.556
  389   2HH1  ARG  56          2HH1      ARG  56 -19.539  10.702  -3.409
  390   1HH2  ARG  56          1HH2      ARG  56 -18.646   8.106  -1.290
  391   2HH2  ARG  56          2HH2      ARG  56 -19.744   9.419  -1.559
  392    H    GLU  57           H        GLU  57 -15.059  12.763  -2.557
  393    HA   GLU  57           HA       GLU  57 -17.730  13.393  -3.305
  394   1HB   GLU  57          1HB       GLU  57 -17.571  14.900  -1.307
  395   2HB   GLU  57          2HB       GLU  57 -16.916  13.291  -1.002
  396   1HG   GLU  57          1HG       GLU  57 -14.692  14.039  -1.083
  397   2HG   GLU  57          2HG       GLU  57 -15.118  15.503  -1.971
  398    H    LEU  58           H        LEU  58 -14.718  15.018  -3.992
  399    HA   LEU  58           HA       LEU  58 -15.817  17.641  -4.555
  400   1HB   LEU  58          1HB       LEU  58 -13.287  16.180  -4.665
  401   2HB   LEU  58          2HB       LEU  58 -13.463  17.301  -6.016
  402    HG   LEU  58           HG       LEU  58 -13.964  18.085  -3.134
  403   1HD1  LEU  58          1HD1      LEU  58 -11.538  17.338  -3.902
  404   2HD1  LEU  58          2HD1      LEU  58 -11.529  18.929  -4.663
  405   3HD1  LEU  58          3HD1      LEU  58 -11.761  18.787  -2.920
  406   1HD2  LEU  58          1HD2      LEU  58 -13.823  19.507  -5.785
  407   2HD2  LEU  58          2HD2      LEU  58 -15.039  19.650  -4.515
  408   3HD2  LEU  58          3HD2      LEU  58 -13.446  20.375  -4.297
  409    H    PHE  59           H        PHE  59 -15.695  14.640  -6.310
  410    HA   PHE  59           HA       PHE  59 -15.668  15.438  -9.001
  411   1HB   PHE  59          1HB       PHE  59 -15.739  13.118  -7.997
  412   2HB   PHE  59          2HB       PHE  59 -17.468  13.351  -7.738
  413    HD1  PHE  59           HD1      PHE  59 -19.028  13.570  -9.653
  414    HD2  PHE  59           HD2      PHE  59 -14.822  12.786 -10.229
  415    HE1  PHE  59           HE1      PHE  59 -19.475  12.907 -12.015
  416    HE2  PHE  59           HE2      PHE  59 -15.268  12.122 -12.589
  417    HZ   PHE  59           HZ       PHE  59 -17.595  12.183 -13.482
  418    H    ILE  60           H        ILE  60 -18.476  15.288  -6.788
  419    HA   ILE  60           HA       ILE  60 -20.359  16.287  -8.759
  420    HB   ILE  60           HB       ILE  60 -20.426  16.158  -5.726
  421   1HG1  ILE  60          1HG1      ILE  60 -21.713  14.228  -7.657
  422   2HG1  ILE  60          2HG1      ILE  60 -20.038  14.012  -7.146
  423   1HG2  ILE  60          1HG2      ILE  60 -22.135  17.670  -6.692
  424   2HG2  ILE  60          2HG2      ILE  60 -22.675  16.369  -7.752
  425   3HG2  ILE  60          3HG2      ILE  60 -22.869  16.221  -6.005
  426   1HD1  ILE  60          1HD1      ILE  60 -21.311  14.498  -4.753
  427   2HD1  ILE  60          2HD1      ILE  60 -22.524  13.572  -5.638
  428   3HD1  ILE  60          3HD1      ILE  60 -20.916  12.897  -5.378
  429    H    ALA  61           H        ALA  61 -18.412  17.761  -6.180
  430    HA   ALA  61           HA       ALA  61 -19.624  20.389  -6.381
  431   1HB   ALA  61          1HB       ALA  61 -17.056  19.264  -5.237
  432   2HB   ALA  61          3HB       ALA  61 -18.517  19.724  -4.363
  433   3HB   ALA  61          2HB       ALA  61 -17.491  20.965  -5.082
  434    H    ALA  62           H        ALA  62 -17.199  18.687  -8.204
  435    HA   ALA  62           HA       ALA  62 -16.010  21.147  -9.329
  436   1HB   ALA  62          1HB       ALA  62 -15.098  18.640  -8.798
  437   2HB   ALA  62          3HB       ALA  62 -14.353  19.704  -9.990
  438   3HB   ALA  62          2HB       ALA  62 -15.500  18.469 -10.507
  439    H    SER  63           H        SER  63 -17.527  18.243 -10.799
  440    HA   SER  63           HA       SER  63 -18.023  19.412 -13.345
  441   1HB   SER  63          1HB       SER  63 -18.175  16.961 -12.302
  442   2HB   SER  63          2HB       SER  63 -19.878  17.383 -12.157
  443    HG   SER  63           HG       SER  63 -19.772  16.624 -14.169
  444    H    LEU   8           H        LEU   8  23.447 -31.973   0.073
  445    HA   LEU   8           HA       LEU   8  21.704 -33.409   0.788
  446   1HB   LEU   8          1HB       LEU   8  24.035 -34.255   2.521
  447   2HB   LEU   8          2HB       LEU   8  22.461 -35.046   2.627
  448    HG   LEU   8           HG       LEU   8  22.754 -35.131  -0.031
  449   1HD1  LEU   8          1HD1      LEU   8  25.509 -34.781   1.118
  450   2HD1  LEU   8          2HD1      LEU   8  25.280 -35.818  -0.290
  451   3HD1  LEU   8          3HD1      LEU   8  24.830 -34.114  -0.367
  452   1HD2  LEU   8          1HD2      LEU   8  23.380 -36.920   2.201
  453   2HD2  LEU   8          2HD2      LEU   8  22.526 -37.264   0.696
  454   3HD2  LEU   8          3HD2      LEU   8  24.288 -37.320   0.742
  455    H    GLU   9           H        GLU   9  21.571 -30.804   1.712
  456    HA   GLU   9           HA       GLU   9  20.729 -31.134   4.576
  457   1HB   GLU   9          1HB       GLU   9  22.691 -29.499   3.466
  458   2HB   GLU   9          2HB       GLU   9  21.312 -28.415   3.653
  459   1HG   GLU   9          1HG       GLU   9  21.185 -28.784   5.982
  460   2HG   GLU   9          2HG       GLU   9  22.167 -30.247   5.891
  461    HA   PRO  10           HA       PRO  10  17.206 -29.755   1.766
  462   1HB   PRO  10          1HB       PRO  10  15.556 -31.890   2.204
  463   2HB   PRO  10          2HB       PRO  10  16.750 -31.847   0.892
  464   1HG   PRO  10          2HG       PRO  10  16.886 -33.201   3.537
  465   2HG   PRO  10          1HG       PRO  10  17.470 -33.746   1.957
  466   1HD   PRO  10          1HD       PRO  10  19.091 -32.707   3.891
  467   2HD   PRO  10          2HD       PRO  10  19.447 -32.620   2.152
  468    H    ASP  11           H        ASP  11  17.051 -31.507   4.873
  469    HA   ASP  11           HA       ASP  11  15.959 -30.950   6.894
  470   1HB   ASP  11          1HB       ASP  11  16.725 -28.523   5.592
  471   2HB   ASP  11          2HB       ASP  11  15.120 -28.273   6.276
  472    H    ASN  12           H        ASN  12  14.094 -28.815   4.717
  473    HA   ASN  12           HA       ASN  12  11.738 -30.612   5.148
  474   1HB   ASN  12          1HB       ASN  12  12.078 -27.608   5.225
  475   2HB   ASN  12          2HB       ASN  12  10.492 -28.352   5.022
  476   2HD2  ASN  12          2HD2      ASN  12  12.441 -27.104   7.387
  477   1HD2  ASN  12          1HD2      ASN  12  11.920 -28.031   8.710
  478    H    VAL  13           H        VAL  13  13.538 -28.489   2.976
  479    HA   VAL  13           HA       VAL  13  12.680 -29.827   0.604
  480    HB   VAL  13           HB       VAL  13  10.945 -27.791   1.779
  481   1HG1  VAL  13          1HG1      VAL  13  11.656 -27.460  -1.161
  482   2HG1  VAL  13          2HG1      VAL  13  10.329 -26.646  -0.332
  483   3HG1  VAL  13          3HG1      VAL  13  11.998 -26.289   0.110
  484   1HG2  VAL  13          1HG2      VAL  13  10.713 -30.237   0.518
  485   2HG2  VAL  13          2HG2      VAL  13   9.370 -29.167   0.915
  486   3HG2  VAL  13          3HG2      VAL  13  10.089 -29.120  -0.695
  487    HA   PRO  14           HA       PRO  14  15.256 -26.041  -0.498
  488   1HB   PRO  14          1HB       PRO  14  15.376 -23.893   1.188
  489   2HB   PRO  14          2HB       PRO  14  14.059 -24.135   0.026
  490   1HG   PRO  14          2HG       PRO  14  14.026 -24.361   2.934
  491   2HG   PRO  14          1HG       PRO  14  12.680 -24.201   1.802
  492   1HD   PRO  14          2HD       PRO  14  13.661 -26.580   3.099
  493   2HD   PRO  14          1HD       PRO  14  12.244 -26.390   2.050
  494    H    MET  15           H        MET  15  15.825 -25.104   2.877
  495    HA   MET  15           HA       MET  15  18.161 -26.878   3.138
  496   1HB   MET  15          1HB       MET  15  18.489 -24.559   1.764
  497   2HB   MET  15          2HB       MET  15  18.778 -23.983   3.407
  498   1HG   MET  15          1HG       MET  15  20.743 -25.109   3.586
  499   2HG   MET  15          2HG       MET  15  20.106 -26.537   2.769
  500   1HE   MET  15          1HE       MET  15  23.002 -25.289   2.521
  501   2HE   MET  15          2HE       MET  15  23.281 -24.163   1.194
  502   3HE   MET  15          3HE       MET  15  22.411 -23.634   2.641
  503    H    ASP  16           H        ASP  16  19.311 -24.882   5.107
  504    HA   ASP  16           HA       ASP  16  17.195 -24.659   7.156
  505   1HB   ASP  16          1HB       ASP  16  18.231 -27.016   7.118
  506   2HB   ASP  16          2HB       ASP  16  19.714 -26.251   7.690
  507    H    MET  17           H        MET  17  17.988 -22.413   6.463
  508    HA   MET  17           HA       MET  17  20.443 -21.645   8.007
  509   1HB   MET  17          1HB       MET  17  20.496 -19.740   6.345
  510   2HB   MET  17          2HB       MET  17  20.696 -21.333   5.614
  511   1HG   MET  17          1HG       MET  17  18.382 -21.380   4.915
  512   2HG   MET  17          2HG       MET  17  18.031 -19.904   5.816
  513   1HE   MET  17          1HE       MET  17  18.677 -17.891   5.545
  514   2HE   MET  17          2HE       MET  17  19.513 -17.092   4.217
  515   3HE   MET  17          3HE       MET  17  17.813 -17.549   4.049
  516    H    SER  18           H        SER  18  17.026 -21.151   7.583
  517    HA   SER  18           HA       SER  18  17.106 -18.718   9.320
  518   1HB   SER  18          1HB       SER  18  14.739 -19.849   7.823
  519   2HB   SER  18          2HB       SER  18  15.006 -18.187   8.345
  520    HG   SER  18           HG       SER  18  15.545 -19.162   6.016
  521    HA   PRO  19           HA       PRO  19  15.315 -20.922  12.671
  522   1HB   PRO  19          1HB       PRO  19  13.584 -19.097  13.737
  523   2HB   PRO  19          2HB       PRO  19  15.348 -18.951  13.876
  524   1HG   PRO  19          2HG       PRO  19  13.478 -17.569  12.024
  525   2HG   PRO  19          1HG       PRO  19  14.914 -16.946  12.848
  526   1HD   PRO  19          1HD       PRO  19  14.861 -17.688  10.218
  527   2HD   PRO  19          2HD       PRO  19  16.326 -17.709  11.224
  528    H    LYS  20           H        LYS  20  13.488 -20.203   9.980
  529    HA   LYS  20           HA       LYS  20  11.506 -21.147   9.118
  530   1HB   LYS  20          1HB       LYS  20  12.602 -23.112  10.414
  531   2HB   LYS  20          2HB       LYS  20  11.383 -22.787  11.648
  532   1HG   LYS  20          1HG       LYS  20  10.721 -23.259   8.730
  533   2HG   LYS  20          2HG       LYS  20  10.702 -24.532   9.952
  534   1HD   LYS  20          1HD       LYS  20   9.221 -22.577  11.179
  535   2HD   LYS  20          2HD       LYS  20   8.776 -22.347   9.488
  536   1HE   LYS  20          2HE       LYS  20   7.228 -23.975  10.296
  537   2HE   LYS  20          1HE       LYS  20   8.455 -24.932   9.441
  538   1HZ   LYS  20          1HZ       LYS  20   8.484 -24.302  12.347
  539   2HZ   LYS  20          2HZ       LYS  20   8.047 -25.802  11.676
  540   3HZ   LYS  20          3HZ       LYS  20   9.639 -25.228  11.519
  541    H    ALA  21           H        ALA  21  10.928 -21.185  12.665
  542    HA   ALA  21           HA       ALA  21   8.233 -20.422  12.631
  543   1HB   ALA  21          1HB       ALA  21  10.505 -19.852  14.553
  544   2HB   ALA  21          3HB       ALA  21   8.820 -19.502  14.941
  545   3HB   ALA  21          2HB       ALA  21   9.329 -21.164  14.637
  546    H    LEU  22           H        LEU  22  10.924 -18.157  13.304
  547    HA   LEU  22           HA       LEU  22   9.359 -15.783  12.972
  548   1HB   LEU  22          1HB       LEU  22  11.349 -15.517  14.155
  549   2HB   LEU  22          2HB       LEU  22  12.250 -16.574  13.078
  550    HG   LEU  22           HG       LEU  22  12.308 -14.845  11.358
  551   1HD1  LEU  22          1HD1      LEU  22  10.528 -13.371  13.305
  552   2HD1  LEU  22          2HD1      LEU  22  11.411 -12.540  12.024
  553   3HD1  LEU  22          3HD1      LEU  22  10.206 -13.762  11.616
  554   1HD2  LEU  22          1HD2      LEU  22  13.211 -14.225  14.139
  555   2HD2  LEU  22          2HD2      LEU  22  14.169 -14.504  12.684
  556   3HD2  LEU  22          3HD2      LEU  22  13.360 -12.954  12.925
  557    H    GLN  23           H        GLN  23  11.773 -17.215  10.733
  558    HA   GLN  23           HA       GLN  23  11.430 -15.571   8.508
  559   1HB   GLN  23          1HB       GLN  23  13.054 -17.437   8.792
  560   2HB   GLN  23          2HB       GLN  23  11.738 -18.591   8.567
  561   1HG   GLN  23          1HG       GLN  23  11.417 -16.971   6.380
  562   2HG   GLN  23          2HG       GLN  23  13.171 -16.966   6.567
  563   2HE2  GLN  23          2HE2      GLN  23  13.465 -18.341   4.661
  564   1HE2  GLN  23          1HE2      GLN  23  13.061 -19.989   4.696
  565    H    GLN  24           H        GLN  24   9.432 -18.393   9.419
  566    HA   GLN  24           HA       GLN  24   7.714 -18.352   7.125
  567   1HB   GLN  24          1HB       GLN  24   8.019 -20.184   8.825
  568   2HB   GLN  24          2HB       GLN  24   7.111 -19.202   9.975
  569   1HG   GLN  24          1HG       GLN  24   5.835 -19.593   7.326
  570   2HG   GLN  24          2HG       GLN  24   5.946 -21.029   8.345
  571   2HE2  GLN  24          2HE2      GLN  24   4.365 -17.923   7.971
  572   1HE2  GLN  24          1HE2      GLN  24   3.353 -18.057   9.328
  573    H    LYS  25           H        LYS  25   7.587 -16.672  10.253
  574    HA   LYS  25           HA       LYS  25   4.949 -15.544   9.905
  575   1HB   LYS  25          1HB       LYS  25   7.272 -15.366  11.708
  576   2HB   LYS  25          2HB       LYS  25   6.351 -13.865  11.590
  577   1HG   LYS  25          1HG       LYS  25   4.944 -14.791  13.102
  578   2HG   LYS  25          2HG       LYS  25   4.372 -15.796  11.770
  579   1HD   LYS  25          1HD       LYS  25   5.777 -17.602  12.375
  580   2HD   LYS  25          2HD       LYS  25   6.785 -16.581  13.403
  581   1HE   LYS  25          1HE       LYS  25   4.213 -16.289  14.474
  582   2HE   LYS  25          2HE       LYS  25   4.349 -18.018  14.095
  583   1HZ   LYS  25          1HZ       LYS  25   6.662 -17.843  15.085
  584   2HZ   LYS  25          2HZ       LYS  25   6.170 -16.356  15.735
  585   3HZ   LYS  25          3HZ       LYS  25   5.365 -17.785  16.180
  586    H    ILE  26           H        ILE  26   8.238 -14.197   9.432
  587    HA   ILE  26           HA       ILE  26   7.558 -11.610   8.558
  588    HB   ILE  26           HB       ILE  26   9.747 -13.513   7.657
  589   1HG1  ILE  26          1HG1      ILE  26  10.058 -11.246   9.606
  590   2HG1  ILE  26          2HG1      ILE  26   9.376 -12.776  10.159
  591   1HG2  ILE  26          1HG2      ILE  26   9.234 -10.601   7.146
  592   2HG2  ILE  26          2HG2      ILE  26  10.898 -11.151   7.345
  593   3HG2  ILE  26          3HG2      ILE  26   9.894 -11.826   6.062
  594   1HD1  ILE  26          1HD1      ILE  26  11.852 -12.917   8.507
  595   2HD1  ILE  26          2HD1      ILE  26  12.020 -12.320  10.157
  596   3HD1  ILE  26          3HD1      ILE  26  11.347 -13.924   9.863
  597    H    HIS  27           H        HIS  27   8.171 -14.454   6.450
  598    HA   HIS  27           HA       HIS  27   7.409 -13.288   3.993
  599   1HB   HIS  27          1HB       HIS  27   8.295 -15.710   4.908
  600   2HB   HIS  27          2HB       HIS  27   6.635 -16.107   4.463
  601    HD1  HIS  27           HD1      HIS  27   9.681 -14.386   2.941
  602    HD2  HIS  27           HD2      HIS  27   6.290 -16.497   1.743
  603    HE1  HIS  27           HE1      HIS  27   9.876 -14.693   0.435
  604    H    GLU  28           H        GLU  28   5.441 -14.319   6.681
  605    HA   GLU  28           HA       GLU  28   2.948 -14.532   5.162
  606   1HB   GLU  28          1HB       GLU  28   3.979 -15.205   7.714
  607   2HB   GLU  28          2HB       GLU  28   2.642 -14.091   8.002
  608   1HG   GLU  28          2HG       GLU  28   1.787 -16.379   7.923
  609   2HG   GLU  28          1HG       GLU  28   1.205 -15.485   6.517
  610    H    LEU  29           H        LEU  29   4.536 -12.084   7.196
  611    HA   LEU  29           HA       LEU  29   2.287 -10.227   7.106
  612   1HB   LEU  29          1HB       LEU  29   5.195 -10.111   7.932
  613   2HB   LEU  29          2HB       LEU  29   4.139  -8.703   8.040
  614    HG   LEU  29           HG       LEU  29   3.288 -11.330   9.237
  615   1HD1  LEU  29          1HD1      LEU  29   5.638 -10.011   9.989
  616   2HD1  LEU  29          2HD1      LEU  29   4.434  -9.460  11.154
  617   3HD1  LEU  29          3HD1      LEU  29   4.745 -11.185  10.956
  618   1HD2  LEU  29          1HD2      LEU  29   2.415  -8.524   9.216
  619   2HD2  LEU  29          2HD2      LEU  29   1.494  -9.983   9.584
  620   3HD2  LEU  29          3HD2      LEU  29   2.479  -9.221  10.834
  621    H    GLU  30           H        GLU  30   5.414 -10.525   5.409
  622    HA   GLU  30           HA       GLU  30   5.244  -8.108   3.885
  623   1HB   GLU  30          1HB       GLU  30   7.132  -9.906   4.314
  624   2HB   GLU  30          2HB       GLU  30   6.484 -10.642   2.848
  625   1HG   GLU  30          1HG       GLU  30   6.758  -7.791   2.476
  626   2HG   GLU  30          2HG       GLU  30   8.292  -8.479   3.012
  627    H    GLY  31           H        GLY  31   4.213 -11.450   3.130
  628   1HA   GLY  31          2HA       GLY  31   2.743 -12.252   1.483
  629   2HA   GLY  31          1HA       GLY  31   3.232 -10.870   0.501
  630    H    LEU  32           H        LEU  32   1.774 -10.651   3.713
  631    HA   LEU  32           HA       LEU  32  -0.941 -10.232   2.874
  632   1HB   LEU  32          1HB       LEU  32   0.384 -10.609   5.212
  633   2HB   LEU  32          2HB       LEU  32   0.114  -8.869   5.297
  634    HG   LEU  32           HG       LEU  32  -2.322  -9.334   4.737
  635   1HD1  LEU  32          1HD1      LEU  32  -1.199 -12.051   4.695
  636   2HD1  LEU  32          2HD1      LEU  32  -2.649 -11.904   5.688
  637   3HD1  LEU  32          3HD1      LEU  32  -2.694 -11.443   3.986
  638   1HD2  LEU  32          1HD2      LEU  32  -1.117 -10.466   7.281
  639   2HD2  LEU  32          2HD2      LEU  32  -1.667  -8.810   7.019
  640   3HD2  LEU  32          3HD2      LEU  32  -2.835 -10.132   7.066
  641    H    MET  33           H        MET  33   1.828  -8.063   3.280
  642    HA   MET  33           HA       MET  33   0.491  -5.556   3.146
  643   1HB   MET  33          1HB       MET  33   3.146  -6.664   3.014
  644   2HB   MET  33          2HB       MET  33   2.975  -5.429   1.769
  645   1HG   MET  33          1HG       MET  33   2.413  -3.752   3.349
  646   2HG   MET  33          2HG       MET  33   2.063  -4.940   4.604
  647   1HE   MET  33          1HE       MET  33   4.525  -4.317   1.960
  648   2HE   MET  33          2HE       MET  33   5.249  -2.955   2.808
  649   3HE   MET  33          3HE       MET  33   6.130  -4.482   2.664
  650    H    MET  34           H        MET  34   2.191  -7.221   0.462
  651    HA   MET  34           HA       MET  34   1.402  -5.636  -1.683
  652   1HB   MET  34          1HB       MET  34   2.080  -8.498  -1.227
  653   2HB   MET  34          2HB       MET  34   1.367  -8.099  -2.790
  654   1HG   MET  34          1HG       MET  34   3.084  -6.294  -3.054
  655   2HG   MET  34          2HG       MET  34   3.842  -6.852  -1.562
  656   1HE   MET  34          1HE       MET  34   5.533  -6.545  -3.869
  657   2HE   MET  34          2HE       MET  34   5.785  -7.872  -5.000
  658   3HE   MET  34          3HE       MET  34   4.351  -6.858  -5.147
  659    H    GLN  35           H        GLN  35  -0.464  -8.306  -0.211
  660    HA   GLN  35           HA       GLN  35  -2.624  -8.483  -1.986
  661   1HB   GLN  35          1HB       GLN  35  -2.292  -9.944  -0.067
  662   2HB   GLN  35          2HB       GLN  35  -2.506  -8.592   1.045
  663   1HG   GLN  35          2HG       GLN  35  -4.698  -9.115   1.104
  664   2HG   GLN  35          1HG       GLN  35  -4.799  -8.549  -0.563
  665   2HE2  GLN  35          2HE2      GLN  35  -5.116 -11.319   1.440
  666   1HE2  GLN  35          1HE2      GLN  35  -5.194 -12.484   0.207
  667    H    HIS  36           H        HIS  36  -3.017  -6.716   1.081
  668    HA   HIS  36           HA       HIS  36  -5.215  -5.145   0.347
  669   1HB   HIS  36          1HB       HIS  36  -2.870  -4.655   2.196
  670   2HB   HIS  36          2HB       HIS  36  -4.306  -3.632   2.181
  671    HD1  HIS  36           HD1      HIS  36  -3.078  -6.993   3.235
  672    HD2  HIS  36           HD2      HIS  36  -6.702  -4.937   3.111
  673    HE1  HIS  36           HE1      HIS  36  -4.707  -8.328   4.639
  674    H    ALA  37           H        ALA  37  -1.760  -4.153   0.204
  675    HA   ALA  37           HA       ALA  37  -2.005  -1.587  -0.867
  676   1HB   ALA  37          1HB       ALA  37  -0.044  -3.710  -0.684
  677   2HB   ALA  37          3HB       ALA  37   0.218  -1.967  -0.703
  678   3HB   ALA  37          2HB       ALA  37   0.127  -2.861  -2.220
  679    H    GLN  38           H        GLN  38  -2.396  -4.692  -2.521
  680    HA   GLN  38           HA       GLN  38  -2.507  -3.564  -5.206
  681   1HB   GLN  38          1HB       GLN  38  -2.655  -6.138  -3.832
  682   2HB   GLN  38          2HB       GLN  38  -3.824  -6.036  -5.149
  683   1HG   GLN  38          1HG       GLN  38  -2.165  -5.692  -6.771
  684   2HG   GLN  38          2HG       GLN  38  -0.983  -5.145  -5.581
  685   2HE2  GLN  38          2HE2      GLN  38   0.203  -6.768  -4.384
  686   1HE2  GLN  38          1HE2      GLN  38   0.137  -8.415  -4.790
  687    H    ASN  39           H        ASN  39  -4.858  -4.441  -2.699
  688    HA   ASN  39           HA       ASN  39  -7.128  -3.635  -4.438
  689   1HB   ASN  39          2HB       ASN  39  -6.968  -4.740  -1.612
  690   2HB   ASN  39          1HB       ASN  39  -8.445  -4.561  -2.559
  691   2HD2  ASN  39          2HD2      ASN  39  -9.063  -6.537  -3.429
  692   1HD2  ASN  39          1HD2      ASN  39  -8.000  -7.722  -4.016
  693    H    LEU  40           H        LEU  40  -5.028  -1.756  -3.218
  694    HA   LEU  40           HA       LEU  40  -4.999   0.381  -2.231
  695   1HB   LEU  40          2HB       LEU  40  -7.958   0.125  -2.870
  696   2HB   LEU  40          1HB       LEU  40  -7.097   1.637  -2.582
  697    HG   LEU  40           HG       LEU  40  -5.513   0.722  -4.500
  698   1HD1  LEU  40          1HD1      LEU  40  -8.044  -0.875  -4.725
  699   2HD1  LEU  40          2HD1      LEU  40  -7.218  -0.368  -6.199
  700   3HD1  LEU  40          3HD1      LEU  40  -6.379  -1.375  -5.020
  701   1HD2  LEU  40          1HD2      LEU  40  -7.792   2.457  -4.370
  702   2HD2  LEU  40          2HD2      LEU  40  -6.406   2.556  -5.455
  703   3HD2  LEU  40          3HD2      LEU  40  -7.824   1.616  -5.919
  704    H    GLU  41           H        GLU  41  -5.489  -2.012  -0.495
  705    HA   GLU  41           HA       GLU  41  -7.115  -0.746   1.683
  706   1HB   GLU  41          1HB       GLU  41  -6.270  -3.597   1.076
  707   2HB   GLU  41          2HB       GLU  41  -7.138  -3.128   2.537
  708   1HG   GLU  41          1HG       GLU  41  -8.293  -2.184  -0.032
  709   2HG   GLU  41          2HG       GLU  41  -8.400  -3.916   0.283
  710    H    PHE  42           H        PHE  42  -4.099  -0.484   0.823
  711    HA   PHE  42           HA       PHE  42  -2.440  -1.604   2.822
  712   1HB   PHE  42          1HB       PHE  42  -0.910   0.272   2.105
  713   2HB   PHE  42          2HB       PHE  42  -1.553  -0.698   0.785
  714    HD1  PHE  42           HD1      PHE  42  -2.468   2.371   2.790
  715    HD2  PHE  42           HD2      PHE  42  -2.453   0.421  -1.065
  716    HE1  PHE  42           HE1      PHE  42  -3.422   4.417   1.747
  717    HE2  PHE  42           HE2      PHE  42  -3.390   2.470  -2.103
  718    HZ   PHE  42           HZ       PHE  42  -3.874   4.471  -0.697
  719    H    GLU  43           H        GLU  43  -4.854   0.794   3.265
  720    HA   GLU  43           HA       GLU  43  -3.743   2.637   5.063
  721   1HB   GLU  43          1HB       GLU  43  -6.064   2.664   4.258
  722   2HB   GLU  43          2HB       GLU  43  -6.406   1.174   5.138
  723   1HG   GLU  43          1HG       GLU  43  -5.567   2.535   7.222
  724   2HG   GLU  43          2HG       GLU  43  -5.934   3.938   6.216
  725    H    GLU  44           H        GLU  44  -5.503  -0.276   6.132
  726    HA   GLU  44           HA       GLU  44  -4.064  -0.306   8.695
  727   1HB   GLU  44          1HB       GLU  44  -5.557  -2.267   9.079
  728   2HB   GLU  44          2HB       GLU  44  -6.455  -0.860   8.509
  729   1HG   GLU  44          1HG       GLU  44  -6.897  -1.799   6.455
  730   2HG   GLU  44          2HG       GLU  44  -5.395  -2.722   6.437
  731    H    ALA  45           H        ALA  45  -3.732  -1.741   5.553
  732    HA   ALA  45           HA       ALA  45  -2.241  -4.108   6.353
  733   1HB   ALA  45          1HB       ALA  45  -3.330  -2.825   3.988
  734   2HB   ALA  45          3HB       ALA  45  -1.694  -3.404   3.676
  735   3HB   ALA  45          2HB       ALA  45  -2.932  -4.525   4.241
  736    H    ALA  46           H        ALA  46  -1.272  -1.011   4.824
  737    HA   ALA  46           HA       ALA  46   1.477  -1.433   4.608
  738   1HB   ALA  46          1HB       ALA  46   1.559   1.100   4.973
  739   2HB   ALA  46          3HB       ALA  46   0.455   0.533   3.720
  740   3HB   ALA  46          2HB       ALA  46  -0.170   1.008   5.302
  741    H    GLN  47           H        GLN  47  -0.409  -0.894   7.524
  742    HA   GLN  47           HA       GLN  47   1.517   0.002   9.360
  743   1HB   GLN  47          1HB       GLN  47  -0.895  -1.758   9.404
  744   2HB   GLN  47          2HB       GLN  47   0.124  -1.753  10.846
  745   1HG   GLN  47          1HG       GLN  47   0.006   0.893  10.444
  746   2HG   GLN  47          2HG       GLN  47  -1.521   0.446   9.681
  747   2HE2  GLN  47          2HE2      GLN  47  -3.245   0.419  11.120
  748   1HE2  GLN  47          1HE2      GLN  47  -3.128   0.089  12.781
  749    H    ILE  48           H        ILE  48   1.247  -3.097   7.762
  750    HA   ILE  48           HA       ILE  48   2.895  -4.667   9.510
  751    HB   ILE  48           HB       ILE  48   2.318  -4.777   6.531
  752   1HG1  ILE  48          1HG1      ILE  48   1.154  -6.578   8.636
  753   2HG1  ILE  48          2HG1      ILE  48   0.472  -4.969   8.401
  754   1HG2  ILE  48          1HG2      ILE  48   4.357  -6.056   7.140
  755   2HG2  ILE  48          2HG2      ILE  48   3.430  -6.921   8.367
  756   3HG2  ILE  48          3HG2      ILE  48   3.035  -7.122   6.659
  757   1HD1  ILE  48          1HD1      ILE  48   0.600  -5.746   5.829
  758   2HD1  ILE  48          2HD1      ILE  48   0.427  -7.329   6.586
  759   3HD1  ILE  48          3HD1      ILE  48  -0.798  -6.089   6.848
  760    H    ARG  49           H        ARG  49   3.609  -2.337   6.963
  761    HA   ARG  49           HA       ARG  49   6.252  -2.937   6.269
  762   1HB   ARG  49          2HB       ARG  49   6.435  -0.564   5.776
  763   2HB   ARG  49          1HB       ARG  49   4.779  -1.063   5.446
  764   1HG   ARG  49          2HG       ARG  49   4.305   0.795   6.707
  765   2HG   ARG  49          1HG       ARG  49   4.498  -0.355   8.029
  766   1HD   ARG  49          1HD       ARG  49   7.062   0.337   7.814
  767   2HD   ARG  49          2HD       ARG  49   6.356   1.813   7.124
  768    HE   ARG  49           HE       ARG  49   4.924   1.031   9.501
  769   1HH1  ARG  49          1HH1      ARG  49   8.117   1.131   9.754
  770   2HH1  ARG  49          2HH1      ARG  49   8.259   2.659  10.556
  771   1HH2  ARG  49          1HH2      ARG  49   4.975   3.587   9.941
  772   2HH2  ARG  49          2HH2      ARG  49   6.481   4.050  10.663
  773    H    ASP  50           H        ASP  50   5.042  -1.691   9.323
  774    HA   ASP  50           HA       ASP  50   7.661  -0.921  10.367
  775   1HB   ASP  50          1HB       ASP  50   4.999  -0.445  10.953
  776   2HB   ASP  50          2HB       ASP  50   5.486  -1.532  12.253
  777    H    GLN  51           H        GLN  51   5.419  -3.668  10.849
  778    HA   GLN  51           HA       GLN  51   7.111  -5.092  12.703
  779   1HB   GLN  51          2HB       GLN  51   4.958  -6.047  10.783
  780   2HB   GLN  51          1HB       GLN  51   5.540  -6.931  12.195
  781   1HG   GLN  51          1HG       GLN  51   4.577  -5.418  13.703
  782   2HG   GLN  51          2HG       GLN  51   4.483  -4.132  12.500
  783   2HE2  GLN  51          2HE2      GLN  51   3.455  -7.497  11.917
  784   1HE2  GLN  51          1HE2      GLN  51   1.807  -7.136  11.735
  785    H    LEU  52           H        LEU  52   6.756  -5.139   9.167
  786    HA   LEU  52           HA       LEU  52   8.390  -7.419   8.617
  787   1HB   LEU  52          1HB       LEU  52   7.062  -5.251   7.254
  788   2HB   LEU  52          2HB       LEU  52   8.671  -5.472   6.567
  789    HG   LEU  52           HG       LEU  52   6.996  -6.894   5.425
  790   1HD1  LEU  52          1HD1      LEU  52   9.293  -8.010   6.964
  791   2HD1  LEU  52          2HD1      LEU  52   8.203  -9.167   6.200
  792   3HD1  LEU  52          3HD1      LEU  52   9.029  -7.953   5.221
  793   1HD2  LEU  52          1HD2      LEU  52   5.811  -7.155   7.835
  794   2HD2  LEU  52          2HD2      LEU  52   5.584  -8.329   6.538
  795   3HD2  LEU  52          3HD2      LEU  52   6.750  -8.648   7.821
  796    H    HIS  53           H        HIS  53   9.204  -3.957   8.947
  797    HA   HIS  53           HA       HIS  53  12.006  -4.264   8.313
  798   1HB   HIS  53          1HB       HIS  53  10.405  -2.184   9.837
  799   2HB   HIS  53          2HB       HIS  53  12.085  -1.967   9.344
  800    HD1  HIS  53           HD1      HIS  53  10.064  -0.043   8.161
  801    HD2  HIS  53           HD2      HIS  53  11.006  -3.684   6.362
  802    HE1  HIS  53           HE1      HIS  53   9.448   0.187   5.715
  803    H    GLN  54           H        GLN  54  10.252  -3.944  11.423
  804    HA   GLN  54           HA       GLN  54  12.530  -4.164  13.128
  805   1HB   GLN  54          1HB       GLN  54   9.745  -3.871  13.304
  806   2HB   GLN  54          2HB       GLN  54  10.092  -5.364  14.180
  807   1HG   GLN  54          1HG       GLN  54  11.762  -4.210  15.547
  808   2HG   GLN  54          2HG       GLN  54  11.506  -2.720  14.639
  809   2HE2  GLN  54          2HE2      GLN  54  10.641  -4.204  17.495
  810   1HE2  GLN  54          1HE2      GLN  54   9.152  -3.435  17.768
  811    H    LEU  55           H        LEU  55  10.288  -6.665  11.893
  812    HA   LEU  55           HA       LEU  55  11.463  -8.892  13.248
  813   1HB   LEU  55          1HB       LEU  55   9.740  -8.398  10.847
  814   2HB   LEU  55          2HB       LEU  55  10.400 -10.017  11.076
  815    HG   LEU  55           HG       LEU  55   9.302  -8.861  13.539
  816   1HD1  LEU  55          1HD1      LEU  55   7.783  -8.618  11.083
  817   2HD1  LEU  55          2HD1      LEU  55   6.983  -9.724  12.199
  818   3HD1  LEU  55          3HD1      LEU  55   7.360  -8.077  12.707
  819   1HD2  LEU  55          1HD2      LEU  55   9.020 -11.429  11.963
  820   2HD2  LEU  55          2HD2      LEU  55   9.865 -11.180  13.492
  821   3HD2  LEU  55          3HD2      LEU  55   8.103 -11.130  13.440
  822    H    ARG  56           H        ARG  56  12.363  -7.174  10.308
  823    HA   ARG  56           HA       ARG  56  14.029  -9.085   9.048
  824   1HB   ARG  56          1HB       ARG  56  13.321  -6.865   8.167
  825   2HB   ARG  56          2HB       ARG  56  14.397  -6.083   9.325
  826   1HG   ARG  56          1HG       ARG  56  16.194  -7.712   8.242
  827   2HG   ARG  56          2HG       ARG  56  15.076  -7.667   6.878
  828   1HD   ARG  56          1HD       ARG  56  15.325  -5.328   6.596
  829   2HD   ARG  56          2HD       ARG  56  16.011  -5.121   8.220
  830    HE   ARG  56           HE       ARG  56  17.433  -6.311   5.893
  831   1HH1  ARG  56          1HH1      ARG  56  18.267  -7.761   8.315
  832   2HH1  ARG  56          2HH1      ARG  56  19.557  -6.784   8.934
  833   1HH2  ARG  56          1HH2      ARG  56  18.693  -3.993   7.066
  834   2HH2  ARG  56          2HH2      ARG  56  19.797  -4.650   8.226
  835    H    GLU  57           H        GLU  57  15.125  -6.454  11.233
  836    HA   GLU  57           HA       GLU  57  17.781  -7.411  11.574
  837   1HB   GLU  57          1HB       GLU  57  17.694  -5.923  13.590
  838   2HB   GLU  57          2HB       GLU  57  17.029  -5.157  12.147
  839   1HG   GLU  57          1HG       GLU  57  14.813  -5.397  12.884
  840   2HG   GLU  57          2HG       GLU  57  15.232  -6.676  14.025
  841    H    LEU  58           H        LEU  58  14.770  -8.464  12.991
  842    HA   LEU  58           HA       LEU  58  15.884  -9.778  15.324
  843   1HB   LEU  58          1HB       LEU  58  13.335  -9.409  13.940
  844   2HB   LEU  58          2HB       LEU  58  13.488 -11.026  14.626
  845    HG   LEU  58           HG       LEU  58  14.076  -8.501  16.190
  846   1HD1  LEU  58          1HD1      LEU  58  11.621  -8.968  15.301
  847   2HD1  LEU  58          2HD1      LEU  58  11.609 -10.152  16.608
  848   3HD1  LEU  58          3HD1      LEU  58  11.887  -8.447  16.964
  849   1HD2  LEU  58          1HD2      LEU  58  13.879 -11.444  16.799
  850   2HD2  LEU  58          2HD2      LEU  58  15.131 -10.296  17.275
  851   3HD2  LEU  58          3HD2      LEU  58  13.553 -10.258  18.063
  852    H    PHE  59           H        PHE  59  15.680 -10.600  11.951
  853    HA   PHE  59           HA       PHE  59  15.588 -13.406  11.948
  854   1HB   PHE  59          1HB       PHE  59  15.661 -11.785  10.010
  855   2HB   PHE  59          2HB       PHE  59  17.400 -11.641  10.275
  856    HD1  PHE  59           HD1      PHE  59  18.910 -13.574   9.911
  857    HD2  PHE  59           HD2      PHE  59  14.680 -13.806   9.072
  858    HE1  PHE  59           HE1      PHE  59  19.285 -15.657   8.593
  859    HE2  PHE  59           HE2      PHE  59  15.056 -15.889   7.756
  860    HZ   PHE  59           HZ       PHE  59  17.358 -16.815   7.517
  861    H    ILE  60           H        ILE  60  18.455 -11.307  12.383
  862    HA   ILE  60           HA       ILE  60  20.295 -13.523  12.743
  863    HB   ILE  60           HB       ILE  60  20.442 -10.582  13.483
  864   1HG1  ILE  60          1HG1      ILE  60  21.655 -11.909  11.061
  865   2HG1  ILE  60          2HG1      ILE  60  19.992 -11.321  11.030
  866   1HG2  ILE  60          1HG2      ILE  60  22.141 -11.977  14.627
  867   2HG2  ILE  60          2HG2      ILE  60  22.639 -12.633  13.067
  868   3HG2  ILE  60          3HG2      ILE  60  22.877 -10.922  13.420
  869   1HD1  ILE  60          1HD1      ILE  60  21.336  -9.195  12.155
  870   2HD1  ILE  60          2HD1      ILE  60  22.513  -9.807  10.993
  871   3HD1  ILE  60          3HD1      ILE  60  20.905  -9.328  10.449
  872    H    ALA  61           H        ALA  61  18.435 -11.427  14.928
  873    HA   ALA  61           HA       ALA  61  19.671 -12.399  17.367
  874   1HB   ALA  61          1HB       ALA  61  18.611 -10.249  17.326
  875   2HB   ALA  61          3HB       ALA  61  17.122 -10.923  16.662
  876   3HB   ALA  61          2HB       ALA  61  17.582 -11.270  18.330
  877    H    ALA  62           H        ALA  62  17.177 -13.605  15.262
  878    HA   ALA  62           HA       ALA  62  15.988 -15.357  17.320
  879   1HB   ALA  62          1HB       ALA  62  15.415 -15.710  14.428
  880   2HB   ALA  62          3HB       ALA  62  15.063 -14.112  15.086
  881   3HB   ALA  62          2HB       ALA  62  14.296 -15.541  15.781
  882    H    SER  63           H        SER  63  17.432 -15.972  14.091
  883    HA   SER  63           HA       SER  63  17.871 -18.755  14.476
  884   1HB   SER  63          1HB       SER  63  18.024 -17.061  12.422
  885   2HB   SER  63          2HB       SER  63  19.736 -17.081  12.836
  886    HG   SER  63           HG       SER  63  19.566 -18.789  11.538

  No H/Q in entry =         886
  Start of MODEL   15
    1    H    LEU   8           H        LEU   8 -34.911  10.681 -26.306
    2    HA   LEU   8           HA       LEU   8 -33.373  10.454 -24.513
    3   1HB   LEU   8          1HB       LEU   8 -33.589   8.163 -23.510
    4   2HB   LEU   8          2HB       LEU   8 -35.145   8.865 -23.960
    5    HG   LEU   8           HG       LEU   8 -33.866   7.359 -26.136
    6   1HD1  LEU   8          1HD1      LEU   8 -33.185   6.061 -24.066
    7   2HD1  LEU   8          2HD1      LEU   8 -34.902   5.823 -23.740
    8   3HD1  LEU   8          3HD1      LEU   8 -34.182   5.162 -25.209
    9   1HD2  LEU   8          1HD2      LEU   8 -36.432   8.191 -25.300
   10   2HD2  LEU   8          2HD2      LEU   8 -36.037   7.250 -26.738
   11   3HD2  LEU   8          3HD2      LEU   8 -36.454   6.429 -25.233
   12    H    GLU   9           H        GLU   9 -31.598  10.889 -26.228
   13    HA   GLU   9           HA       GLU   9 -29.800   8.492 -26.410
   14   1HB   GLU   9          1HB       GLU   9 -30.947   9.317 -28.540
   15   2HB   GLU   9          2HB       GLU   9 -29.986  10.787 -28.378
   16   1HG   GLU   9          1HG       GLU   9 -27.947   9.205 -28.214
   17   2HG   GLU   9          2HG       GLU   9 -29.028   7.966 -28.855
   18    HA   PRO  10           HA       PRO  10 -27.803  12.193 -24.310
   19   1HB   PRO  10          1HB       PRO  10 -27.296  11.004 -21.898
   20   2HB   PRO  10          2HB       PRO  10 -28.802  11.876 -22.248
   21   1HG   PRO  10          2HG       PRO  10 -28.272   8.949 -22.216
   22   2HG   PRO  10          1HG       PRO  10 -29.702   9.844 -21.681
   23   1HD   PRO  10          1HD       PRO  10 -29.553   8.501 -24.056
   24   2HD   PRO  10          2HD       PRO  10 -30.611   9.902 -23.777
   25    H    ASP  11           H        ASP  11 -26.952   8.768 -23.658
   26    HA   ASP  11           HA       ASP  11 -24.926   7.601 -23.965
   27   1HB   ASP  11          1HB       ASP  11 -25.235   9.526 -26.093
   28   2HB   ASP  11          2HB       ASP  11 -23.525   9.363 -25.694
   29    H    ASN  12           H        ASN  12 -23.585  10.856 -24.452
   30    HA   ASN  12           HA       ASN  12 -22.298  10.700 -21.756
   31   1HB   ASN  12          1HB       ASN  12 -20.157  11.337 -22.892
   32   2HB   ASN  12          2HB       ASN  12 -20.758   9.761 -23.410
   33   2HD2  ASN  12          2HD2      ASN  12 -20.500  13.181 -24.405
   34   1HD2  ASN  12          1HD2      ASN  12 -20.743  12.887 -26.060
   35    H    VAL  13           H        VAL  13 -24.502  12.366 -22.951
   36    HA   VAL  13           HA       VAL  13 -23.289  15.042 -23.224
   37    HB   VAL  13           HB       VAL  13 -25.949  13.729 -23.634
   38   1HG1  VAL  13          1HG1      VAL  13 -25.560  16.633 -22.946
   39   2HG1  VAL  13          2HG1      VAL  13 -26.800  16.165 -24.111
   40   3HG1  VAL  13          3HG1      VAL  13 -26.860  15.543 -22.461
   41   1HG2  VAL  13          1HG2      VAL  13 -23.991  14.270 -25.316
   42   2HG2  VAL  13          2HG2      VAL  13 -25.671  14.472 -25.813
   43   3HG2  VAL  13          3HG2      VAL  13 -24.722  15.875 -25.323
   44    HA   PRO  14           HA       PRO  14 -25.535  15.630 -19.107
   45   1HB   PRO  14          1HB       PRO  14 -26.807  13.525 -17.919
   46   2HB   PRO  14          2HB       PRO  14 -27.587  14.557 -19.133
   47   1HG   PRO  14          2HG       PRO  14 -26.603  11.804 -19.372
   48   2HG   PRO  14          1HG       PRO  14 -27.822  12.658 -20.325
   49   1HD   PRO  14          1HD       PRO  14 -25.121  12.134 -21.039
   50   2HD   PRO  14          2HD       PRO  14 -26.318  13.080 -21.933
   51    H    MET  15           H        MET  15 -24.403  12.233 -19.172
   52    HA   MET  15           HA       MET  15 -22.533  12.931 -16.949
   53   1HB   MET  15          1HB       MET  15 -24.704  11.166 -16.957
   54   2HB   MET  15          2HB       MET  15 -23.292  10.123 -17.126
   55   1HG   MET  15          1HG       MET  15 -22.876  10.366 -14.929
   56   2HG   MET  15          2HG       MET  15 -22.627  12.091 -15.190
   57   1HE   MET  15          1HE       MET  15 -23.616  10.324 -12.812
   58   2HE   MET  15          2HE       MET  15 -25.269  10.611 -12.275
   59   3HE   MET  15          3HE       MET  15 -24.937   9.402 -13.524
   60    H    ASP  16           H        ASP  16 -21.059  10.584 -16.924
   61    HA   ASP  16           HA       ASP  16 -19.246   9.543 -18.018
   62   1HB   ASP  16          1HB       ASP  16 -21.542   9.069 -19.416
   63   2HB   ASP  16          2HB       ASP  16 -20.556   9.832 -20.662
   64    H    MET  17           H        MET  17 -18.345  11.872 -17.543
   65    HA   MET  17           HA       MET  17 -16.785  12.710 -19.822
   66   1HB   MET  17          1HB       MET  17 -17.909  14.976 -20.025
   67   2HB   MET  17          2HB       MET  17 -18.893  13.624 -20.585
   68   1HG   MET  17          1HG       MET  17 -19.976  13.557 -18.313
   69   2HG   MET  17          2HG       MET  17 -19.101  15.037 -17.912
   70   1HE   MET  17          1HE       MET  17 -19.474  17.195 -18.611
   71   2HE   MET  17          2HE       MET  17 -19.113  16.947 -20.317
   72   3HE   MET  17          3HE       MET  17 -20.579  17.804 -19.850
   73    H    SER  18           H        SER  18 -18.186  13.629 -16.685
   74    HA   SER  18           HA       SER  18 -17.206  14.697 -14.819
   75   1HB   SER  18          1HB       SER  18 -14.608  13.810 -16.087
   76   2HB   SER  18          2HB       SER  18 -14.985  13.947 -14.372
   77    HG   SER  18           HG       SER  18 -15.516  11.928 -16.159
   78    HA   PRO  19           HA       PRO  19 -15.638  18.581 -16.160
   79   1HB   PRO  19          1HB       PRO  19 -14.281  19.472 -13.965
   80   2HB   PRO  19          2HB       PRO  19 -16.049  19.340 -14.031
   81   1HG   PRO  19          1HG       PRO  19 -14.107  17.679 -12.607
   82   2HG   PRO  19          2HG       PRO  19 -15.829  17.908 -12.303
   83   1HD   PRO  19          1HD       PRO  19 -14.563  15.704 -13.593
   84   2HD   PRO  19          2HD       PRO  19 -16.303  15.976 -13.358
   85    H    LYS  20           H        LYS  20 -13.673  16.115 -16.347
   86    HA   LYS  20           HA       LYS  20 -11.534  15.787 -17.276
   87   1HB   LYS  20          1HB       LYS  20 -12.515  17.828 -18.567
   88   2HB   LYS  20          2HB       LYS  20 -11.381  18.778 -17.605
   89   1HG   LYS  20          1HG       LYS  20 -10.432  16.327 -19.069
   90   2HG   LYS  20          2HG       LYS  20 -10.601  17.859 -19.924
   91   1HD   LYS  20          1HD       LYS  20  -9.286  18.363 -17.431
   92   2HD   LYS  20          2HD       LYS  20  -8.461  17.028 -18.235
   93   1HE   LYS  20          1HE       LYS  20  -8.774  18.659 -20.362
   94   2HE   LYS  20          2HE       LYS  20  -8.694  19.877 -19.072
   95   1HZ   LYS  20          1HZ       LYS  20  -6.712  18.776 -18.214
   96   2HZ   LYS  20          2HZ       LYS  20  -6.770  17.647 -19.478
   97   3HZ   LYS  20          3HZ       LYS  20  -6.473  19.285 -19.817
   98    H    ALA  21           H        ALA  21 -11.168  18.990 -15.692
   99    HA   ALA  21           HA       ALA  21  -8.587  18.741 -14.715
  100   1HB   ALA  21          1HB       ALA  21  -9.412  20.792 -14.185
  101   2HB   ALA  21          3HB       ALA  21  -9.923  20.035 -12.676
  102   3HB   ALA  21          2HB       ALA  21 -11.057  20.180 -14.018
  103    H    LEU  22           H        LEU  22 -11.545  17.616 -13.048
  104    HA   LEU  22           HA       LEU  22 -10.025  16.416 -10.847
  105   1HB   LEU  22          1HB       LEU  22 -12.905  16.490 -11.767
  106   2HB   LEU  22          2HB       LEU  22 -12.409  15.523 -10.377
  107    HG   LEU  22           HG       LEU  22 -11.354  17.626  -9.425
  108   1HD1  LEU  22          1HD1      LEU  22 -12.637  18.687 -11.911
  109   2HD1  LEU  22          2HD1      LEU  22 -12.627  19.707 -10.472
  110   3HD1  LEU  22          3HD1      LEU  22 -11.107  19.139 -11.163
  111   1HD2  LEU  22          1HD2      LEU  22 -13.629  16.702  -8.789
  112   2HD2  LEU  22          2HD2      LEU  22 -13.443  18.438  -8.533
  113   3HD2  LEU  22          3HD2      LEU  22 -14.333  17.844  -9.933
  114    H    GLN  23           H        GLN  23 -11.895  15.259 -13.639
  115    HA   GLN  23           HA       GLN  23 -11.703  12.479 -13.285
  116   1HB   GLN  23          1HB       GLN  23 -12.968  13.724 -15.036
  117   2HB   GLN  23          2HB       GLN  23 -11.445  14.079 -15.852
  118   1HG   GLN  23          1HG       GLN  23 -11.142  11.441 -15.681
  119   2HG   GLN  23          2HG       GLN  23 -12.905  11.479 -15.609
  120   2HE2  GLN  23          2HE2      GLN  23 -12.319  10.299 -17.850
  121   1HE2  GLN  23          1HE2      GLN  23 -12.280  11.326 -19.201
  122    H    GLN  24           H        GLN  24  -9.282  14.715 -14.635
  123    HA   GLN  24           HA       GLN  24  -7.411  12.594 -15.356
  124   1HB   GLN  24          1HB       GLN  24  -7.825  15.313 -15.880
  125   2HB   GLN  24          2HB       GLN  24  -6.309  15.268 -14.976
  126   1HG   GLN  24          1HG       GLN  24  -6.507  13.149 -16.995
  127   2HG   GLN  24          2HG       GLN  24  -6.563  14.772 -17.685
  128   2HE2  GLN  24          2HE2      GLN  24  -4.478  12.398 -16.249
  129   1HE2  GLN  24          1HE2      GLN  24  -3.074  13.351 -16.205
  130    H    LYS  25           H        LYS  25  -7.687  14.936 -12.672
  131    HA   LYS  25           HA       LYS  25  -5.238  14.106 -11.364
  132   1HB   LYS  25          1HB       LYS  25  -7.707  15.678 -10.611
  133   2HB   LYS  25          2HB       LYS  25  -6.409  15.393  -9.450
  134   1HG   LYS  25          1HG       LYS  25  -4.845  16.622 -10.701
  135   2HG   LYS  25          2HG       LYS  25  -5.792  16.491 -12.184
  136   1HD   LYS  25          2HD       LYS  25  -6.564  18.560 -11.693
  137   2HD   LYS  25          1HD       LYS  25  -7.530  17.772 -10.446
  138   1HE   LYS  25          1HE       LYS  25  -6.230  18.593  -8.758
  139   2HE   LYS  25          2HE       LYS  25  -4.728  18.310  -9.660
  140   1HZ   LYS  25          1HZ       LYS  25  -6.694  20.457 -10.258
  141   2HZ   LYS  25          2HZ       LYS  25  -5.228  20.691  -9.438
  142   3HZ   LYS  25          3HZ       LYS  25  -5.222  20.192 -11.063
  143    H    ILE  26           H        ILE  26  -8.682  13.278 -10.943
  144    HA   ILE  26           HA       ILE  26  -8.344  11.637  -8.606
  145    HB   ILE  26           HB       ILE  26 -10.397  11.663 -10.841
  146   1HG1  ILE  26          1HG1      ILE  26 -10.596  12.849  -8.066
  147   2HG1  ILE  26          2HG1      ILE  26  -9.985  13.772  -9.439
  148   1HG2  ILE  26          1HG2      ILE  26 -10.104  10.017  -8.413
  149   2HG2  ILE  26          2HG2      ILE  26 -11.679  10.797  -8.574
  150   3HG2  ILE  26          3HG2      ILE  26 -11.085   9.735  -9.851
  151   1HD1  ILE  26          1HD1      ILE  26 -12.664  12.360  -9.449
  152   2HD1  ILE  26          2HD1      ILE  26 -12.464  14.054  -8.999
  153   3HD1  ILE  26          3HD1      ILE  26 -12.062  13.523 -10.631
  154    H    HIS  27           H        HIS  27  -8.416  10.860 -12.095
  155    HA   HIS  27           HA       HIS  27  -8.044   8.000 -11.664
  156   1HB   HIS  27          1HB       HIS  27  -8.983   9.575 -13.660
  157   2HB   HIS  27          2HB       HIS  27  -7.343   9.296 -14.247
  158    HD1  HIS  27           HD1      HIS  27  -6.716   6.907 -14.968
  159    HD2  HIS  27           HD2      HIS  27 -10.595   7.204 -13.472
  160    HE1  HIS  27           HE1      HIS  27  -7.861   4.713 -15.507
  161    H    GLU  28           H        GLU  28  -5.937  10.758 -11.880
  162    HA   GLU  28           HA       GLU  28  -3.557   9.277 -12.710
  163   1HB   GLU  28          1HB       GLU  28  -4.302  12.031 -11.803
  164   2HB   GLU  28          2HB       GLU  28  -2.600  11.571 -11.743
  165   1HG   GLU  28          1HG       GLU  28  -4.229  11.063 -14.223
  166   2HG   GLU  28          2HG       GLU  28  -3.512  12.649 -13.932
  167    H    LEU  29           H        LEU  29  -4.559  10.833  -9.633
  168    HA   LEU  29           HA       LEU  29  -2.395   9.803  -8.067
  169   1HB   LEU  29          1HB       LEU  29  -5.175  10.846  -7.516
  170   2HB   LEU  29          2HB       LEU  29  -4.118  10.332  -6.201
  171    HG   LEU  29           HG       LEU  29  -3.131  12.260  -8.294
  172   1HD1  LEU  29          1HD1      LEU  29  -4.831  12.833  -5.862
  173   2HD1  LEU  29          2HD1      LEU  29  -3.753  14.045  -6.553
  174   3HD1  LEU  29          3HD1      LEU  29  -5.076  13.389  -7.517
  175   1HD2  LEU  29          1HD2      LEU  29  -2.057  10.992  -5.989
  176   2HD2  LEU  29          2HD2      LEU  29  -1.294  12.228  -6.988
  177   3HD2  LEU  29          3HD2      LEU  29  -2.254  12.697  -5.585
  178    H    GLU  30           H        GLU  30  -5.476   8.416  -9.046
  179    HA   GLU  30           HA       GLU  30  -5.662   6.324  -7.095
  180   1HB   GLU  30          1HB       GLU  30  -7.416   7.167  -8.705
  181   2HB   GLU  30          2HB       GLU  30  -6.557   6.323  -9.994
  182   1HG   GLU  30          1HG       GLU  30  -6.795   4.397  -8.001
  183   2HG   GLU  30          2HG       GLU  30  -8.340   5.247  -7.944
  184    H    GLY  31           H        GLY  31  -3.948   6.553 -10.197
  185   1HA   GLY  31          2HA       GLY  31  -2.544   4.991 -11.278
  186   2HA   GLY  31          1HA       GLY  31  -3.169   3.745 -10.199
  187    H    LEU  32           H        LEU  32  -1.919   6.680  -8.816
  188    HA   LEU  32           HA       LEU  32   0.835   5.892  -8.524
  189   1HB   LEU  32          1HB       LEU  32  -0.387   8.179  -8.278
  190   2HB   LEU  32          2HB       LEU  32  -0.711   7.654  -6.625
  191    HG   LEU  32           HG       LEU  32   1.779   7.212  -6.394
  192   1HD1  LEU  32          1HD1      LEU  32   1.733   7.634  -9.151
  193   2HD1  LEU  32          2HD1      LEU  32   2.459   9.107  -8.506
  194   3HD1  LEU  32          3HD1      LEU  32   3.175   7.537  -8.139
  195   1HD2  LEU  32          1HD2      LEU  32   0.380   9.798  -6.567
  196   2HD2  LEU  32          2HD2      LEU  32   1.409   9.160  -5.283
  197   3HD2  LEU  32          3HD2      LEU  32   2.133   9.929  -6.696
  198    H    MET  33           H        MET  33  -2.086   5.200  -6.680
  199    HA   MET  33           HA       MET  33  -0.911   4.342  -4.228
  200   1HB   MET  33          1HB       MET  33  -3.429   3.773  -5.776
  201   2HB   MET  33          2HB       MET  33  -3.105   2.895  -4.281
  202   1HG   MET  33          1HG       MET  33  -3.468   4.725  -2.978
  203   2HG   MET  33          2HG       MET  33  -2.659   5.809  -4.112
  204   1HE   MET  33          1HE       MET  33  -5.483   3.306  -3.993
  205   2HE   MET  33          2HE       MET  33  -6.111   4.472  -2.822
  206   3HE   MET  33          3HE       MET  33  -6.949   4.215  -4.350
  207    H    MET  34           H        MET  34  -2.179   2.204  -6.815
  208    HA   MET  34           HA       MET  34  -0.909  -0.168  -5.883
  209   1HB   MET  34          1HB       MET  34  -2.802   0.012  -7.492
  210   2HB   MET  34          2HB       MET  34  -1.689   0.657  -8.699
  211   1HG   MET  34          2HG       MET  34  -1.842  -1.667  -9.183
  212   2HG   MET  34          1HG       MET  34  -0.307  -1.475  -8.336
  213   1HE   MET  34          1HE       MET  34  -3.943  -1.914  -8.101
  214   2HE   MET  34          2HE       MET  34  -4.272  -3.100  -6.831
  215   3HE   MET  34          3HE       MET  34  -3.961  -1.418  -6.411
  216    H    GLN  35           H        GLN  35   0.251   2.428  -7.982
  217    HA   GLN  35           HA       GLN  35   2.489   1.204  -9.181
  218   1HB   GLN  35          1HB       GLN  35   1.678   3.434  -9.731
  219   2HB   GLN  35          2HB       GLN  35   2.051   4.008  -8.107
  220   1HG   GLN  35          2HG       GLN  35   4.085   4.597  -8.879
  221   2HG   GLN  35          1HG       GLN  35   4.445   2.879  -9.038
  222   2HE2  GLN  35          2HE2      GLN  35   2.819   5.535 -10.862
  223   1HE2  GLN  35          1HE2      GLN  35   3.275   4.960 -12.392
  224    H    HIS  36           H        HIS  36   2.959   3.479  -6.480
  225    HA   HIS  36           HA       HIS  36   5.460   2.400  -5.666
  226   1HB   HIS  36          1HB       HIS  36   3.324   4.148  -4.486
  227   2HB   HIS  36          2HB       HIS  36   4.673   3.647  -3.468
  228    HD1  HIS  36           HD1      HIS  36   4.385   6.614  -4.280
  229    HD2  HIS  36           HD2      HIS  36   6.658   3.847  -6.414
  230    HE1  HIS  36           HE1      HIS  36   6.089   7.949  -5.596
  231    H    ALA  37           H        ALA  37   2.169   1.788  -4.390
  232    HA   ALA  37           HA       ALA  37   2.722   0.132  -2.206
  233   1HB   ALA  37          1HB       ALA  37   0.592  -0.118  -4.358
  234   2HB   ALA  37          2HB       ALA  37   0.507  -0.875  -2.768
  235   3HB   ALA  37          3HB       ALA  37   0.492   0.883  -2.909
  236    H    GLN  38           H        GLN  38   2.693  -0.729  -5.670
  237    HA   GLN  38           HA       GLN  38   3.033  -3.546  -5.411
  238   1HB   GLN  38          1HB       GLN  38   3.336  -1.421  -7.420
  239   2HB   GLN  38          2HB       GLN  38   4.422  -2.785  -7.685
  240   1HG   GLN  38          1HG       GLN  38   1.888  -3.859  -6.968
  241   2HG   GLN  38          2HG       GLN  38   1.604  -2.629  -8.200
  242   2HE2  GLN  38          2HE2      GLN  38   1.250  -4.042  -9.996
  243   1HE2  GLN  38          1HE2      GLN  38   2.443  -5.090 -10.596
  244    H    ASN  39           H        ASN  39   5.348  -0.866  -5.319
  245    HA   ASN  39           HA       ASN  39   7.644  -2.721  -5.047
  246   1HB   ASN  39          1HB       ASN  39   7.136   0.177  -5.531
  247   2HB   ASN  39          2HB       ASN  39   8.654  -0.237  -4.735
  248   2HD2  ASN  39          2HD2      ASN  39   6.692  -1.160  -7.615
  249   1HD2  ASN  39          1HD2      ASN  39   8.031  -1.536  -8.589
  250    H    LEU  40           H        LEU  40   5.347  -2.153  -2.975
  251    HA   LEU  40           HA       LEU  40   5.170  -1.998  -0.645
  252   1HB   LEU  40          1HB       LEU  40   8.009  -2.937  -1.113
  253   2HB   LEU  40          2HB       LEU  40   7.316  -2.819   0.505
  254    HG   LEU  40           HG       LEU  40   5.372  -4.233  -0.409
  255   1HD1  LEU  40          1HD1      LEU  40   7.379  -4.396  -2.647
  256   2HD1  LEU  40          2HD1      LEU  40   6.299  -5.751  -2.323
  257   3HD1  LEU  40          3HD1      LEU  40   5.633  -4.174  -2.741
  258   1HD2  LEU  40          1HD2      LEU  40   7.628  -4.914   0.912
  259   2HD2  LEU  40          2HD2      LEU  40   6.411  -6.099   0.439
  260   3HD2  LEU  40          3HD2      LEU  40   7.852  -5.873  -0.551
  261    H    GLU  41           H        GLU  41   6.196   0.389  -2.272
  262    HA   GLU  41           HA       GLU  41   8.079   1.848  -0.642
  263   1HB   GLU  41          1HB       GLU  41   6.045   2.452  -2.776
  264   2HB   GLU  41          2HB       GLU  41   6.839   3.785  -1.937
  265   1HG   GLU  41          1HG       GLU  41   8.567   1.572  -2.951
  266   2HG   GLU  41          2HG       GLU  41   7.894   2.690  -4.138
  267    H    PHE  42           H        PHE  42   4.529   1.791  -0.828
  268    HA   PHE  42           HA       PHE  42   2.890   2.628   0.643
  269   1HB   PHE  42          1HB       PHE  42   5.122   1.455   2.272
  270   2HB   PHE  42          2HB       PHE  42   3.761   2.204   3.103
  271    HD1  PHE  42           HD1      PHE  42   1.471   1.561   1.370
  272    HD2  PHE  42           HD2      PHE  42   4.853  -0.875   2.504
  273    HE1  PHE  42           HE1      PHE  42   0.114  -0.496   1.004
  274    HE2  PHE  42           HE2      PHE  42   3.490  -2.931   2.139
  275    HZ   PHE  42           HZ       PHE  42   1.120  -2.737   1.392
  276    H    GLU  43           H        GLU  43   2.774   4.037   2.816
  277    HA   GLU  43           HA       GLU  43   2.989   6.132   3.826
  278   1HB   GLU  43          1HB       GLU  43   5.329   5.484   4.148
  279   2HB   GLU  43          2HB       GLU  43   5.717   5.951   2.494
  280   1HG   GLU  43          1HG       GLU  43   4.885   8.278   3.074
  281   2HG   GLU  43          2HG       GLU  43   4.866   7.755   4.760
  282    H    GLU  44           H        GLU  44   4.675   6.346   0.729
  283    HA   GLU  44           HA       GLU  44   3.287   8.840   0.030
  284   1HB   GLU  44          2HB       GLU  44   4.770   8.750  -1.915
  285   2HB   GLU  44          1HB       GLU  44   5.692   8.350  -0.467
  286   1HG   GLU  44          1HG       GLU  44   5.505   5.963  -0.964
  287   2HG   GLU  44          2HG       GLU  44   4.484   6.309  -2.359
  288    H    ALA  45           H        ALA  45   3.162   5.407  -0.843
  289    HA   ALA  45           HA       ALA  45   1.309   5.817  -3.073
  290   1HB   ALA  45          1HB       ALA  45   1.628   3.176  -1.752
  291   2HB   ALA  45          3HB       ALA  45   3.105   3.926  -2.354
  292   3HB   ALA  45          2HB       ALA  45   1.768   3.603  -3.457
  293    H    ALA  46           H        ALA  46   1.022   4.570   0.272
  294    HA   ALA  46           HA       ALA  46  -1.832   4.053  -0.003
  295   1HB   ALA  46          1HB       ALA  46  -0.187   2.845   1.465
  296   2HB   ALA  46          3HB       ALA  46  -0.110   4.287   2.478
  297   3HB   ALA  46          2HB       ALA  46  -1.627   3.400   2.319
  298    H    GLN  47           H        GLN  47   0.095   6.808   1.062
  299    HA   GLN  47           HA       GLN  47  -1.942   8.144   2.587
  300   1HB   GLN  47          1HB       GLN  47   0.594   8.847   1.168
  301   2HB   GLN  47          2HB       GLN  47  -0.461  10.167   1.672
  302   1HG   GLN  47          1HG       GLN  47   0.312   7.962   3.581
  303   2HG   GLN  47          2HG       GLN  47   1.329   9.387   3.361
  304   2HE2  GLN  47          2HE2      GLN  47   0.173  11.557   3.709
  305   1HE2  GLN  47          1HE2      GLN  47  -1.060  11.618   4.873
  306    H    ILE  48           H        ILE  48  -1.238   7.995  -0.880
  307    HA   ILE  48           HA       ILE  48  -2.762  10.144  -1.865
  308    HB   ILE  48           HB       ILE  48  -2.397   7.311  -2.898
  309   1HG1  ILE  48          2HG1      ILE  48  -0.299   8.543  -2.493
  310   2HG1  ILE  48          1HG1      ILE  48  -0.578   8.348  -4.223
  311   1HG2  ILE  48          1HG2      ILE  48  -3.850   9.631  -3.967
  312   2HG2  ILE  48          2HG2      ILE  48  -2.642   8.988  -5.081
  313   3HG2  ILE  48          3HG2      ILE  48  -3.916   7.939  -4.461
  314   1HD1  ILE  48          1HD1      ILE  48  -1.896  10.720  -3.622
  315   2HD1  ILE  48          2HD1      ILE  48  -0.437  10.798  -2.635
  316   3HD1  ILE  48          3HD1      ILE  48  -0.309  10.586  -4.381
  317    H    ARG  49           H        ARG  49  -3.819   7.091  -0.491
  318    HA   ARG  49           HA       ARG  49  -6.488   6.936  -1.403
  319   1HB   ARG  49          1HB       ARG  49  -5.521   5.152  -0.153
  320   2HB   ARG  49          2HB       ARG  49  -5.046   6.222   1.159
  321   1HG   ARG  49          1HG       ARG  49  -7.895   6.392   0.816
  322   2HG   ARG  49          2HG       ARG  49  -7.432   4.696   0.938
  323   1HD   ARG  49          1HD       ARG  49  -7.867   5.734   3.181
  324   2HD   ARG  49          2HD       ARG  49  -6.197   5.160   3.021
  325    HE   ARG  49           HE       ARG  49  -5.552   7.522   2.480
  326   1HH1  ARG  49          1HH1      ARG  49  -8.821   7.743   2.486
  327   2HH1  ARG  49          2HH1      ARG  49  -8.953   8.953   3.718
  328   1HH2  ARG  49          1HH2      ARG  49  -5.630   8.716   4.680
  329   2HH2  ARG  49          2HH2      ARG  49  -7.148   9.504   4.960
  330    H    ASP  50           H        ASP  50  -4.991   9.098   0.928
  331    HA   ASP  50           HA       ASP  50  -7.499  10.062   2.076
  332   1HB   ASP  50          1HB       ASP  50  -5.019  10.015   2.966
  333   2HB   ASP  50          2HB       ASP  50  -4.881  11.542   2.094
  334    H    GLN  51           H        GLN  51  -5.311  11.061  -0.527
  335    HA   GLN  51           HA       GLN  51  -6.687  13.604  -0.996
  336   1HB   GLN  51          2HB       GLN  51  -4.709  11.999  -2.652
  337   2HB   GLN  51          1HB       GLN  51  -5.113  13.699  -2.894
  338   1HG   GLN  51          1HG       GLN  51  -4.236  14.263  -0.687
  339   2HG   GLN  51          2HG       GLN  51  -3.921  12.560  -0.349
  340   2HE2  GLN  51          2HE2      GLN  51  -3.327  14.234  -3.459
  341   1HE2  GLN  51          1HE2      GLN  51  -1.645  14.011  -3.439
  342    H    LEU  52           H        LEU  52  -6.628  10.376  -2.509
  343    HA   LEU  52           HA       LEU  52  -8.301  10.986  -4.751
  344   1HB   LEU  52          1HB       LEU  52  -6.867   8.849  -3.757
  345   2HB   LEU  52          2HB       LEU  52  -8.533   8.302  -3.561
  346    HG   LEU  52           HG       LEU  52  -7.659   7.665  -5.777
  347   1HD1  LEU  52          1HD1      LEU  52 -10.076   8.839  -5.228
  348   2HD1  LEU  52          2HD1      LEU  52  -9.498   9.831  -6.566
  349   3HD1  LEU  52          3HD1      LEU  52  -9.661   8.087  -6.769
  350   1HD2  LEU  52          1HD2      LEU  52  -6.283  10.013  -5.684
  351   2HD2  LEU  52          2HD2      LEU  52  -6.582   9.120  -7.176
  352   3HD2  LEU  52          3HD2      LEU  52  -7.625  10.472  -6.733
  353    H    HIS  53           H        HIS  53  -9.077   9.736  -1.492
  354    HA   HIS  53           HA       HIS  53 -11.908   9.477  -1.927
  355   1HB   HIS  53          1HB       HIS  53 -10.604   8.384  -0.130
  356   2HB   HIS  53          2HB       HIS  53 -10.283   9.961   0.593
  357    HD1  HIS  53           HD1      HIS  53 -12.322  11.226   1.664
  358    HD2  HIS  53           HD2      HIS  53 -13.192   7.362   0.362
  359    HE1  HIS  53           HE1      HIS  53 -14.556  10.610   2.688
  360    H    GLN  54           H        GLN  54  -9.889  12.123  -0.648
  361    HA   GLN  54           HA       GLN  54 -12.064  13.862   0.083
  362   1HB   GLN  54          1HB       GLN  54  -9.133  13.903  -0.213
  363   2HB   GLN  54          2HB       GLN  54  -9.896  15.470  -0.488
  364   1HG   GLN  54          1HG       GLN  54 -11.246  14.814   1.705
  365   2HG   GLN  54          2HG       GLN  54  -9.828  13.806   1.998
  366   2HE2  GLN  54          2HE2      GLN  54  -7.932  15.634   0.661
  367   1HE2  GLN  54          1HE2      GLN  54  -7.770  16.986   1.674
  368    H    LEU  55           H        LEU  55 -10.079  13.573  -2.871
  369    HA   LEU  55           HA       LEU  55 -11.276  15.800  -4.256
  370   1HB   LEU  55          1HB       LEU  55  -9.545  13.441  -4.842
  371   2HB   LEU  55          2HB       LEU  55 -10.330  14.214  -6.220
  372    HG   LEU  55           HG       LEU  55  -9.109  16.081  -4.281
  373   1HD1  LEU  55          1HD1      LEU  55  -7.608  13.838  -4.859
  374   2HD1  LEU  55          2HD1      LEU  55  -7.103  14.965  -6.119
  375   3HD1  LEU  55          3HD1      LEU  55  -6.944  15.412  -4.421
  376   1HD2  LEU  55          1HD2      LEU  55 -10.161  16.510  -6.615
  377   2HD2  LEU  55          2HD2      LEU  55  -8.635  17.311  -6.243
  378   3HD2  LEU  55          3HD2      LEU  55  -8.650  15.867  -7.257
  379    H    ARG  56           H        ARG  56 -12.282  12.508  -3.702
  380    HA   ARG  56           HA       ARG  56 -13.977  12.019  -5.913
  381   1HB   ARG  56          1HB       ARG  56 -13.366  10.401  -4.154
  382   2HB   ARG  56          2HB       ARG  56 -14.306  11.318  -2.977
  383   1HG   ARG  56          1HG       ARG  56 -16.230  10.984  -4.792
  384   2HG   ARG  56          2HG       ARG  56 -15.251   9.580  -5.217
  385   1HD   ARG  56          1HD       ARG  56 -15.525   8.587  -3.095
  386   2HD   ARG  56          2HD       ARG  56 -15.984  10.125  -2.337
  387    HE   ARG  56           HE       ARG  56 -17.796   9.385  -4.484
  388   1HH1  ARG  56          1HH1      ARG  56 -17.973  10.493  -1.473
  389   2HH1  ARG  56          2HH1      ARG  56 -19.122   9.352  -0.857
  390   1HH2  ARG  56          1HH2      ARG  56 -18.852   7.212  -3.573
  391   2HH2  ARG  56          2HH2      ARG  56 -19.619   7.495  -2.046
  392    H    GLU  57           H        GLU  57 -14.826  13.530  -2.771
  393    HA   GLU  57           HA       GLU  57 -17.536  14.144  -3.412
  394   1HB   GLU  57          1HB       GLU  57 -16.464  14.157  -1.161
  395   2HB   GLU  57          2HB       GLU  57 -15.566  15.604  -1.620
  396   1HG   GLU  57          1HG       GLU  57 -17.350  16.673  -0.669
  397   2HG   GLU  57          2HG       GLU  57 -18.079  16.398  -2.252
  398    H    LEU  58           H        LEU  58 -14.519  15.918  -4.011
  399    HA   LEU  58           HA       LEU  58 -15.564  18.432  -4.778
  400   1HB   LEU  58          1HB       LEU  58 -13.120  16.946  -4.883
  401   2HB   LEU  58          2HB       LEU  58 -13.372  17.689  -6.463
  402    HG   LEU  58           HG       LEU  58 -13.700  19.252  -3.900
  403   1HD1  LEU  58          1HD1      LEU  58 -11.211  18.690  -5.517
  404   2HD1  LEU  58          2HD1      LEU  58 -11.362  20.132  -4.515
  405   3HD1  LEU  58          3HD1      LEU  58 -11.436  18.533  -3.776
  406   1HD2  LEU  58          1HD2      LEU  58 -14.605  20.005  -6.202
  407   2HD2  LEU  58          2HD2      LEU  58 -13.597  21.151  -5.317
  408   3HD2  LEU  58          3HD2      LEU  58 -12.913  20.222  -6.650
  409    H    PHE  59           H        PHE  59 -15.641  15.357  -6.442
  410    HA   PHE  59           HA       PHE  59 -15.946  16.123  -9.137
  411   1HB   PHE  59          1HB       PHE  59 -15.767  13.816  -8.323
  412   2HB   PHE  59          2HB       PHE  59 -17.330  13.959  -7.518
  413    HD1  PHE  59           HD1      PHE  59 -19.412  14.420  -8.934
  414    HD2  PHE  59           HD2      PHE  59 -15.620  13.240 -10.630
  415    HE1  PHE  59           HE1      PHE  59 -20.562  13.752 -11.043
  416    HE2  PHE  59           HE2      PHE  59 -16.771  12.573 -12.738
  417    HZ   PHE  59           HZ       PHE  59 -19.242  12.828 -12.944
  418    H    ILE  60           H        ILE  60 -18.259  16.301  -6.468
  419    HA   ILE  60           HA       ILE  60 -20.540  16.943  -8.185
  420    HB   ILE  60           HB       ILE  60 -20.088  17.236  -5.197
  421   1HG1  ILE  60          1HG1      ILE  60 -21.698  14.983  -6.137
  422   2HG1  ILE  60          2HG1      ILE  60 -20.040  14.912  -6.733
  423   1HG2  ILE  60          1HG2      ILE  60 -22.514  17.323  -6.982
  424   2HG2  ILE  60          2HG2      ILE  60 -22.658  16.829  -5.295
  425   3HG2  ILE  60          3HG2      ILE  60 -22.050  18.437  -5.694
  426   1HD1  ILE  60          1HD1      ILE  60 -19.638  15.648  -4.127
  427   2HD1  ILE  60          2HD1      ILE  60 -21.061  14.616  -3.981
  428   3HD1  ILE  60          3HD1      ILE  60 -19.584  13.983  -4.708
  429    H    ALA  61           H        ALA  61 -18.076  18.725  -6.407
  430    HA   ALA  61           HA       ALA  61 -19.381  21.298  -6.420
  431   1HB   ALA  61          1HB       ALA  61 -17.250  20.237  -5.197
  432   2HB   ALA  61          2HB       ALA  61 -16.407  20.997  -6.547
  433   3HB   ALA  61          3HB       ALA  61 -17.385  21.977  -5.456
  434    H    ALA  62           H        ALA  62 -17.677  19.469  -8.849
  435    HA   ALA  62           HA       ALA  62 -17.410  21.885 -10.586
  436   1HB   ALA  62          1HB       ALA  62 -16.266  19.081 -10.606
  437   2HB   ALA  62          3HB       ALA  62 -16.037  20.206 -11.946
  438   3HB   ALA  62          2HB       ALA  62 -15.401  20.595 -10.347
  439    H    SER  63           H        SER  63 -18.246  18.434 -11.104
  440    HA   SER  63           HA       SER  63 -20.063  19.214 -13.309
  441   1HB   SER  63          1HB       SER  63 -18.405  17.337 -13.441
  442   2HB   SER  63          2HB       SER  63 -19.297  16.506 -12.170
  443    HG   SER  63           HG       SER  63 -19.785  16.581 -14.794
  444    H    LEU   8           H        LEU   8  34.666 -28.476   1.711
  445    HA   LEU   8           HA       LEU   8  33.144 -26.689   2.057
  446   1HB   LEU   8          1HB       LEU   8  33.311 -25.066   0.151
  447   2HB   LEU   8          2HB       LEU   8  34.879 -25.704   0.646
  448    HG   LEU   8           HG       LEU   8  33.536 -27.347  -1.388
  449   1HD1  LEU   8          1HD1      LEU   8  32.844 -24.986  -2.011
  450   2HD1  LEU   8          2HD1      LEU   8  34.557 -24.611  -2.193
  451   3HD1  LEU   8          3HD1      LEU   8  33.805 -25.823  -3.231
  452   1HD2  LEU   8          1HD2      LEU   8  36.133 -26.795  -0.424
  453   2HD2  LEU   8          2HD2      LEU   8  35.696 -27.897  -1.728
  454   3HD2  LEU   8          3HD2      LEU   8  36.108 -26.222  -2.092
  455    H    GLU   9           H        GLU   9  31.361 -28.449   2.027
  456    HA   GLU   9           HA       GLU   9  29.500 -27.923  -0.269
  457   1HB   GLU   9          1HB       GLU   9  30.643 -30.205  -0.129
  458   2HB   GLU   9          2HB       GLU   9  29.723 -30.473   1.352
  459   1HG   GLU   9          1HG       GLU   9  27.645 -29.851  -0.056
  460   2HG   GLU   9          2HG       GLU   9  28.685 -30.109  -1.456
  461    HA   PRO  10           HA       PRO  10  27.621 -26.979   3.936
  462   1HB   PRO  10          1HB       PRO  10  27.111 -24.325   3.511
  463   2HB   PRO  10          2HB       PRO  10  28.636 -24.917   4.201
  464   1HG   PRO  10          2HG       PRO  10  28.031 -24.037   1.425
  465   2HG   PRO  10          1HG       PRO  10  29.489 -23.788   2.396
  466   1HD   PRO  10          1HD       PRO  10  29.277 -25.672   0.428
  467   2HD   PRO  10          2HD       PRO  10  30.375 -25.814   1.819
  468    H    ASP  11           H        ASP  11  26.690 -25.359   0.872
  469    HA   ASP  11           HA       ASP  11  24.631 -25.310  -0.277
  470   1HB   ASP  11          1HB       ASP  11  24.966 -27.906   0.940
  471   2HB   ASP  11          2HB       ASP  11  23.257 -27.470   0.948
  472    H    ASN  12           H        ASN  12  23.370 -26.713   2.734
  473    HA   ASN  12           HA       ASN  12  22.108 -24.084   3.401
  474   1HB   ASN  12          1HB       ASN  12  19.972 -25.348   3.742
  475   2HB   ASN  12          2HB       ASN  12  20.526 -25.391   2.067
  476   2HD2  ASN  12          2HD2      ASN  12  20.346 -27.332   5.059
  477   1HD2  ASN  12          1HD2      ASN  12  20.562 -28.831   4.293
  478    H    VAL  13           H        VAL  13  24.342 -25.717   4.587
  479    HA   VAL  13           HA       VAL  13  23.196 -26.748   7.102
  480    HB   VAL  13           HB       VAL  13  25.816 -26.771   5.654
  481   1HG1  VAL  13          1HG1      VAL  13  25.510 -26.951   8.642
  482   2HG1  VAL  13          2HG1      VAL  13  26.724 -27.934   7.822
  483   3HG1  VAL  13          3HG1      VAL  13  26.786 -26.175   7.702
  484   1HG2  VAL  13          1HG2      VAL  13  23.854 -28.530   5.738
  485   2HG2  VAL  13          2HG2      VAL  13  25.534 -29.070   5.741
  486   3HG2  VAL  13          3HG2      VAL  13  24.626 -29.005   7.252
  487    HA   PRO  14           HA       PRO  14  25.502 -22.985   8.793
  488   1HB   PRO  14          1HB       PRO  14  26.731 -21.243   7.087
  489   2HB   PRO  14          2HB       PRO  14  27.524 -22.706   7.702
  490   1HG   PRO  14          2HG       PRO  14  26.466 -22.134   5.026
  491   2HG   PRO  14          1HG       PRO  14  27.698 -23.297   5.533
  492   1HD   PRO  14          1HD       PRO  14  24.976 -23.822   4.901
  493   2HD   PRO  14          2HD       PRO  14  26.186 -24.954   5.514
  494    H    MET  15           H        MET  15  24.281 -22.061   5.556
  495    HA   MET  15           HA       MET  15  22.455 -20.129   6.919
  496   1HB   MET  15          1HB       MET  15  24.579 -19.633   5.167
  497   2HB   MET  15          2HB       MET  15  23.138 -19.488   4.160
  498   1HG   MET  15          1HG       MET  15  22.754 -17.454   5.039
  499   2HG   MET  15          2HG       MET  15  22.546 -18.203   6.622
  500   1HE   MET  15          1HE       MET  15  23.516 -15.418   5.591
  501   2HE   MET  15          2HE       MET  15  25.182 -14.993   5.973
  502   3HE   MET  15          3HE       MET  15  24.804 -15.837   4.465
  503    H    ASP  16           H        ASP  16  20.921 -19.422   4.721
  504    HA   ASP  16           HA       ASP  16  19.070 -20.161   3.461
  505   1HB   ASP  16          1HB       ASP  16  21.338 -21.369   2.538
  506   2HB   ASP  16          2HB       ASP  16  20.357 -22.781   2.936
  507    H    MET  17           H        MET  17  18.234 -20.378   5.852
  508    HA   MET  17           HA       MET  17  16.671 -22.797   6.038
  509   1HB   MET  17          1HB       MET  17  17.852 -23.650   8.116
  510   2HB   MET  17          2HB       MET  17  18.793 -23.799   6.632
  511   1HG   MET  17          1HG       MET  17  19.899 -21.608   7.196
  512   2HG   MET  17          2HG       MET  17  19.067 -21.650   8.752
  513   1HE   MET  17          1HE       MET  17  19.487 -22.944  10.605
  514   2HE   MET  17          2HE       MET  17  19.103 -24.505   9.885
  515   3HE   MET  17          3HE       MET  17  20.596 -24.308  10.800
  516    H    SER  18           H        SER  18  18.130 -20.064   7.785
  517    HA   SER  18           HA       SER  18  17.199 -18.584   9.374
  518   1HB   SER  18          1HB       SER  18  14.565 -19.533   8.231
  519   2HB   SER  18          2HB       SER  18  14.964 -17.932   8.848
  520    HG   SER  18           HG       SER  18  15.424 -19.059   6.384
  521    HA   PRO  19           HA       PRO  19  15.717 -20.988  12.747
  522   1HB   PRO  19          1HB       PRO  19  14.408 -19.140  14.272
  523   2HB   PRO  19          2HB       PRO  19  16.171 -19.170  14.077
  524   1HG   PRO  19          1HG       PRO  19  14.202 -17.321  12.953
  525   2HG   PRO  19          2HG       PRO  19  15.933 -17.101  13.214
  526   1HD   PRO  19          1HD       PRO  19  14.598 -17.694  10.766
  527   2HD   PRO  19          2HD       PRO  19  16.346 -17.552  11.047
  528    H    LYS  20           H        LYS  20  13.687 -20.446  10.387
  529    HA   LYS  20           HA       LYS  20  11.529 -21.234   9.865
  530   1HB   LYS  20          1HB       LYS  20  12.549 -23.062  11.418
  531   2HB   LYS  20          2HB       LYS  20  11.451 -22.414  12.636
  532   1HG   LYS  20          1HG       LYS  20  10.423 -23.102   9.894
  533   2HG   LYS  20          2HG       LYS  20  10.622 -24.367  11.110
  534   1HD   LYS  20          1HD       LYS  20   9.348 -22.120  12.348
  535   2HD   LYS  20          2HD       LYS  20   8.480 -22.501  10.861
  536   1HE   LYS  20          1HE       LYS  20   8.812 -25.010  11.799
  537   2HE   LYS  20          2HE       LYS  20   8.778 -24.128  13.339
  538   1HZ   LYS  20          1HZ       LYS  20   6.777 -22.982  12.588
  539   2HZ   LYS  20          2HZ       LYS  20   6.792 -23.865  11.141
  540   3HZ   LYS  20          3HZ       LYS  20   6.533 -24.663  12.619
  541    H    ALA  21           H        ALA  21  11.266 -20.643  13.399
  542    HA   ALA  21           HA       ALA  21   8.689 -19.628  13.516
  543   1HB   ALA  21          1HB       ALA  21  11.204 -19.385  15.024
  544   2HB   ALA  21          3HB       ALA  21   9.574 -19.717  15.609
  545   3HB   ALA  21          2HB       ALA  21  10.080 -18.055  15.305
  546    H    LEU  22           H        LEU  22  11.636 -17.717  12.839
  547    HA   LEU  22           HA       LEU  22  10.109 -15.257  12.370
  548   1HB   LEU  22          1HB       LEU  22  12.980 -16.168  12.093
  549   2HB   LEU  22          2HB       LEU  22  12.475 -14.557  11.584
  550    HG   LEU  22           HG       LEU  22  11.484 -14.250  13.901
  551   1HD1  LEU  22          1HD1      LEU  22  12.768 -16.941  14.161
  552   2HD1  LEU  22          2HD1      LEU  22  12.801 -15.860  15.554
  553   3HD1  LEU  22          3HD1      LEU  22  11.259 -16.351  14.853
  554   1HD2  LEU  22          1HD2      LEU  22  13.742 -13.381  13.138
  555   2HD2  LEU  22          2HD2      LEU  22  13.604 -13.638  14.877
  556   3HD2  LEU  22          3HD2      LEU  22  14.464 -14.810  13.878
  557    H    GLN  23           H        GLN  23  11.918 -17.601  10.403
  558    HA   GLN  23           HA       GLN  23  11.657 -16.458   7.850
  559   1HB   GLN  23          1HB       GLN  23  12.935 -18.498   8.500
  560   2HB   GLN  23          2HB       GLN  23  11.413 -19.377   8.644
  561   1HG   GLN  23          1HG       GLN  23  11.045 -18.447   6.179
  562   2HG   GLN  23          2HG       GLN  23  12.808 -18.396   6.188
  563   2HE2  GLN  23          2HE2      GLN  23  12.166 -20.197   4.427
  564   1HE2  GLN  23          1HE2      GLN  23  12.139 -21.788   5.019
  565    H    GLN  24           H        GLN  24   9.282 -18.388   9.668
  566    HA   GLN  24           HA       GLN  24   7.348 -18.460   7.483
  567   1HB   GLN  24          1HB       GLN  24   7.826 -19.749   9.920
  568   2HB   GLN  24          2HB       GLN  24   6.320 -18.867  10.181
  569   1HG   GLN  24          1HG       GLN  24   6.441 -20.187   7.563
  570   2HG   GLN  24          2HG       GLN  24   6.530 -21.317   8.915
  571   2HE2  GLN  24          2HE2      GLN  24   4.402 -19.249   7.117
  572   1HE2  GLN  24          1HE2      GLN  24   3.023 -19.477   8.081
  573    H    LYS  25           H        LYS  25   7.715 -16.570  10.491
  574    HA   LYS  25           HA       LYS  25   5.258 -15.069  10.143
  575   1HB   LYS  25          1HB       LYS  25   7.775 -14.811  11.796
  576   2HB   LYS  25          2HB       LYS  25   6.484 -13.613  11.895
  577   1HG   LYS  25          1HG       LYS  25   4.939 -15.161  12.753
  578   2HG   LYS  25          2HG       LYS  25   5.864 -16.547  12.173
  579   1HD   LYS  25          2HD       LYS  25   6.695 -16.678  14.273
  580   2HD   LYS  25          1HD       LYS  25   7.655 -15.259  13.851
  581   1HE   LYS  25          1HE       LYS  25   6.395 -13.877  15.162
  582   2HE   LYS  25          2HE       LYS  25   4.875 -14.655  14.673
  583   1HZ   LYS  25          1HZ       LYS  25   6.893 -15.852  16.498
  584   2HZ   LYS  25          2HZ       LYS  25   5.442 -15.131  17.002
  585   3HZ   LYS  25          3HZ       LYS  25   5.406 -16.543  16.055
  586    H    ILE  26           H        ILE  26   8.685 -14.437   9.376
  587    HA   ILE  26           HA       ILE  26   8.330 -11.725   8.492
  588    HB   ILE  26           HB       ILE  26  10.359 -13.879   7.812
  589   1HG1  ILE  26          1HG1      ILE  26  10.619 -11.566   9.745
  590   2HG1  ILE  26          2HG1      ILE  26  10.018 -13.146  10.248
  591   1HG2  ILE  26          1HG2      ILE  26  10.050 -11.076   6.949
  592   2HG2  ILE  26          2HG2      ILE  26  11.643 -11.461   7.603
  593   3HG2  ILE  26          3HG2      ILE  26  11.007 -12.374   6.234
  594   1HD1  ILE  26          1HD1      ILE  26  12.659 -12.753   8.820
  595   2HD1  ILE  26          2HD1      ILE  26  12.507 -12.813  10.576
  596   3HD1  ILE  26          3HD1      ILE  26  12.074 -14.220   9.604
  597    H    HIS  27           H        HIS  27   8.344 -14.840   6.738
  598    HA   HIS  27           HA       HIS  27   7.902 -13.599   4.136
  599   1HB   HIS  27          1HB       HIS  27   8.859 -15.969   5.038
  600   2HB   HIS  27          2HB       HIS  27   7.207 -16.444   4.649
  601    HD1  HIS  27           HD1      HIS  27   6.509 -16.440   2.172
  602    HD2  HIS  27           HD2      HIS  27  10.412 -15.107   2.779
  603    HE1  HIS  27           HE1      HIS  27   7.589 -16.322  -0.116
  604    H    GLU  28           H        GLU  28   5.865 -14.599   6.772
  605    HA   GLU  28           HA       GLU  28   3.439 -14.956   5.181
  606   1HB   GLU  28          1HB       GLU  28   4.265 -14.887   8.057
  607   2HB   GLU  28          2HB       GLU  28   2.552 -14.690   7.684
  608   1HG   GLU  28          1HG       GLU  28   4.139 -16.924   6.435
  609   2HG   GLU  28          2HG       GLU  28   3.467 -17.102   8.055
  610    H    LEU  29           H        LEU  29   4.514 -12.464   7.534
  611    HA   LEU  29           HA       LEU  29   2.342 -10.660   7.060
  612   1HB   LEU  29          1HB       LEU  29   5.154 -10.444   8.140
  613   2HB   LEU  29          2HB       LEU  29   4.098  -9.032   8.056
  614    HG   LEU  29           HG       LEU  29   3.137 -11.590   9.326
  615   1HD1  LEU  29          1HD1      LEU  29   4.880  -9.432  10.528
  616   2HD1  LEU  29          2HD1      LEU  29   3.826 -10.440  11.519
  617   3HD1  LEU  29          3HD1      LEU  29   5.120 -11.178  10.575
  618   1HD2  LEU  29          1HD2      LEU  29   2.058  -9.015   8.806
  619   2HD2  LEU  29          2HD2      LEU  29   1.315 -10.324   9.725
  620   3HD2  LEU  29          3HD2      LEU  29   2.303  -9.118  10.549
  621    H    GLU  30           H        GLU  30   5.375 -11.205   5.364
  622    HA   GLU  30           HA       GLU  30   5.528  -8.735   3.921
  623   1HB   GLU  30          1HB       GLU  30   7.286 -10.524   4.212
  624   2HB   GLU  30          2HB       GLU  30   6.390 -11.511   3.056
  625   1HG   GLU  30          1HG       GLU  30   6.600  -9.047   1.783
  626   2HG   GLU  30          2HG       GLU  30   8.166  -9.243   2.569
  627    H    GLY  31           H        GLY  31   3.785 -11.763   3.293
  628   1HA   GLY  31          2HA       GLY  31   2.329 -12.345   1.525
  629   2HA   GLY  31          1HA       GLY  31   2.934 -10.953   0.626
  630    H    LEU  32           H        LEU  32   1.776 -10.472   3.869
  631    HA   LEU  32           HA       LEU  32  -0.994  -9.956   3.278
  632   1HB   LEU  32          1HB       LEU  32   0.290 -10.384   5.502
  633   2HB   LEU  32          2HB       LEU  32   0.619  -8.652   5.469
  634    HG   LEU  32           HG       LEU  32  -1.878  -8.294   5.182
  635   1HD1  LEU  32          1HD1      LEU  32  -1.854 -11.055   4.786
  636   2HD1  LEU  32          2HD1      LEU  32  -2.534 -10.862   6.403
  637   3HD1  LEU  32          3HD1      LEU  32  -3.286 -10.054   5.027
  638   1HD2  LEU  32          1HD2      LEU  32  -0.416  -9.214   7.567
  639   2HD2  LEU  32          2HD2      LEU  32  -1.445  -7.797   7.358
  640   3HD2  LEU  32          3HD2      LEU  32  -2.168  -9.368   7.704
  641    H    MET  33           H        MET  33   1.928  -8.000   3.067
  642    HA   MET  33           HA       MET  33   0.760  -5.400   2.987
  643   1HB   MET  33          1HB       MET  33   3.244  -6.725   1.925
  644   2HB   MET  33          2HB       MET  33   2.914  -5.039   1.524
  645   1HG   MET  33          1HG       MET  33   3.339  -4.322   3.642
  646   2HG   MET  33          2HG       MET  33   2.546  -5.717   4.374
  647   1HE   MET  33          1HE       MET  33   5.305  -4.890   1.933
  648   2HE   MET  33          2HE       MET  33   5.976  -4.107   3.372
  649   3HE   MET  33          3HE       MET  33   6.790  -5.499   2.661
  650    H    MET  34           H        MET  34   1.943  -7.261   0.157
  651    HA   MET  34           HA       MET  34   0.622  -5.678  -1.806
  652   1HB   MET  34          1HB       MET  34   2.501  -7.277  -2.155
  653   2HB   MET  34          2HB       MET  34   1.391  -8.615  -1.854
  654   1HG   MET  34          2HG       MET  34   1.478  -8.407  -4.223
  655   2HG   MET  34          1HG       MET  34  -0.041  -7.646  -3.750
  656   1HE   MET  34          1HE       MET  34   3.584  -7.307  -4.206
  657   2HE   MET  34          2HE       MET  34   3.897  -5.749  -4.983
  658   3HE   MET  34          3HE       MET  34   3.635  -5.832  -3.242
  659    H    GLN  35           H        GLN  35  -0.493  -8.436   0.102
  660    HA   GLN  35           HA       GLN  35  -2.776  -9.221  -1.354
  661   1HB   GLN  35          1HB       GLN  35  -1.914 -10.396   0.598
  662   2HB   GLN  35          2HB       GLN  35  -2.254  -9.006   1.628
  663   1HG   GLN  35          2HG       GLN  35  -4.280  -9.908   2.026
  664   2HG   GLN  35          1HG       GLN  35  -4.687  -9.561   0.345
  665   2HE2  GLN  35          2HE2      GLN  35  -3.012 -12.081   2.313
  666   1HE2  GLN  35          1HE2      GLN  35  -3.500 -13.379   1.333
  667    H    HIS  36           H        HIS  36  -3.157  -7.292   1.618
  668    HA   HIS  36           HA       HIS  36  -5.675  -6.192   0.890
  669   1HB   HIS  36          1HB       HIS  36  -3.481  -5.577   2.844
  670   2HB   HIS  36          2HB       HIS  36  -4.833  -4.452   2.697
  671    HD1  HIS  36           HD1      HIS  36  -4.477  -6.090   5.294
  672    HD2  HIS  36           HD2      HIS  36  -6.844  -7.324   2.092
  673    HE1  HIS  36           HE1      HIS  36  -6.159  -7.730   6.237
  674    H    ALA  37           H        ALA  37  -2.387  -4.805   0.582
  675    HA   ALA  37           HA       ALA  37  -2.958  -2.232  -0.355
  676   1HB   ALA  37          1HB       ALA  37  -0.718  -3.131   0.097
  677   2HB   ALA  37          3HB       ALA  37  -0.860  -4.229  -1.277
  678   3HB   ALA  37          2HB       ALA  37  -0.776  -2.487  -1.545
  679    H    GLN  38           H        GLN  38  -2.989  -5.299  -2.182
  680    HA   GLN  38           HA       GLN  38  -3.400  -4.235  -4.794
  681   1HB   GLN  38          1HB       GLN  38  -3.669  -6.773  -3.333
  682   2HB   GLN  38          2HB       GLN  38  -4.794  -6.629  -4.684
  683   1HG   GLN  38          1HG       GLN  38  -2.281  -5.639  -5.576
  684   2HG   GLN  38          2HG       GLN  38  -1.978  -7.175  -4.763
  685   2HE2  GLN  38          2HE2      GLN  38  -1.683  -8.489  -6.642
  686   1HE2  GLN  38          1HE2      GLN  38  -2.910  -8.756  -7.785
  687    H    ASN  39           H        ASN  39  -5.643  -4.915  -2.138
  688    HA   ASN  39           HA       ASN  39  -7.983  -4.110  -3.770
  689   1HB   ASN  39          1HB       ASN  39  -7.406  -5.416  -1.151
  690   2HB   ASN  39          2HB       ASN  39  -8.925  -4.526  -1.274
  691   2HD2  ASN  39          2HD2      ASN  39  -7.021  -7.025  -3.044
  692   1HD2  ASN  39          1HD2      ASN  39  -8.381  -7.843  -3.648
  693    H    LEU  40           H        LEU  40  -5.649  -2.299  -2.693
  694    HA   LEU  40           HA       LEU  40  -5.442  -0.113  -1.875
  695   1HB   LEU  40          1HB       LEU  40  -8.309  -0.282  -2.828
  696   2HB   LEU  40          2HB       LEU  40  -7.595   1.231  -2.270
  697    HG   LEU  40           HG       LEU  40  -5.700   0.757  -3.942
  698   1HD1  LEU  40          1HD1      LEU  40  -7.738  -1.330  -4.686
  699   2HD1  LEU  40          2HD1      LEU  40  -6.689  -0.632  -5.920
  700   3HD1  LEU  40          3HD1      LEU  40  -5.988  -1.492  -4.549
  701   1HD2  LEU  40          1HD2      LEU  40  -7.956   2.228  -4.146
  702   2HD2  LEU  40          2HD2      LEU  40  -6.777   2.112  -5.453
  703   3HD2  LEU  40          3HD2      LEU  40  -8.225   1.106  -5.479
  704    H    GLU  41           H        GLU  41  -6.425  -2.358  -0.032
  705    HA   GLU  41           HA       GLU  41  -8.249  -1.214   1.887
  706   1HB   GLU  41          1HB       GLU  41  -6.225  -3.438   1.792
  707   2HB   GLU  41          2HB       GLU  41  -6.976  -3.018   3.332
  708   1HG   GLU  41          1HG       GLU  41  -8.772  -3.344   0.970
  709   2HG   GLU  41          2HG       GLU  41  -8.082  -4.805   1.678
  710    H    PHE  42           H        PHE  42  -4.706  -1.385   1.679
  711    HA   PHE  42           HA       PHE  42  -3.028  -0.224   2.861
  712   1HB   PHE  42          1HB       PHE  42  -5.274   1.680   2.272
  713   2HB   PHE  42          2HB       PHE  42  -3.884   2.256   3.192
  714    HD1  PHE  42           HD1      PHE  42  -1.628   0.784   2.013
  715    HD2  PHE  42           HD2      PHE  42  -5.065   2.570   0.101
  716    HE1  PHE  42           HE1      PHE  42  -0.329   1.026  -0.100
  717    HE2  PHE  42           HE2      PHE  42  -3.763   2.812  -2.011
  718    HZ   PHE  42           HZ       PHE  42  -1.393   2.041  -2.106
  719    H    GLU  43           H        GLU  43  -2.852   1.446   4.834
  720    HA   GLU  43           HA       GLU  43  -3.002   1.806   7.138
  721   1HB   GLU  43          1HB       GLU  43  -5.355   2.308   6.676
  722   2HB   GLU  43          2HB       GLU  43  -5.749   0.592   6.654
  723   1HG   GLU  43          1HG       GLU  43  -4.851   0.471   9.026
  724   2HG   GLU  43          2HG       GLU  43  -4.827   2.235   9.013
  725    H    GLU  44           H        GLU  44  -4.717  -1.215   6.493
  726    HA   GLU  44           HA       GLU  44  -3.273  -2.611   8.638
  727   1HB   GLU  44          1HB       GLU  44  -4.779  -4.441   8.032
  728   2HB   GLU  44          2HB       GLU  44  -5.695  -2.936   8.093
  729   1HG   GLU  44          1HG       GLU  44  -5.577  -2.723   5.659
  730   2HG   GLU  44          2HG       GLU  44  -4.562  -4.162   5.559
  731    H    ALA  45           H        ALA  45  -3.246  -2.454   5.097
  732    HA   ALA  45           HA       ALA  45  -1.409  -4.714   4.793
  733   1HB   ALA  45          1HB       ALA  45  -3.244  -3.471   3.241
  734   2HB   ALA  45          2HB       ALA  45  -1.929  -4.440   2.577
  735   3HB   ALA  45          3HB       ALA  45  -1.779  -2.685   2.656
  736    H    ALA  46           H        ALA  46  -1.118  -1.153   4.564
  737    HA   ALA  46           HA       ALA  46   1.718  -1.270   3.908
  738   1HB   ALA  46          1HB       ALA  46   1.517   1.142   3.971
  739   2HB   ALA  46          3HB       ALA  46   0.061   0.486   3.223
  740   3HB   ALA  46          2HB       ALA  46   0.022   1.034   4.901
  741    H    GLN  47           H        GLN  47  -0.125  -1.044   6.908
  742    HA   GLN  47           HA       GLN  47   1.964   0.020   8.569
  743   1HB   GLN  47          1HB       GLN  47  -0.569  -1.533   8.902
  744   2HB   GLN  47          2HB       GLN  47   0.526  -1.435  10.281
  745   1HG   GLN  47          1HG       GLN  47  -0.283   1.032   8.744
  746   2HG   GLN  47          2HG       GLN  47  -1.264   0.412  10.072
  747   2HE2  GLN  47          2HE2      GLN  47  -0.047   0.112  12.217
  748   1HE2  GLN  47          1HE2      GLN  47   1.199   1.207  12.577
  749    H    ILE  48           H        ILE  48   1.218  -3.252   7.441
  750    HA   ILE  48           HA       ILE  48   2.787  -4.822   9.169
  751    HB   ILE  48           HB       ILE  48   2.337  -4.990   6.170
  752   1HG1  ILE  48          2HG1      ILE  48   0.276  -4.951   7.526
  753   2HG1  ILE  48          1HG1      ILE  48   0.530  -6.552   6.829
  754   1HG2  ILE  48          1HG2      ILE  48   3.837  -6.688   8.040
  755   2HG2  ILE  48          2HG2      ILE  48   2.600  -7.565   7.138
  756   3HG2  ILE  48          3HG2      ILE  48   3.854  -6.672   6.277
  757   1HD1  ILE  48          1HD1      ILE  48   1.916  -6.669   9.235
  758   2HD1  ILE  48          2HD1      ILE  48   0.472  -5.740   9.638
  759   3HD1  ILE  48          3HD1      ILE  48   0.318  -7.350   8.934
  760    H    ARG  49           H        ARG  49   3.779  -2.627   6.617
  761    HA   ARG  49           HA       ARG  49   6.431  -3.463   6.129
  762   1HB   ARG  49          1HB       ARG  49   5.434  -1.747   4.810
  763   2HB   ARG  49          2HB       ARG  49   5.001  -0.799   6.227
  764   1HG   ARG  49          1HG       ARG  49   7.850  -1.187   6.211
  765   2HG   ARG  49          2HG       ARG  49   7.344  -0.577   4.636
  766   1HD   ARG  49          1HD       ARG  49   7.832   1.268   6.266
  767   2HD   ARG  49          2HD       ARG  49   6.144   1.286   5.717
  768    HE   ARG  49           HE       ARG  49   5.556   0.087   7.840
  769   1HH1  ARG  49          1HH1      ARG  49   8.829   0.017   7.961
  770   2HH1  ARG  49          2HH1      ARG  49   9.007   0.847   9.472
  771   1HH2  ARG  49          1HH2      ARG  49   5.690   1.847   9.616
  772   2HH2  ARG  49          2HH2      ARG  49   7.230   1.882  10.409
  773    H    ASP  50           H        ASP  50   5.019  -1.853   8.914
  774    HA   ASP  50           HA       ASP  50   7.565  -1.042  10.099
  775   1HB   ASP  50          1HB       ASP  50   5.094  -0.169  10.380
  776   2HB   ASP  50          2HB       ASP  50   4.986  -1.445  11.594
  777    H    GLN  51           H        GLN  51   5.374  -3.815  10.362
  778    HA   GLN  51           HA       GLN  51   6.810  -5.005  12.621
  779   1HB   GLN  51          1HB       GLN  51   4.773  -6.118  10.663
  780   2HB   GLN  51          2HB       GLN  51   5.218  -6.843  12.208
  781   1HG   GLN  51          1HG       GLN  51   4.379  -4.891  13.410
  782   2HG   GLN  51          2HG       GLN  51   4.025  -4.074  11.888
  783   2HE2  GLN  51          2HE2      GLN  51   3.440  -7.533  12.607
  784   1HE2  GLN  51          1HE2      GLN  51   1.753  -7.444  12.447
  785    H    LEU  52           H        LEU  52   6.651  -5.518   9.097
  786    HA   LEU  52           HA       LEU  52   8.312  -7.847   8.985
  787   1HB   LEU  52          1HB       LEU  52   6.836  -6.272   7.268
  788   2HB   LEU  52          2HB       LEU  52   8.488  -5.930   6.754
  789    HG   LEU  52           HG       LEU  52   7.573  -7.864   5.528
  790   1HD1  LEU  52          1HD1      LEU  52  10.027  -7.686   6.742
  791   2HD1  LEU  52          2HD1      LEU  52   9.461  -9.253   7.321
  792   3HD1  LEU  52          3HD1      LEU  52   9.575  -8.942   5.589
  793   1HD2  LEU  52          1HD2      LEU  52   6.260  -8.452   7.841
  794   2HD2  LEU  52          2HD2      LEU  52   6.521  -9.622   6.547
  795   3HD2  LEU  52          3HD2      LEU  52   7.603  -9.592   7.939
  796    H    HIS  53           H        HIS  53   9.093  -4.367   8.710
  797    HA   HIS  53           HA       HIS  53  11.911  -4.718   8.257
  798   1HB   HIS  53          1HB       HIS  53  10.600  -2.676   7.767
  799   2HB   HIS  53          2HB       HIS  53  10.327  -2.440   9.493
  800    HD1  HIS  53           HD1      HIS  53  12.410  -1.785  10.956
  801    HD2  HIS  53           HD2      HIS  53  13.166  -1.920   6.859
  802    HE1  HIS  53           HE1      HIS  53  14.638  -0.634  10.600
  803    H    GLN  54           H        GLN  54   9.975  -4.252  11.216
  804    HA   GLN  54           HA       GLN  54  12.203  -4.062  13.030
  805   1HB   GLN  54          1HB       GLN  54   9.272  -4.348  13.065
  806   2HB   GLN  54          2HB       GLN  54  10.070  -5.068  14.464
  807   1HG   GLN  54          1HG       GLN  54  11.429  -2.783  14.433
  808   2HG   GLN  54          2HG       GLN  54   9.989  -2.207  13.592
  809   2HE2  GLN  54          2HE2      GLN  54   8.125  -4.009  15.008
  810   1HE2  GLN  54          1HE2      GLN  54   8.010  -3.430  16.600
  811    H    LEU  55           H        LEU  55  10.179  -6.800  11.954
  812    HA   LEU  55           HA       LEU  55  11.417  -8.775  13.650
  813   1HB   LEU  55          1HB       LEU  55   9.619  -8.646  11.274
  814   2HB   LEU  55          2HB       LEU  55  10.407 -10.192  11.591
  815    HG   LEU  55           HG       LEU  55   9.258  -8.872  13.973
  816   1HD1  LEU  55          1HD1      LEU  55   7.693  -8.773  11.703
  817   2HD1  LEU  55          2HD1      LEU  55   7.204 -10.303  12.431
  818   3HD1  LEU  55          3HD1      LEU  55   7.076  -8.806  13.355
  819   1HD2  LEU  55          1HD2      LEU  55  10.295 -11.234  13.681
  820   2HD2  LEU  55          2HD2      LEU  55   8.793 -11.106  14.595
  821   3HD2  LEU  55          3HD2      LEU  55   8.761 -11.657  12.921
  822    H    ARG  56           H        ARG  56  12.345  -7.294  10.634
  823    HA   ARG  56           HA       ARG  56  14.001  -9.275   9.479
  824   1HB   ARG  56          1HB       ARG  56  13.368  -7.122   8.455
  825   2HB   ARG  56          2HB       ARG  56  14.344  -6.263   9.647
  826   1HG   ARG  56          1HG       ARG  56  16.239  -7.909   8.748
  827   2HG   ARG  56          2HG       ARG  56  15.219  -7.906   7.309
  828   1HD   ARG  56          1HD       ARG  56  15.491  -5.589   6.965
  829   2HD   ARG  56          2HD       ARG  56  15.997  -5.309   8.644
  830    HE   ARG  56           HE       ARG  56  17.767  -7.157   7.265
  831   1HH1  ARG  56          1HH1      ARG  56  18.007  -4.594   9.189
  832   2HH1  ARG  56          2HH1      ARG  56  19.132  -3.678   8.242
  833   1HH2  ARG  56          1HH2      ARG  56  18.774  -5.659   5.419
  834   2HH2  ARG  56          2HH2      ARG  56  19.566  -4.281   6.107
  835    H    GLU  57           H        GLU  57  14.924  -6.707  11.808
  836    HA   GLU  57           HA       GLU  57  17.641  -7.507  12.135
  837   1HB   GLU  57          1HB       GLU  57  16.596  -5.353  12.829
  838   2HB   GLU  57          2HB       GLU  57  15.731  -6.208  14.106
  839   1HG   GLU  57          1HG       GLU  57  17.553  -5.612  15.353
  840   2HG   GLU  57          2HG       GLU  57  18.255  -7.050  14.613
  841    H    LEU  58           H        LEU  58  14.665  -8.583  13.743
  842    HA   LEU  58           HA       LEU  58  15.766 -10.049  15.897
  843   1HB   LEU  58          1HB       LEU  58  13.284  -9.713  14.514
  844   2HB   LEU  58          2HB       LEU  58  13.537 -11.441  14.762
  845    HG   LEU  58           HG       LEU  58  13.934  -9.439  16.989
  846   1HD1  LEU  58          1HD1      LEU  58  11.413 -10.818  16.051
  847   2HD1  LEU  58          2HD1      LEU  58  11.613 -10.277  17.718
  848   3HD1  LEU  58          3HD1      LEU  58  11.654  -9.107  16.400
  849   1HD2  LEU  58          1HD2      LEU  58  14.832 -11.864  17.019
  850   2HD2  LEU  58          2HD2      LEU  58  13.865 -11.345  18.399
  851   3HD2  LEU  58          3HD2      LEU  58  13.142 -12.351  17.143
  852    H    PHE  59           H        PHE  59  15.745 -10.753  12.471
  853    HA   PHE  59           HA       PHE  59  16.040 -13.554  12.417
  854   1HB   PHE  59          1HB       PHE  59  15.810 -12.107  10.449
  855   2HB   PHE  59          2HB       PHE  59  17.385 -11.383  10.776
  856    HD1  PHE  59           HD1      PHE  59  19.462 -12.879  10.750
  857    HD2  PHE  59           HD2      PHE  59  15.622 -14.148   9.236
  858    HE1  PHE  59           HE1      PHE  59  20.571 -14.707   9.468
  859    HE2  PHE  59           HE2      PHE  59  16.731 -15.977   7.955
  860    HZ   PHE  59           HZ       PHE  59  19.207 -16.256   8.071
  861    H    ILE  60           H        ILE  60  18.386 -11.058  13.294
  862    HA   ILE  60           HA       ILE  60  20.663 -12.896  13.348
  863    HB   ILE  60           HB       ILE  60  20.253 -10.119  14.505
  864   1HG1  ILE  60          1HG1      ILE  60  21.794 -10.370  12.033
  865   2HG1  ILE  60          2HG1      ILE  60  20.128 -10.916  11.838
  866   1HG2  ILE  60          1HG2      ILE  60  22.660 -11.860  14.005
  867   2HG2  ILE  60          2HG2      ILE  60  22.810 -10.103  14.016
  868   3HG2  ILE  60          3HG2      ILE  60  22.240 -10.948  15.455
  869   1HD1  ILE  60          1HD1      ILE  60  19.773  -8.633  13.308
  870   2HD1  ILE  60          2HD1      ILE  60  21.170  -8.199  12.323
  871   3HD1  ILE  60          3HD1      ILE  60  19.670  -8.707  11.549
  872    H    ALA  61           H        ALA  61  18.266 -11.700  15.636
  873    HA   ALA  61           HA       ALA  61  19.636 -12.462  18.057
  874   1HB   ALA  61          1HB       ALA  61  17.493 -10.979  17.456
  875   2HB   ALA  61          3HB       ALA  61  16.656 -12.488  17.817
  876   3HB   ALA  61          2HB       ALA  61  17.671 -11.728  19.042
  877    H    ALA  62           H        ALA  62  17.859 -14.251  15.653
  878    HA   ALA  62           HA       ALA  62  17.636 -16.614  17.469
  879   1HB   ALA  62          1HB       ALA  62  16.419 -15.815  14.814
  880   2HB   ALA  62          2HB       ALA  62  16.205 -17.423  15.507
  881   3HB   ALA  62          3HB       ALA  62  15.596 -16.006  16.361
  882    H    SER  63           H        SER  63  18.375 -16.112  13.994
  883    HA   SER  63           HA       SER  63  20.186 -18.454  14.051
  884   1HB   SER  63          1HB       SER  63  18.481 -18.032  12.263
  885   2HB   SER  63          2HB       SER  63  19.365 -16.577  11.811
  886    HG   SER  63           HG       SER  63  19.826 -19.114  11.111

  No H/Q in entry =         886
  Start of MODEL   16
    1    H    LEU   8           H        LEU   8 -29.114  -1.700 -19.558
    2    HA   LEU   8           HA       LEU   8 -28.456  -1.114 -21.803
    3   1HB   LEU   8          1HB       LEU   8 -30.103  -3.026 -22.366
    4   2HB   LEU   8          2HB       LEU   8 -31.303  -1.753 -22.588
    5    HG   LEU   8           HG       LEU   8 -29.414  -0.668 -24.088
    6   1HD1  LEU   8          1HD1      LEU   8 -27.868  -2.626 -23.373
    7   2HD1  LEU   8          2HD1      LEU   8 -28.799  -3.588 -24.520
    8   3HD1  LEU   8          3HD1      LEU   8 -27.898  -2.180 -25.079
    9   1HD2  LEU   8          1HD2      LEU   8 -31.734  -1.665 -24.699
   10   2HD2  LEU   8          2HD2      LEU   8 -30.533  -1.533 -25.983
   11   3HD2  LEU   8          3HD2      LEU   8 -30.827  -3.089 -25.208
   12    H    GLU   9           H        GLU   9 -28.839   0.888 -20.157
   13    HA   GLU   9           HA       GLU   9 -30.302   2.906 -21.736
   14   1HB   GLU   9          1HB       GLU   9 -31.816   1.612 -20.019
   15   2HB   GLU   9          2HB       GLU   9 -31.000   2.619 -18.822
   16   1HG   GLU   9          1HG       GLU   9 -31.631   4.632 -20.216
   17   2HG   GLU   9          2HG       GLU   9 -32.625   3.556 -21.200
   18    HA   PRO  10           HA       PRO  10 -26.511   4.333 -19.443
   19   1HB   PRO  10          1HB       PRO  10 -25.229   5.387 -21.619
   20   2HB   PRO  10          2HB       PRO  10 -25.064   3.689 -21.130
   21   1HG   PRO  10          2HG       PRO  10 -26.729   4.884 -23.285
   22   2HG   PRO  10          1HG       PRO  10 -25.825   3.361 -23.269
   23   1HD   PRO  10          1HD       PRO  10 -28.528   3.523 -22.912
   24   2HD   PRO  10          2HD       PRO  10 -27.522   2.215 -22.251
   25    H    ASP  11           H        ASP  11 -28.007   6.002 -22.240
   26    HA   ASP  11           HA       ASP  11 -28.865   8.189 -22.450
   27   1HB   ASP  11          1HB       ASP  11 -29.399   7.214 -19.778
   28   2HB   ASP  11          2HB       ASP  11 -29.146   8.959 -19.743
   29    H    ASN  12           H        ASN  12 -27.262   8.718 -19.327
   30    HA   ASN  12           HA       ASN  12 -25.158  10.331 -20.718
   31   1HB   ASN  12          1HB       ASN  12 -25.592  12.104 -19.001
   32   2HB   ASN  12          2HB       ASN  12 -26.984  11.814 -20.045
   33   2HD2  ASN  12          2HD2      ASN  12 -25.818  11.625 -16.753
   34   1HD2  ASN  12          1HD2      ASN  12 -27.258  11.045 -16.067
   35    H    VAL  13           H        VAL  13 -25.390   7.679 -19.094
   36    HA   VAL  13           HA       VAL  13 -23.855   8.214 -16.668
   37    HB   VAL  13           HB       VAL  13 -25.062   5.891 -18.112
   38   1HG1  VAL  13          1HG1      VAL  13 -22.718   5.683 -16.232
   39   2HG1  VAL  13          2HG1      VAL  13 -23.957   4.429 -16.245
   40   3HG1  VAL  13          3HG1      VAL  13 -23.035   4.772 -17.709
   41   1HG2  VAL  13          1HG2      VAL  13 -26.152   7.289 -16.296
   42   2HG2  VAL  13          2HG2      VAL  13 -26.143   5.549 -16.007
   43   3HG2  VAL  13          3HG2      VAL  13 -24.988   6.587 -15.173
   44    HA   PRO  14           HA       PRO  14 -20.284   6.474 -19.244
   45   1HB   PRO  14          1HB       PRO  14 -20.662   5.876 -21.879
   46   2HB   PRO  14          2HB       PRO  14 -21.011   4.722 -20.578
   47   1HG   PRO  14          2HG       PRO  14 -22.859   6.283 -22.252
   48   2HG   PRO  14          1HG       PRO  14 -23.110   4.744 -21.417
   49   1HD   PRO  14          1HD       PRO  14 -24.003   7.291 -20.587
   50   2HD   PRO  14          2HD       PRO  14 -24.053   5.782 -19.666
   51    H    MET  15           H        MET  15 -22.433   8.302 -21.426
   52    HA   MET  15           HA       MET  15 -20.402   9.799 -22.750
   53   1HB   MET  15          1HB       MET  15 -22.966   9.396 -23.178
   54   2HB   MET  15          2HB       MET  15 -23.162  10.851 -22.200
   55   1HG   MET  15          1HG       MET  15 -22.377  12.199 -23.846
   56   2HG   MET  15          2HG       MET  15 -21.067  11.090 -24.247
   57   1HE   MET  15          1HE       MET  15 -24.734  11.924 -24.421
   58   2HE   MET  15          2HE       MET  15 -25.428  10.867 -25.658
   59   3HE   MET  15          3HE       MET  15 -24.954  10.206 -24.095
   60    H    ASP  16           H        ASP  16 -19.169  11.475 -21.985
   61    HA   ASP  16           HA       ASP  16 -18.382  13.160 -20.525
   62   1HB   ASP  16          1HB       ASP  16 -20.757  13.852 -21.541
   63   2HB   ASP  16          2HB       ASP  16 -21.232  13.762 -19.844
   64    H    MET  17           H        MET  17 -18.583  10.564 -19.322
   65    HA   MET  17           HA       MET  17 -20.004  10.432 -16.875
   66   1HB   MET  17          2HB       MET  17 -18.272   8.759 -16.305
   67   2HB   MET  17          1HB       MET  17 -18.780   8.584 -17.985
   68   1HG   MET  17          1HG       MET  17 -16.805  10.191 -18.515
   69   2HG   MET  17          2HG       MET  17 -16.226   9.760 -16.906
   70   1HE   MET  17          1HE       MET  17 -16.318   7.485 -16.038
   71   2HE   MET  17          2HE       MET  17 -17.456   6.486 -16.937
   72   3HE   MET  17          3HE       MET  17 -15.740   6.061 -16.899
   73    H    SER  18           H        SER  18 -17.188  12.292 -17.757
   74    HA   SER  18           HA       SER  18 -17.190  13.571 -15.083
   75   1HB   SER  18          1HB       SER  18 -14.819  12.136 -16.320
   76   2HB   SER  18          2HB       SER  18 -14.733  13.142 -14.876
   77    HG   SER  18           HG       SER  18 -15.004  10.955 -14.329
   78    HA   PRO  19           HA       PRO  19 -15.904  16.976 -17.568
   79   1HB   PRO  19          1HB       PRO  19 -14.563  18.525 -15.764
   80   2HB   PRO  19          2HB       PRO  19 -16.320  18.285 -15.717
   81   1HG   PRO  19          2HG       PRO  19 -14.237  17.199 -13.962
   82   2HG   PRO  19          1HG       PRO  19 -15.963  17.429 -13.660
   83   1HD   PRO  19          1HD       PRO  19 -14.618  15.005 -14.321
   84   2HD   PRO  19          2HD       PRO  19 -16.363  15.256 -14.105
   85    H    LYS  20           H        LYS  20 -13.842  14.647 -17.247
   86    HA   LYS  20           HA       LYS  20 -11.702  14.212 -18.137
   87   1HB   LYS  20          1HB       LYS  20 -12.695  15.958 -19.785
   88   2HB   LYS  20          2HB       LYS  20 -11.636  17.112 -18.974
   89   1HG   LYS  20          1HG       LYS  20 -10.613  14.489 -20.074
   90   2HG   LYS  20          2HG       LYS  20 -10.668  15.961 -21.047
   91   1HD   LYS  20          1HD       LYS  20  -9.479  16.944 -18.831
   92   2HD   LYS  20          2HD       LYS  20  -8.910  15.275 -18.749
   93   1HE   LYS  20          1HE       LYS  20  -8.695  16.163 -21.472
   94   2HE   LYS  20          2HE       LYS  20  -7.910  17.355 -20.417
   95   1HZ   LYS  20          1HZ       LYS  20  -6.854  15.460 -19.244
   96   2HZ   LYS  20          2HZ       LYS  20  -7.466  14.418 -20.438
   97   3HZ   LYS  20          3HZ       LYS  20  -6.345  15.620 -20.857
   98    H    ALA  21           H        ALA  21 -11.469  17.643 -17.094
   99    HA   ALA  21           HA       ALA  21  -8.892  17.616 -16.035
  100   1HB   ALA  21          1HB       ALA  21 -10.143  19.645 -16.199
  101   2HB   ALA  21          3HB       ALA  21 -11.443  19.008 -15.191
  102   3HB   ALA  21          2HB       ALA  21  -9.881  19.402 -14.471
  103    H    LEU  22           H        LEU  22 -11.895  16.899 -14.212
  104    HA   LEU  22           HA       LEU  22 -10.529  16.111 -11.792
  105   1HB   LEU  22          1HB       LEU  22 -12.785  16.824 -11.626
  106   2HB   LEU  22          2HB       LEU  22 -13.291  15.825 -12.984
  107    HG   LEU  22           HG       LEU  22 -13.159  13.820 -11.684
  108   1HD1  LEU  22          1HD1      LEU  22 -11.713  15.556  -9.675
  109   2HD1  LEU  22          2HD1      LEU  22 -12.395  13.986  -9.244
  110   3HD1  LEU  22          3HD1      LEU  22 -11.131  14.093 -10.470
  111   1HD2  LEU  22          1HD2      LEU  22 -15.130  15.303 -11.257
  112   2HD2  LEU  22          2HD2      LEU  22 -14.732  14.276  -9.879
  113   3HD2  LEU  22          3HD2      LEU  22 -14.276  15.980  -9.870
  114    H    GLN  23           H        GLN  23 -12.279  14.157 -14.221
  115    HA   GLN  23           HA       GLN  23 -11.667  11.576 -13.405
  116   1HB   GLN  23          1HB       GLN  23 -12.943  12.647 -15.466
  117   2HB   GLN  23          2HB       GLN  23 -11.420  12.336 -16.300
  118   1HG   GLN  23          1HG       GLN  23 -11.540   9.958 -15.490
  119   2HG   GLN  23          2HG       GLN  23 -13.155  10.305 -14.869
  120   2HE2  GLN  23          2HE2      GLN  23 -11.554  11.290 -17.951
  121   1HE2  GLN  23          1HE2      GLN  23 -12.761  10.643 -18.953
  122    H    GLN  24           H        GLN  24  -9.673  13.524 -15.662
  123    HA   GLN  24           HA       GLN  24  -7.520  11.693 -15.927
  124   1HB   GLN  24          1HB       GLN  24  -8.214  14.069 -16.986
  125   2HB   GLN  24          2HB       GLN  24  -6.990  14.628 -15.846
  126   1HG   GLN  24          1HG       GLN  24  -6.061  12.256 -17.214
  127   2HG   GLN  24          2HG       GLN  24  -6.546  13.482 -18.385
  128   2HE2  GLN  24          2HE2      GLN  24  -3.998  12.523 -16.330
  129   1HE2  GLN  24          1HE2      GLN  24  -3.109  13.969 -16.363
  130    H    LYS  25           H        LYS  25  -8.194  14.123 -13.434
  131    HA   LYS  25           HA       LYS  25  -5.621  13.979 -12.128
  132   1HB   LYS  25          1HB       LYS  25  -8.224  15.237 -11.832
  133   2HB   LYS  25          2HB       LYS  25  -7.609  14.697 -10.270
  134   1HG   LYS  25          2HG       LYS  25  -6.647  16.821 -10.456
  135   2HG   LYS  25          1HG       LYS  25  -5.363  15.783 -11.077
  136   1HD   LYS  25          1HD       LYS  25  -6.425  16.160 -13.396
  137   2HD   LYS  25          2HD       LYS  25  -7.309  17.485 -12.637
  138   1HE   LYS  25          1HE       LYS  25  -4.977  18.272 -11.785
  139   2HE   LYS  25          2HE       LYS  25  -4.331  17.207 -13.049
  140   1HZ   LYS  25          1HZ       LYS  25  -6.412  19.289 -13.470
  141   2HZ   LYS  25          2HZ       LYS  25  -4.774  19.457 -13.888
  142   3HZ   LYS  25          3HZ       LYS  25  -5.732  18.294 -14.667
  143    H    ILE  26           H        ILE  26  -8.799  12.528 -11.300
  144    HA   ILE  26           HA       ILE  26  -8.018  11.029  -9.050
  145    HB   ILE  26           HB       ILE  26  -9.980  10.407 -11.282
  146   1HG1  ILE  26          1HG1      ILE  26 -10.665  11.501  -8.567
  147   2HG1  ILE  26          2HG1      ILE  26 -10.073  12.595  -9.818
  148   1HG2  ILE  26          1HG2      ILE  26  -9.142   8.770  -9.136
  149   2HG2  ILE  26          2HG2      ILE  26 -10.715   9.418  -8.670
  150   3HG2  ILE  26          3HG2      ILE  26 -10.542   8.525 -10.181
  151   1HD1  ILE  26          1HD1      ILE  26 -12.238  10.664 -10.545
  152   2HD1  ILE  26          2HD1      ILE  26 -12.671  12.072  -9.576
  153   3HD1  ILE  26          3HD1      ILE  26 -11.931  12.287 -11.163
  154    H    HIS  27           H        HIS  27  -8.184   9.839 -12.436
  155    HA   HIS  27           HA       HIS  27  -6.992   7.304 -11.967
  156   1HB   HIS  27          1HB       HIS  27  -8.160   8.533 -14.035
  157   2HB   HIS  27          2HB       HIS  27  -6.482   8.808 -14.501
  158    HD1  HIS  27           HD1      HIS  27  -5.458   6.050 -13.215
  159    HD2  HIS  27           HD2      HIS  27  -8.565   6.480 -15.961
  160    HE1  HIS  27           HE1      HIS  27  -5.706   3.811 -14.372
  161    H    GLU  28           H        GLU  28  -5.563  10.487 -12.216
  162    HA   GLU  28           HA       GLU  28  -2.852   9.582 -12.785
  163   1HB   GLU  28          1HB       GLU  28  -4.339  12.072 -12.201
  164   2HB   GLU  28          2HB       GLU  28  -2.648  12.086 -11.698
  165   1HG   GLU  28          1HG       GLU  28  -3.420  11.112 -14.442
  166   2HG   GLU  28          2HG       GLU  28  -3.217  12.836 -14.125
  167    H    LEU  29           H        LEU  29  -4.487  10.818  -9.841
  168    HA   LEU  29           HA       LEU  29  -2.232  10.345  -8.099
  169   1HB   LEU  29          1HB       LEU  29  -5.201  10.805  -7.745
  170   2HB   LEU  29          2HB       LEU  29  -4.122  10.606  -6.365
  171    HG   LEU  29           HG       LEU  29  -3.591  12.624  -8.553
  172   1HD1  LEU  29          1HD1      LEU  29  -5.813  12.993  -7.383
  173   2HD1  LEU  29          2HD1      LEU  29  -4.905  13.170  -5.880
  174   3HD1  LEU  29          3HD1      LEU  29  -4.651  14.308  -7.204
  175   1HD2  LEU  29          1HD2      LEU  29  -1.987  11.651  -6.545
  176   2HD2  LEU  29          2HD2      LEU  29  -1.808  13.245  -7.278
  177   3HD2  LEU  29          3HD2      LEU  29  -2.707  13.064  -5.773
  178    H    GLU  30           H        GLU  30  -5.139   8.457  -8.922
  179    HA   GLU  30           HA       GLU  30  -4.841   6.374  -7.002
  180   1HB   GLU  30          1HB       GLU  30  -6.708   7.020  -8.737
  181   2HB   GLU  30          2HB       GLU  30  -5.830   5.929  -9.810
  182   1HG   GLU  30          1HG       GLU  30  -5.926   4.364  -7.629
  183   2HG   GLU  30          2HG       GLU  30  -7.383   5.316  -7.343
  184    H    GLY  31           H        GLY  31  -3.700   6.516 -10.401
  185   1HA   GLY  31          2HA       GLY  31  -1.988   5.323 -11.475
  186   2HA   GLY  31          1HA       GLY  31  -2.344   4.005 -10.357
  187    H    LEU  32           H        LEU  32  -1.343   7.251  -9.383
  188    HA   LEU  32           HA       LEU  32   1.462   6.592  -9.022
  189   1HB   LEU  32          1HB       LEU  32   0.179   8.859  -9.323
  190   2HB   LEU  32          2HB       LEU  32  -0.039   8.767  -7.575
  191    HG   LEU  32           HG       LEU  32   2.514   8.332  -7.485
  192   1HD1  LEU  32          1HD1      LEU  32   2.226   9.551 -10.250
  193   2HD1  LEU  32          2HD1      LEU  32   3.751   9.335  -9.389
  194   3HD1  LEU  32          3HD1      LEU  32   2.815   7.927  -9.891
  195   1HD2  LEU  32          1HD2      LEU  32   1.378  10.427  -6.753
  196   2HD2  LEU  32          2HD2      LEU  32   2.961  10.743  -7.462
  197   3HD2  LEU  32          3HD2      LEU  32   1.499  11.043  -8.400
  198    H    MET  33           H        MET  33  -1.429   6.310  -7.053
  199    HA   MET  33           HA       MET  33  -0.002   5.954  -4.523
  200   1HB   MET  33          1HB       MET  33  -2.234   6.895  -4.584
  201   2HB   MET  33          2HB       MET  33  -2.846   5.504  -5.478
  202   1HG   MET  33          1HG       MET  33  -1.514   4.890  -2.900
  203   2HG   MET  33          2HG       MET  33  -3.055   5.741  -2.785
  204   1HE   MET  33          1HE       MET  33  -5.074   5.172  -4.038
  205   2HE   MET  33          2HE       MET  33  -5.704   3.528  -3.996
  206   3HE   MET  33          3HE       MET  33  -5.216   4.316  -2.498
  207    H    MET  34           H        MET  34  -1.161   3.879  -7.118
  208    HA   MET  34           HA       MET  34  -0.986   1.399  -5.583
  209   1HB   MET  34          1HB       MET  34  -1.334   2.202  -8.473
  210   2HB   MET  34          2HB       MET  34  -1.152   0.507  -8.022
  211   1HG   MET  34          1HG       MET  34  -3.071   1.898  -6.314
  212   2HG   MET  34          2HG       MET  34  -3.535   1.948  -8.015
  213   1HE   MET  34          1HE       MET  34  -3.100   0.449  -4.937
  214   2HE   MET  34          2HE       MET  34  -4.652  -0.386  -5.091
  215   3HE   MET  34          3HE       MET  34  -3.153  -1.309  -5.033
  216    H    GLN  35           H        GLN  35   1.008   2.896  -8.164
  217    HA   GLN  35           HA       GLN  35   3.025   0.962  -8.389
  218   1HB   GLN  35          1HB       GLN  35   4.400   2.876  -9.147
  219   2HB   GLN  35          2HB       GLN  35   2.755   2.988  -9.777
  220   1HG   GLN  35          1HG       GLN  35   2.159   4.535  -7.947
  221   2HG   GLN  35          2HG       GLN  35   3.809   4.435  -7.329
  222   2HE2  GLN  35          2HE2      GLN  35   2.443   4.864 -10.650
  223   1HE2  GLN  35          1HE2      GLN  35   3.377   6.234 -11.012
  224    H    HIS  36           H        HIS  36   2.580   3.414  -5.871
  225    HA   HIS  36           HA       HIS  36   5.177   2.966  -4.622
  226   1HB   HIS  36          1HB       HIS  36   2.589   4.293  -3.766
  227   2HB   HIS  36          2HB       HIS  36   4.079   4.362  -2.823
  228    HD1  HIS  36           HD1      HIS  36   5.592   4.408  -5.859
  229    HD2  HIS  36           HD2      HIS  36   3.061   7.203  -4.082
  230    HE1  HIS  36           HE1      HIS  36   6.048   6.619  -7.007
  231    H    ALA  37           H        ALA  37   1.869   2.346  -3.369
  232    HA   ALA  37           HA       ALA  37   2.470   0.702  -1.196
  233   1HB   ALA  37          1HB       ALA  37   0.191  -0.417  -2.140
  234   2HB   ALA  37          2HB       ALA  37   0.224   1.178  -1.386
  235   3HB   ALA  37          3HB       ALA  37   0.237   1.033  -3.144
  236    H    GLN  38           H        GLN  38   2.306  -0.180  -4.640
  237    HA   GLN  38           HA       GLN  38   2.626  -3.033  -4.251
  238   1HB   GLN  38          1HB       GLN  38   2.692  -1.024  -6.453
  239   2HB   GLN  38          2HB       GLN  38   3.497  -2.561  -6.768
  240   1HG   GLN  38          1HG       GLN  38   1.220  -3.489  -5.662
  241   2HG   GLN  38          2HG       GLN  38   0.608  -1.986  -6.356
  242   2HE2  GLN  38          2HE2      GLN  38   2.217  -5.061  -7.182
  243   1HE2  GLN  38          1HE2      GLN  38   1.848  -4.999  -8.838
  244    H    ASN  39           H        ASN  39   4.830  -0.300  -4.691
  245    HA   ASN  39           HA       ASN  39   7.200  -2.087  -4.729
  246   1HB   ASN  39          1HB       ASN  39   6.508   0.743  -5.335
  247   2HB   ASN  39          2HB       ASN  39   8.144   0.459  -4.741
  248   2HD2  ASN  39          2HD2      ASN  39   6.358   0.579  -7.574
  249   1HD2  ASN  39          1HD2      ASN  39   7.343  -0.397  -8.552
  250    H    LEU  40           H        LEU  40   5.307  -1.507  -2.327
  251    HA   LEU  40           HA       LEU  40   5.542  -1.267  -0.010
  252   1HB   LEU  40          1HB       LEU  40   8.049  -2.307  -1.121
  253   2HB   LEU  40          2HB       LEU  40   8.277  -1.482   0.421
  254    HG   LEU  40           HG       LEU  40   5.906  -3.148   0.493
  255   1HD1  LEU  40          1HD1      LEU  40   8.484  -4.352  -0.484
  256   2HD1  LEU  40          2HD1      LEU  40   7.405  -5.294   0.544
  257   3HD1  LEU  40          3HD1      LEU  40   6.834  -4.686  -1.010
  258   1HD2  LEU  40          1HD2      LEU  40   8.432  -2.704   2.031
  259   2HD2  LEU  40          2HD2      LEU  40   6.757  -2.621   2.580
  260   3HD2  LEU  40          3HD2      LEU  40   7.532  -4.189   2.342
  261    H    GLU  41           H        GLU  41   5.936   1.120  -1.885
  262    HA   GLU  41           HA       GLU  41   7.866   2.886  -0.636
  263   1HB   GLU  41          1HB       GLU  41   5.854   2.882  -2.741
  264   2HB   GLU  41          2HB       GLU  41   5.816   4.394  -1.833
  265   1HG   GLU  41          1HG       GLU  41   8.369   3.178  -2.918
  266   2HG   GLU  41          2HG       GLU  41   7.419   4.374  -3.798
  267    H    PHE  42           H        PHE  42   4.320   2.571  -0.413
  268    HA   PHE  42           HA       PHE  42   2.807   3.341   1.222
  269   1HB   PHE  42          1HB       PHE  42   5.247   2.247   2.546
  270   2HB   PHE  42          2HB       PHE  42   4.068   3.060   3.575
  271    HD1  PHE  42           HD1      PHE  42   1.490   2.454   2.454
  272    HD2  PHE  42           HD2      PHE  42   4.975  -0.081   2.729
  273    HE1  PHE  42           HE1      PHE  42   0.028   0.438   2.383
  274    HE2  PHE  42           HE2      PHE  42   3.512  -2.098   2.659
  275    HZ   PHE  42           HZ       PHE  42   1.037  -1.836   2.487
  276    H    GLU  43           H        GLU  43   2.815   4.822   3.333
  277    HA   GLU  43           HA       GLU  43   3.017   6.958   4.260
  278   1HB   GLU  43          1HB       GLU  43   5.403   6.440   4.394
  279   2HB   GLU  43          2HB       GLU  43   5.623   6.852   2.696
  280   1HG   GLU  43          1HG       GLU  43   4.722   9.162   3.266
  281   2HG   GLU  43          2HG       GLU  43   4.901   8.709   4.962
  282    H    GLU  44           H        GLU  44   4.393   7.138   1.006
  283    HA   GLU  44           HA       GLU  44   2.845   9.552   0.370
  284   1HB   GLU  44          2HB       GLU  44   4.124   9.436  -1.716
  285   2HB   GLU  44          1HB       GLU  44   5.203   9.132  -0.356
  286   1HG   GLU  44          1HG       GLU  44   5.089   6.728  -0.742
  287   2HG   GLU  44          2HG       GLU  44   3.888   6.957  -2.012
  288    H    ALA  45           H        ALA  45   2.704   6.085  -0.261
  289    HA   ALA  45           HA       ALA  45   0.688   6.294  -2.372
  290   1HB   ALA  45          1HB       ALA  45   1.143   3.797  -0.812
  291   2HB   ALA  45          3HB       ALA  45   2.536   4.475  -1.654
  292   3HB   ALA  45          2HB       ALA  45   1.088   4.034  -2.558
  293    H    ALA  46           H        ALA  46   0.650   5.224   1.052
  294    HA   ALA  46           HA       ALA  46  -2.182   4.702   1.103
  295   1HB   ALA  46          1HB       ALA  46  -0.494   5.447   3.483
  296   2HB   ALA  46          3HB       ALA  46  -0.214   3.935   2.615
  297   3HB   ALA  46          2HB       ALA  46  -1.777   4.240   3.373
  298    H    GLN  47           H        GLN  47  -0.343   7.644   1.341
  299    HA   GLN  47           HA       GLN  47  -2.402   9.156   2.777
  300   1HB   GLN  47          1HB       GLN  47   0.293   9.481   1.737
  301   2HB   GLN  47          2HB       GLN  47  -0.699  10.888   1.372
  302   1HG   GLN  47          1HG       GLN  47   0.440  11.088   3.580
  303   2HG   GLN  47          2HG       GLN  47  -1.317  11.114   3.726
  304   2HE2  GLN  47          2HE2      GLN  47  -2.037   9.817   5.412
  305   1HE2  GLN  47          1HE2      GLN  47  -1.292   8.384   5.933
  306    H    ILE  48           H        ILE  48  -1.210   9.100  -0.612
  307    HA   ILE  48           HA       ILE  48  -3.017  10.912  -1.775
  308    HB   ILE  48           HB       ILE  48  -1.865   8.291  -2.792
  309   1HG1  ILE  48          1HG1      ILE  48  -0.954  11.156  -3.210
  310   2HG1  ILE  48          2HG1      ILE  48  -0.259  10.063  -2.013
  311   1HG2  ILE  48          1HG2      ILE  48  -3.492  10.425  -4.105
  312   2HG2  ILE  48          2HG2      ILE  48  -2.153   9.737  -5.023
  313   3HG2  ILE  48          3HG2      ILE  48  -3.444   8.693  -4.429
  314   1HD1  ILE  48          1HD1      ILE  48  -0.412   8.801  -4.629
  315   2HD1  ILE  48          2HD1      ILE  48   0.517  10.299  -4.693
  316   3HD1  ILE  48          3HD1      ILE  48   0.986   9.017  -3.576
  317    H    ARG  49           H        ARG  49  -3.514   7.594  -0.727
  318    HA   ARG  49           HA       ARG  49  -5.966   6.974  -1.999
  319   1HB   ARG  49          1HB       ARG  49  -4.799   5.285  -0.817
  320   2HB   ARG  49          2HB       ARG  49  -4.620   6.286   0.618
  321   1HG   ARG  49          1HG       ARG  49  -7.427   5.920   0.043
  322   2HG   ARG  49          2HG       ARG  49  -6.622   4.353   0.108
  323   1HD   ARG  49          1HD       ARG  49  -7.431   5.118   2.362
  324   2HD   ARG  49          2HD       ARG  49  -5.671   4.899   2.311
  325    HE   ARG  49           HE       ARG  49  -5.503   7.387   1.924
  326   1HH1  ARG  49          1HH1      ARG  49  -8.740   6.958   1.810
  327   2HH1  ARG  49          2HH1      ARG  49  -9.148   7.991   3.140
  328   1HH2  ARG  49          1HH2      ARG  49  -5.874   8.311   4.237
  329   2HH2  ARG  49          2HH2      ARG  49  -7.524   8.758   4.514
  330    H    ASP  50           H        ASP  50  -5.223   9.213   0.582
  331    HA   ASP  50           HA       ASP  50  -7.972   9.471   1.554
  332   1HB   ASP  50          1HB       ASP  50  -5.739   9.873   2.778
  333   2HB   ASP  50          2HB       ASP  50  -5.664  11.397   1.894
  334    H    GLN  51           H        GLN  51  -5.849  11.180  -0.717
  335    HA   GLN  51           HA       GLN  51  -7.588  13.444  -1.157
  336   1HB   GLN  51          2HB       GLN  51  -5.468  12.144  -2.904
  337   2HB   GLN  51          1HB       GLN  51  -6.083  13.788  -3.086
  338   1HG   GLN  51          1HG       GLN  51  -5.101  14.509  -1.065
  339   2HG   GLN  51          2HG       GLN  51  -4.890  12.860  -0.477
  340   2HE2  GLN  51          2HE2      GLN  51  -4.084  13.857  -3.796
  341   1HE2  GLN  51          1HE2      GLN  51  -2.407  13.648  -3.631
  342    H    LEU  52           H        LEU  52  -7.164  10.311  -2.813
  343    HA   LEU  52           HA       LEU  52  -8.856  10.708  -5.036
  344   1HB   LEU  52          1HB       LEU  52  -7.663   8.536  -3.503
  345   2HB   LEU  52          2HB       LEU  52  -9.239   8.075  -4.149
  346    HG   LEU  52           HG       LEU  52  -7.435   7.566  -5.761
  347   1HD1  LEU  52          1HD1      LEU  52  -9.687   9.372  -6.260
  348   2HD1  LEU  52          2HD1      LEU  52  -8.419   9.507  -7.478
  349   3HD1  LEU  52          3HD1      LEU  52  -9.174   7.946  -7.159
  350   1HD2  LEU  52          1HD2      LEU  52  -6.012   9.538  -4.916
  351   2HD2  LEU  52          2HD2      LEU  52  -6.019   9.256  -6.657
  352   3HD2  LEU  52          3HD2      LEU  52  -6.999  10.551  -5.969
  353    H    HIS  53           H        HIS  53  -9.669   9.833  -1.686
  354    HA   HIS  53           HA       HIS  53 -12.455   9.290  -2.112
  355   1HB   HIS  53          1HB       HIS  53 -10.541   9.682   0.064
  356   2HB   HIS  53          2HB       HIS  53 -12.142  10.299   0.471
  357    HD1  HIS  53           HD1      HIS  53 -12.741   8.360   2.063
  358    HD2  HIS  53           HD2      HIS  53 -11.760   7.091  -1.784
  359    HE1  HIS  53           HE1      HIS  53 -13.400   5.919   1.926
  360    H    GLN  54           H        GLN  54 -10.857  12.235  -0.819
  361    HA   GLN  54           HA       GLN  54 -13.163  13.882  -0.710
  362   1HB   GLN  54          1HB       GLN  54 -10.198  14.306  -1.029
  363   2HB   GLN  54          2HB       GLN  54 -11.291  15.690  -1.050
  364   1HG   GLN  54          1HG       GLN  54 -12.121  14.085   1.119
  365   2HG   GLN  54          2HG       GLN  54 -10.361  14.157   1.214
  366   2HE2  GLN  54          2HE2      GLN  54 -10.249  15.669   2.979
  367   1HE2  GLN  54          1HE2      GLN  54 -10.788  17.272   2.842
  368    H    LEU  55           H        LEU  55 -10.863  13.313  -3.377
  369    HA   LEU  55           HA       LEU  55 -11.800  15.223  -5.232
  370   1HB   LEU  55          1HB       LEU  55 -10.394  12.608  -5.248
  371   2HB   LEU  55          2HB       LEU  55 -11.100  13.103  -6.787
  372    HG   LEU  55           HG       LEU  55  -9.726  15.300  -5.432
  373   1HD1  LEU  55          1HD1      LEU  55  -8.389  12.677  -5.699
  374   2HD1  LEU  55          2HD1      LEU  55  -7.497  14.036  -6.385
  375   3HD1  LEU  55          3HD1      LEU  55  -7.968  14.057  -4.685
  376   1HD2  LEU  55          1HD2      LEU  55  -9.654  13.970  -8.148
  377   2HD2  LEU  55          2HD2      LEU  55 -10.345  15.536  -7.725
  378   3HD2  LEU  55          3HD2      LEU  55  -8.595  15.318  -7.737
  379    H    ARG  56           H        ARG  56 -13.198  12.146  -4.244
  380    HA   ARG  56           HA       ARG  56 -14.996  11.680  -6.392
  381   1HB   ARG  56          1HB       ARG  56 -14.421  10.193  -4.438
  382   2HB   ARG  56          2HB       ARG  56 -15.438  11.218  -3.425
  383   1HG   ARG  56          1HG       ARG  56 -17.258  10.774  -5.256
  384   2HG   ARG  56          2HG       ARG  56 -16.244   9.392  -5.673
  385   1HD   ARG  56          1HD       ARG  56 -16.321   8.715  -3.225
  386   2HD   ARG  56          2HD       ARG  56 -17.565   9.961  -3.002
  387    HE   ARG  56           HE       ARG  56 -18.449   8.564  -5.218
  388   1HH1  ARG  56          1HH1      ARG  56 -18.764   8.401  -1.926
  389   2HH1  ARG  56          2HH1      ARG  56 -19.227   6.734  -1.853
  390   1HH2  ARG  56          1HH2      ARG  56 -18.490   6.109  -5.183
  391   2HH2  ARG  56          2HH2      ARG  56 -19.072   5.437  -3.698
  392    H    GLU  57           H        GLU  57 -15.840  13.171  -3.237
  393    HA   GLU  57           HA       GLU  57 -18.373  14.179  -4.014
  394   1HB   GLU  57          1HB       GLU  57 -18.008  15.683  -2.039
  395   2HB   GLU  57          2HB       GLU  57 -17.595  14.002  -1.704
  396   1HG   GLU  57          1HG       GLU  57 -15.282  14.420  -1.795
  397   2HG   GLU  57          2HG       GLU  57 -15.497  15.926  -2.688
  398    H    LEU  58           H        LEU  58 -15.154  15.353  -4.685
  399    HA   LEU  58           HA       LEU  58 -15.732  18.099  -5.242
  400   1HB   LEU  58          1HB       LEU  58 -13.537  16.525  -5.106
  401   2HB   LEU  58          2HB       LEU  58 -13.712  16.625  -6.858
  402    HG   LEU  58           HG       LEU  58 -14.041  19.188  -5.419
  403   1HD1  LEU  58          1HD1      LEU  58 -12.184  18.057  -4.160
  404   2HD1  LEU  58          2HD1      LEU  58 -11.302  17.910  -5.680
  405   3HD1  LEU  58          3HD1      LEU  58 -11.666  19.506  -5.022
  406   1HD2  LEU  58          1HD2      LEU  58 -13.457  18.223  -8.028
  407   2HD2  LEU  58          2HD2      LEU  58 -13.624  19.903  -7.515
  408   3HD2  LEU  58          3HD2      LEU  58 -12.041  19.125  -7.489
  409    H    PHE  59           H        PHE  59 -16.474  15.183  -6.984
  410    HA   PHE  59           HA       PHE  59 -16.546  15.928  -9.669
  411   1HB   PHE  59          1HB       PHE  59 -17.129  13.719  -8.760
  412   2HB   PHE  59          2HB       PHE  59 -18.591  14.389  -8.037
  413    HD1  PHE  59           HD1      PHE  59 -20.328  15.487  -9.602
  414    HD2  PHE  59           HD2      PHE  59 -17.127  12.951 -11.004
  415    HE1  PHE  59           HE1      PHE  59 -21.556  15.119 -11.739
  416    HE2  PHE  59           HE2      PHE  59 -18.356  12.583 -13.142
  417    HZ   PHE  59           HZ       PHE  59 -20.570  13.668 -13.510
  418    H    ILE  60           H        ILE  60 -18.845  16.822  -7.107
  419    HA   ILE  60           HA       ILE  60 -20.744  18.110  -8.883
  420    HB   ILE  60           HB       ILE  60 -20.176  18.316  -5.908
  421   1HG1  ILE  60          1HG1      ILE  60 -22.460  16.858  -7.228
  422   2HG1  ILE  60          2HG1      ILE  60 -20.886  16.081  -7.055
  423   1HG2  ILE  60          1HG2      ILE  60 -22.531  19.267  -7.566
  424   2HG2  ILE  60          2HG2      ILE  60 -22.541  19.161  -5.805
  425   3HG2  ILE  60          3HG2      ILE  60 -21.434  20.268  -6.616
  426   1HD1  ILE  60          1HD1      ILE  60 -21.371  17.226  -4.551
  427   2HD1  ILE  60          2HD1      ILE  60 -22.930  16.560  -5.039
  428   3HD1  ILE  60          3HD1      ILE  60 -21.510  15.516  -4.963
  429    H    ALA  61           H        ALA  61 -17.961  19.213  -6.967
  430    HA   ALA  61           HA       ALA  61 -18.387  22.039  -7.463
  431   1HB   ALA  61          1HB       ALA  61 -17.125  21.239  -5.553
  432   2HB   ALA  61          2HB       ALA  61 -16.013  22.124  -6.597
  433   3HB   ALA  61          3HB       ALA  61 -16.011  20.361  -6.602
  434    H    ALA  62           H        ALA  62 -16.983  19.435  -9.292
  435    HA   ALA  62           HA       ALA  62 -15.488  21.284 -11.072
  436   1HB   ALA  62          1HB       ALA  62 -15.521  18.434 -10.349
  437   2HB   ALA  62          3HB       ALA  62 -15.305  18.713 -12.077
  438   3HB   ALA  62          2HB       ALA  62 -14.182  19.428 -10.921
  439    H    SER  63           H        SER  63 -17.805  18.585 -11.574
  440    HA   SER  63           HA       SER  63 -18.793  20.008 -14.014
  441   1HB   SER  63          1HB       SER  63 -17.816  17.713 -14.195
  442   2HB   SER  63          2HB       SER  63 -19.075  17.122 -13.113
  443    HG   SER  63           HG       SER  63 -19.273  17.205 -15.638
  444    H    LEU   8           H        LEU   8  28.575 -18.937  -7.693
  445    HA   LEU   8           HA       LEU   8  27.861 -21.241  -7.764
  446   1HB   LEU   8          1HB       LEU   8  29.475 -21.270  -9.783
  447   2HB   LEU   8          2HB       LEU   8  30.682 -21.876  -8.646
  448    HG   LEU   8           HG       LEU   8  28.763 -23.579  -8.005
  449   1HD1  LEU   8          1HD1      LEU   8  27.218 -22.299  -9.651
  450   2HD1  LEU   8          2HD1      LEU   8  28.110 -23.143 -10.917
  451   3HD1  LEU   8          3HD1      LEU   8  27.207 -24.061  -9.712
  452   1HD2  LEU   8          1HD2      LEU   8  31.056 -23.933  -9.173
  453   2HD2  LEU   8          2HD2      LEU   8  29.821 -25.173  -9.393
  454   3HD2  LEU   8          3HD2      LEU   8  30.122 -23.993 -10.668
  455    H    GLU   9           H        GLU   9  28.308 -20.244  -5.381
  456    HA   GLU   9           HA       GLU   9  29.745 -22.370  -3.923
  457   1HB   GLU   9          1HB       GLU   9  31.294 -20.390  -4.697
  458   2HB   GLU   9          2HB       GLU   9  30.520 -19.513  -3.376
  459   1HG   GLU   9          1HG       GLU   9  31.131 -21.440  -1.858
  460   2HG   GLU   9          2HG       GLU   9  32.088 -22.098  -3.185
  461    HA   PRO  10           HA       PRO  10  26.031 -20.494  -1.838
  462   1HB   PRO  10          1HB       PRO  10  24.701 -22.850  -1.429
  463   2HB   PRO  10          2HB       PRO  10  24.533 -21.892  -2.914
  464   1HG   PRO  10          2HG       PRO  10  26.151 -24.338  -2.413
  465   2HG   PRO  10          1HG       PRO  10  25.234 -23.864  -3.851
  466   1HD   PRO  10          1HD       PRO  10  27.947 -23.632  -3.639
  467   2HD   PRO  10          2HD       PRO  10  26.947 -22.602  -4.686
  468    H    ASP  11           H        ASP  11  27.467 -23.687  -1.063
  469    HA   ASP  11           HA       ASP  11  28.338 -24.534   0.957
  470   1HB   ASP  11          1HB       ASP  11  28.936 -21.708   0.779
  471   2HB   ASP  11          2HB       ASP  11  28.699 -22.168   2.465
  472    H    ASN  12           H        ASN  12  26.825 -21.657   2.385
  473    HA   ASN  12           HA       ASN  12  24.699 -23.401   3.566
  474   1HB   ASN  12          1HB       ASN  12  25.195 -22.276   5.748
  475   2HB   ASN  12          2HB       ASN  12  26.556 -23.225   5.149
  476   2HD2  ASN  12          2HD2      ASN  12  25.478 -19.990   5.930
  477   1HD2  ASN  12          1HD2      ASN  12  26.931 -19.201   5.546
  478    H    VAL  13           H        VAL  13  24.952 -21.092   1.486
  479    HA   VAL  13           HA       VAL  13  23.487 -18.885   2.719
  480    HB   VAL  13           HB       VAL  13  24.635 -19.632   0.060
  481   1HG1  VAL  13          1HG1      VAL  13  22.340 -17.717   0.437
  482   2HG1  VAL  13          2HG1      VAL  13  23.567 -17.399  -0.789
  483   3HG1  VAL  13          3HG1      VAL  13  22.609 -18.878  -0.863
  484   1HG2  VAL  13          1HG2      VAL  13  25.786 -18.318   1.900
  485   2HG2  VAL  13          2HG2      VAL  13  25.769 -17.543   0.316
  486   3HG2  VAL  13          3HG2      VAL  13  24.646 -17.014   1.569
  487    HA   PRO  14           HA       PRO  14  19.832 -20.772   0.373
  488   1HB   PRO  14          1HB       PRO  14  20.134 -23.133  -0.959
  489   2HB   PRO  14          2HB       PRO  14  20.507 -21.564  -1.700
  490   1HG   PRO  14          2HG       PRO  14  22.324 -23.658  -0.713
  491   2HG   PRO  14          1HG       PRO  14  22.583 -22.424  -1.952
  492   1HD   PRO  14          1HD       PRO  14  23.521 -22.379   0.710
  493   2HD   PRO  14          2HD       PRO  14  23.582 -21.066  -0.473
  494    H    MET  15           H        MET  15  21.937 -23.435   1.464
  495    HA   MET  15           HA       MET  15  19.885 -25.085   2.552
  496   1HB   MET  15          1HB       MET  15  22.433 -25.439   2.003
  497   2HB   MET  15          2HB       MET  15  22.669 -24.924   3.673
  498   1HG   MET  15          1HG       MET  15  21.852 -26.867   4.507
  499   2HG   MET  15          2HG       MET  15  20.520 -26.904   3.350
  500   1HE   MET  15          1HE       MET  15  24.189 -27.395   4.040
  501   2HE   MET  15          2HE       MET  15  24.839 -28.294   2.663
  502   3HE   MET  15          3HE       MET  15  24.403 -26.596   2.484
  503    H    ASP  16           H        ASP  16  18.689 -24.803   4.397
  504    HA   ASP  16           HA       ASP  16  17.958 -23.870   6.442
  505   1HB   ASP  16          1HB       ASP  16  20.310 -25.096   6.777
  506   2HB   ASP  16          2HB       ASP  16  20.830 -23.456   7.168
  507    H    MET  17           H        MET  17  18.167 -21.976   4.296
  508    HA   MET  17           HA       MET  17  19.653 -19.628   4.847
  509   1HB   MET  17          2HB       MET  17  17.922 -18.564   3.435
  510   2HB   MET  17          1HB       MET  17  18.383 -20.134   2.779
  511   1HG   MET  17          1HG       MET  17  16.408 -21.057   4.199
  512   2HG   MET  17          2HG       MET  17  15.869 -19.378   4.256
  513   1HE   MET  17          1HE       MET  17  15.964 -17.896   2.324
  514   2HE   MET  17          2HE       MET  17  17.070 -18.499   1.091
  515   3HE   MET  17          3HE       MET  17  15.350 -18.301   0.722
  516    H    SER  18           H        SER  18  16.830 -20.940   6.423
  517    HA   SER  18           HA       SER  18  16.917 -18.746   8.413
  518   1HB   SER  18          1HB       SER  18  14.500 -19.464   6.724
  519   2HB   SER  18          2HB       SER  18  14.463 -18.367   8.101
  520    HG   SER  18           HG       SER  18  14.730 -17.223   6.159
  521    HA   PRO  19           HA       PRO  19  15.595 -22.071  10.986
  522   1HB   PRO  19          1HB       PRO  19  14.318 -20.755  13.008
  523   2HB   PRO  19          2HB       PRO  19  16.073 -20.682  12.763
  524   1HG   PRO  19          2HG       PRO  19  14.028 -18.642  12.259
  525   2HG   PRO  19          1HG       PRO  19  15.764 -18.459  12.536
  526   1HD   PRO  19          1HD       PRO  19  14.381 -18.366  10.047
  527   2HD   PRO  19          2HD       PRO  19  16.133 -18.273  10.321
  528    H    LYS  20           H        LYS  20  13.522 -21.048   8.879
  529    HA   LYS  20           HA       LYS  20  11.354 -21.726   8.244
  530   1HB   LYS  20          1HB       LYS  20  12.317 -23.828   9.428
  531   2HB   LYS  20          2HB       LYS  20  11.291 -23.357  10.783
  532   1HG   LYS  20          1HG       LYS  20  10.215 -23.635   7.973
  533   2HG   LYS  20          2HG       LYS  20  10.257 -24.988   9.103
  534   1HD   LYS  20          1HD       LYS  20   9.139 -23.120  10.698
  535   2HD   LYS  20          2HD       LYS  20   8.557 -22.551   9.132
  536   1HE   LYS  20          1HE       LYS  20   8.275 -25.409   9.208
  537   2HE   LYS  20          2HE       LYS  20   7.530 -24.721  10.664
  538   1HZ   LYS  20          1HZ       LYS  20   6.489 -23.029   9.201
  539   2HZ   LYS  20          2HZ       LYS  20   7.059 -23.889   7.852
  540   3HZ   LYS  20          3HZ       LYS  20   5.937 -24.608   8.902
  541    H    ALA  21           H        ALA  21  11.182 -21.704  11.833
  542    HA   ALA  21           HA       ALA  21   8.634 -20.622  12.152
  543   1HB   ALA  21          1HB       ALA  21  11.219 -20.272  13.686
  544   2HB   ALA  21          3HB       ALA  21   9.681 -19.659  14.294
  545   3HB   ALA  21          2HB       ALA  21   9.897 -21.389  14.028
  546    H    LEU  22           H        LEU  22  11.679 -18.740  11.938
  547    HA   LEU  22           HA       LEU  22  10.371 -16.165  11.898
  548   1HB   LEU  22          1HB       LEU  22  12.637 -16.263  12.590
  549   2HB   LEU  22          2HB       LEU  22  13.096 -17.290  11.238
  550    HG   LEU  22           HG       LEU  22  12.982 -15.467   9.690
  551   1HD1  LEU  22          1HD1      LEU  22  11.607 -14.006  11.951
  552   2HD1  LEU  22          2HD1      LEU  22  12.287 -13.160  10.560
  553   3HD1  LEU  22          3HD1      LEU  22  10.990 -14.334  10.332
  554   1HD2  LEU  22          1HD2      LEU  22  14.977 -15.528  11.200
  555   2HD2  LEU  22          2HD2      LEU  22  14.609 -13.906  10.618
  556   3HD2  LEU  22          3HD2      LEU  22  14.168 -14.375  12.260
  557    H    GLN  23           H        GLN  23  12.037 -17.972   9.301
  558    HA   GLN  23           HA       GLN  23  11.423 -16.438   7.072
  559   1HB   GLN  23          1HB       GLN  23  12.653 -18.749   7.489
  560   2HB   GLN  23          2HB       GLN  23  11.105 -19.421   6.977
  561   1HG   GLN  23          1HG       GLN  23  11.226 -17.969   4.928
  562   2HG   GLN  23          2HG       GLN  23  12.860 -17.511   5.412
  563   2HE2  GLN  23          2HE2      GLN  23  11.185 -20.707   5.500
  564   1HE2  GLN  23          1HE2      GLN  23  12.359 -21.511   4.573
  565    H    GLN  24           H        GLN  24   9.387 -19.111   8.325
  566    HA   GLN  24           HA       GLN  24   7.211 -18.789   6.531
  567   1HB   GLN  24          1HB       GLN  24   7.897 -20.500   8.493
  568   2HB   GLN  24          2HB       GLN  24   6.709 -19.540   9.375
  569   1HG   GLN  24          1HG       GLN  24   5.723 -20.148   6.726
  570   2HG   GLN  24          2HG       GLN  24   6.187 -21.633   7.557
  571   2HE2  GLN  24          2HE2      GLN  24   3.687 -19.330   7.269
  572   1HE2  GLN  24          1HE2      GLN  24   2.810 -19.755   8.659
  573    H    LYS  25           H        LYS  25   7.974 -17.113   9.562
  574    HA   LYS  25           HA       LYS  25   5.436 -15.761   9.839
  575   1HB   LYS  25          1HB       LYS  25   8.057 -15.899  11.086
  576   2HB   LYS  25          2HB       LYS  25   7.480 -14.233  11.027
  577   1HG   LYS  25          2HG       LYS  25   6.533 -14.997  13.024
  578   2HG   LYS  25          1HG       LYS  25   5.224 -15.265  11.872
  579   1HD   LYS  25          1HD       LYS  25   6.225 -17.619  11.552
  580   2HD   LYS  25          2HD       LYS  25   7.141 -17.292  13.024
  581   1HE   LYS  25          1HE       LYS  25   4.841 -16.646  14.061
  582   2HE   LYS  25          2HE       LYS  25   4.152 -17.537  12.690
  583   1HZ   LYS  25          1HZ       LYS  25   6.239 -18.585  14.529
  584   2HZ   LYS  25          2HZ       LYS  25   4.592 -18.995  14.597
  585   3HZ   LYS  25          3HZ       LYS  25   5.517 -19.431  13.245
  586    H    ILE  26           H        ILE  26   8.622 -14.626   8.633
  587    HA   ILE  26           HA       ILE  26   7.890 -12.023   7.854
  588    HB   ILE  26           HB       ILE  26   9.783 -14.029   6.587
  589   1HG1  ILE  26          1HG1      ILE  26  10.553 -11.758   8.400
  590   2HG1  ILE  26          2HG1      ILE  26   9.937 -13.256   9.100
  591   1HG2  ILE  26          1HG2      ILE  26   8.991 -11.484   5.647
  592   2HG2  ILE  26          2HG2      ILE  26  10.582 -11.261   6.375
  593   3HG2  ILE  26          3HG2      ILE  26  10.360 -12.448   5.090
  594   1HD1  ILE  26          1HD1      ILE  26  12.064 -13.451   7.007
  595   2HD1  ILE  26          2HD1      ILE  26  12.536 -12.936   8.626
  596   3HD1  ILE  26          3HD1      ILE  26  11.755 -14.500   8.391
  597    H    HIS  27           H        HIS  27   7.953 -14.929   5.742
  598    HA   HIS  27           HA       HIS  27   6.752 -13.726   3.467
  599   1HB   HIS  27          1HB       HIS  27   7.874 -16.086   4.034
  600   2HB   HIS  27          2HB       HIS  27   6.186 -16.573   4.192
  601    HD1  HIS  27           HD1      HIS  27   5.173 -14.527   1.934
  602    HD2  HIS  27           HD2      HIS  27   8.207 -17.353   1.510
  603    HE1  HIS  27           HE1      HIS  27   5.370 -15.000  -0.546
  604    H    GLU  28           H        GLU  28   5.344 -14.843   6.469
  605    HA   GLU  28           HA       GLU  28   2.612 -15.065   5.483
  606   1HB   GLU  28          1HB       GLU  28   4.136 -15.253   8.012
  607   2HB   GLU  28          2HB       GLU  28   2.459 -14.736   8.196
  608   1HG   GLU  28          1HG       GLU  28   3.147 -17.104   6.466
  609   2HG   GLU  28          2HG       GLU  28   2.969 -17.289   8.211
  610    H    LEU  29           H        LEU  29   4.336 -12.637   7.483
  611    HA   LEU  29           HA       LEU  29   2.126 -10.779   7.565
  612   1HB   LEU  29          1HB       LEU  29   5.107 -10.643   8.058
  613   2HB   LEU  29          2HB       LEU  29   4.063  -9.239   8.281
  614    HG   LEU  29           HG       LEU  29   3.492 -11.901   9.595
  615   1HD1  LEU  29          1HD1      LEU  29   5.748 -10.938  10.247
  616   2HD1  LEU  29          2HD1      LEU  29   4.884  -9.529  10.863
  617   3HD1  LEU  29          3HD1      LEU  29   4.604 -11.117  11.578
  618   1HD2  LEU  29          1HD2      LEU  29   1.935  -9.661   9.265
  619   2HD2  LEU  29          2HD2      LEU  29   1.751 -10.817  10.585
  620   3HD2  LEU  29          3HD2      LEU  29   2.688  -9.342  10.829
  621    H    GLU  30           H        GLU  30   4.992 -11.095   5.474
  622    HA   GLU  30           HA       GLU  30   4.729  -8.654   4.032
  623   1HB   GLU  30          1HB       GLU  30   6.552 -10.544   4.124
  624   2HB   GLU  30          2HB       GLU  30   5.636 -11.239   2.787
  625   1HG   GLU  30          1HG       GLU  30   5.778  -8.704   1.909
  626   2HG   GLU  30          2HG       GLU  30   7.252  -8.738   2.879
  627    H    GLY  31           H        GLY  31   3.498 -11.923   3.213
  628   1HA   GLY  31          2HA       GLY  31   1.746 -12.568   1.791
  629   2HA   GLY  31          1HA       GLY  31   2.120 -11.128   0.843
  630    H    LEU  32           H        LEU  32   1.176 -11.101   4.247
  631    HA   LEU  32           HA       LEU  32  -1.624 -10.501   3.766
  632   1HB   LEU  32          1HB       LEU  32  -0.329 -11.469   5.831
  633   2HB   LEU  32          2HB       LEU  32  -0.065  -9.773   6.239
  634    HG   LEU  32           HG       LEU  32  -2.619  -9.505   5.890
  635   1HD1  LEU  32          1HD1      LEU  32  -2.395 -12.508   6.261
  636   2HD1  LEU  32          2HD1      LEU  32  -3.897 -11.586   6.326
  637   3HD1  LEU  32          3HD1      LEU  32  -2.987 -11.685   4.819
  638   1HD2  LEU  32          1HD2      LEU  32  -1.444  -9.429   8.088
  639   2HD2  LEU  32          2HD2      LEU  32  -3.043 -10.162   8.213
  640   3HD2  LEU  32          3HD2      LEU  32  -1.604 -11.182   8.208
  641    H    MET  33           H        MET  33   1.318  -8.602   4.010
  642    HA   MET  33           HA       MET  33  -0.042  -6.044   4.415
  643   1HB   MET  33          1HB       MET  33   2.201  -6.430   5.258
  644   2HB   MET  33          2HB       MET  33   2.772  -6.887   3.653
  645   1HG   MET  33          1HG       MET  33   1.494  -4.219   3.845
  646   2HG   MET  33          2HG       MET  33   3.043  -4.386   4.671
  647   1HE   MET  33          1HE       MET  33   5.025  -5.471   3.727
  648   2HE   MET  33          2HE       MET  33   5.645  -4.968   2.157
  649   3HE   MET  33          3HE       MET  33   5.213  -3.751   3.357
  650    H    MET  34           H        MET  34   1.025  -7.962   1.668
  651    HA   MET  34           HA       MET  34   0.868  -5.780  -0.267
  652   1HB   MET  34          1HB       MET  34   1.146  -8.785  -0.330
  653   2HB   MET  34          2HB       MET  34   0.960  -7.864  -1.823
  654   1HG   MET  34          1HG       MET  34   2.938  -6.673  -0.032
  655   2HG   MET  34          2HG       MET  34   3.356  -8.327  -0.477
  656   1HE   MET  34          1HE       MET  34   2.992  -4.939  -1.025
  657   2HE   MET  34          2HE       MET  34   4.531  -4.884  -1.895
  658   3HE   MET  34          3HE       MET  34   3.025  -4.529  -2.739
  659    H    GLN  35           H        GLN  35  -1.181  -8.634   0.462
  660    HA   GLN  35           HA       GLN  35  -3.222  -8.248  -1.422
  661   1HB   GLN  35          2HB       GLN  35  -4.598  -9.492   0.219
  662   2HB   GLN  35          1HB       GLN  35  -2.971 -10.164   0.119
  663   1HG   GLN  35          1HG       GLN  35  -2.312  -8.868   2.116
  664   2HG   GLN  35          2HG       GLN  35  -3.944  -8.209   2.223
  665   2HE2  GLN  35          2HE2      GLN  35  -2.665 -11.546   1.661
  666   1HE2  GLN  35          1HE2      GLN  35  -3.597 -12.262   2.885
  667    H    HIS  36           H        HIS  36  -2.686  -6.549   1.641
  668    HA   HIS  36           HA       HIS  36  -5.252  -5.164   1.613
  669   1HB   HIS  36          1HB       HIS  36  -2.630  -4.784   3.086
  670   2HB   HIS  36          2HB       HIS  36  -4.093  -3.866   3.446
  671    HD1  HIS  36           HD1      HIS  36  -5.687  -6.753   2.646
  672    HD2  HIS  36           HD2      HIS  36  -3.084  -5.910   5.792
  673    HE1  HIS  36           HE1      HIS  36  -6.155  -8.474   4.444
  674    H    ALA  37           H        ALA  37  -1.916  -3.865   1.323
  675    HA   ALA  37           HA       ALA  37  -2.474  -1.299   0.378
  676   1HB   ALA  37          1HB       ALA  37  -0.229  -1.669   0.742
  677   2HB   ALA  37          3HB       ALA  37  -0.292  -3.311   0.101
  678   3HB   ALA  37          2HB       ALA  37  -0.232  -1.935  -1.001
  679    H    GLN  38           H        GLN  38  -2.411  -4.348  -1.454
  680    HA   GLN  38           HA       GLN  38  -2.747  -3.150  -4.071
  681   1HB   GLN  38          1HB       GLN  38  -2.855  -5.834  -2.776
  682   2HB   GLN  38          2HB       GLN  38  -3.681  -5.677  -4.326
  683   1HG   GLN  38          1HG       GLN  38  -1.383  -4.404  -4.934
  684   2HG   GLN  38          2HG       GLN  38  -0.776  -5.514  -3.703
  685   2HE2  GLN  38          2HE2      GLN  38  -2.434  -5.386  -6.860
  686   1HE2  GLN  38          1HE2      GLN  38  -2.110  -6.999  -7.280
  687    H    ASN  39           H        ASN  39  -4.937  -4.303  -1.543
  688    HA   ASN  39           HA       ASN  39  -7.323  -3.774  -3.225
  689   1HB   ASN  39          1HB       ASN  39  -6.622  -5.180  -0.700
  690   2HB   ASN  39          2HB       ASN  39  -8.244  -4.491  -0.775
  691   2HD2  ASN  39          2HD2      ASN  39  -6.534  -7.280  -1.500
  692   1HD2  ASN  39          1HD2      ASN  39  -7.554  -7.915  -2.699
  693    H    LEU  40           H        LEU  40  -5.361  -1.682  -2.014
  694    HA   LEU  40           HA       LEU  40  -5.530   0.474  -1.117
  695   1HB   LEU  40          1HB       LEU  40  -8.076  -0.233  -2.391
  696   2HB   LEU  40          2HB       LEU  40  -8.256   1.011  -1.155
  697    HG   LEU  40           HG       LEU  40  -5.897   1.504  -2.767
  698   1HD1  LEU  40          1HD1      LEU  40  -8.511   0.973  -4.160
  699   2HD1  LEU  40          2HD1      LEU  40  -7.413   2.202  -4.786
  700   3HD1  LEU  40          3HD1      LEU  40  -6.880   0.526  -4.657
  701   1HD2  LEU  40          1HD2      LEU  40  -8.381   2.907  -1.864
  702   2HD2  LEU  40          2HD2      LEU  40  -6.693   3.369  -1.650
  703   3HD2  LEU  40          3HD2      LEU  40  -7.483   3.611  -3.208
  704    H    GLU  41           H        GLU  41  -5.953  -1.998   0.640
  705    HA   GLU  41           HA       GLU  41  -7.832  -1.262   2.721
  706   1HB   GLU  41          1HB       GLU  41  -5.881  -3.324   2.081
  707   2HB   GLU  41          2HB       GLU  41  -5.803  -2.889   3.789
  708   1HG   GLU  41          1HG       GLU  41  -8.396  -3.519   2.356
  709   2HG   GLU  41          2HG       GLU  41  -7.459  -4.728   3.236
  710    H    PHE  42           H        PHE  42  -4.285  -1.045   2.427
  711    HA   PHE  42           HA       PHE  42  -2.721   0.266   3.607
  712   1HB   PHE  42          1HB       PHE  42  -5.135   1.904   2.980
  713   2HB   PHE  42          2HB       PHE  42  -3.918   2.629   4.032
  714    HD1  PHE  42           HD1      PHE  42  -1.379   1.667   3.083
  715    HD2  PHE  42           HD2      PHE  42  -4.885   2.736   0.799
  716    HE1  PHE  42           HE1      PHE  42   0.056   2.144   1.103
  717    HE2  PHE  42           HE2      PHE  42  -3.448   3.213  -1.180
  718    HZ   PHE  42           HZ       PHE  42  -0.976   2.919  -1.025
  719    H    GLU  43           H        GLU  43  -2.658   1.865   5.628
  720    HA   GLU  43           HA       GLU  43  -2.815   2.148   7.943
  721   1HB   GLU  43          1HB       GLU  43  -5.200   2.481   7.524
  722   2HB   GLU  43          2HB       GLU  43  -5.464   0.743   7.437
  723   1HG   GLU  43          1HG       GLU  43  -4.527   0.606   9.797
  724   2HG   GLU  43          2HG       GLU  43  -4.664   2.364   9.852
  725    H    GLU  44           H        GLU  44  -4.278  -0.987   7.208
  726    HA   GLU  44           HA       GLU  44  -2.725  -2.324   9.314
  727   1HB   GLU  44          2HB       GLU  44  -4.062  -4.260   8.626
  728   2HB   GLU  44          1HB       GLU  44  -5.106  -2.844   8.741
  729   1HG   GLU  44          1HG       GLU  44  -5.024  -2.527   6.327
  730   2HG   GLU  44          2HG       GLU  44  -3.856  -3.839   6.163
  731    H    ALA  45           H        ALA  45  -2.633  -1.939   5.810
  732    HA   ALA  45           HA       ALA  45  -0.673  -4.067   5.372
  733   1HB   ALA  45          1HB       ALA  45  -2.518  -2.816   3.866
  734   2HB   ALA  45          2HB       ALA  45  -1.099  -3.590   3.160
  735   3HB   ALA  45          3HB       ALA  45  -1.109  -1.847   3.434
  736    H    ALA  46           H        ALA  46  -0.549  -0.481   5.316
  737    HA   ALA  46           HA       ALA  46   2.280  -0.355   4.787
  738   1HB   ALA  46          1HB       ALA  46   1.935   1.961   4.992
  739   2HB   ALA  46          3HB       ALA  46   0.671   1.757   6.208
  740   3HB   ALA  46          2HB       ALA  46   0.345   1.364   4.519
  741    H    GLN  47           H        GLN  47   0.472  -0.920   7.705
  742    HA   GLN  47           HA       GLN  47   2.581  -0.027   9.532
  743   1HB   GLN  47          1HB       GLN  47  -0.138  -1.053   9.589
  744   2HB   GLN  47          2HB       GLN  47   0.857  -1.829  10.816
  745   1HG   GLN  47          1HG       GLN  47  -0.221   0.255  11.657
  746   2HG   GLN  47          2HG       GLN  47   1.539   0.346  11.697
  747   2HE2  GLN  47          2HE2      GLN  47   2.293   2.316  10.927
  748   1HE2  GLN  47          1HE2      GLN  47   1.552   3.243   9.715
  749    H    ILE  48           H        ILE  48   1.297  -3.230   8.531
  750    HA   ILE  48           HA       ILE  48   3.087  -4.905   9.905
  751    HB   ILE  48           HB       ILE  48   1.885  -5.103   7.122
  752   1HG1  ILE  48          1HG1      ILE  48   0.989  -6.300   9.762
  753   2HG1  ILE  48          2HG1      ILE  48   0.316  -4.825   9.068
  754   1HG2  ILE  48          1HG2      ILE  48   3.495  -7.009   8.765
  755   2HG2  ILE  48          2HG2      ILE  48   2.125  -7.658   7.864
  756   3HG2  ILE  48          3HG2      ILE  48   3.422  -6.822   7.012
  757   1HD1  ILE  48          1HD1      ILE  48   0.387  -6.972   7.109
  758   2HD1  ILE  48          2HD1      ILE  48  -0.530  -7.441   8.540
  759   3HD1  ILE  48          3HD1      ILE  48  -0.980  -5.993   7.640
  760    H    ARG  49           H        ARG  49   3.583  -2.962   7.017
  761    HA   ARG  49           HA       ARG  49   5.994  -4.060   6.019
  762   1HB   ARG  49          1HB       ARG  49   4.844  -2.416   4.758
  763   2HB   ARG  49          2HB       ARG  49   4.713  -1.325   6.131
  764   1HG   ARG  49          1HG       ARG  49   7.501  -1.837   5.570
  765   2HG   ARG  49          2HG       ARG  49   6.684  -1.308   4.100
  766   1HD   ARG  49          1HD       ARG  49   7.561   0.613   5.465
  767   2HD   ARG  49          2HD       ARG  49   5.798   0.669   5.269
  768    HE   ARG  49           HE       ARG  49   5.642  -0.411   7.544
  769   1HH1  ARG  49          1HH1      ARG  49   8.871  -0.472   7.048
  770   2HH1  ARG  49          2HH1      ARG  49   9.322   0.496   8.412
  771   1HH2  ARG  49          1HH2      ARG  49   6.083   1.531   9.086
  772   2HH2  ARG  49          2HH2      ARG  49   7.744   1.630   9.565
  773    H    ASP  50           H        ASP  50   5.343  -2.212   8.914
  774    HA   ASP  50           HA       ASP  50   8.118  -1.420   9.395
  775   1HB   ASP  50          1HB       ASP  50   5.922  -0.310  10.167
  776   2HB   ASP  50          2HB       ASP  50   5.837  -1.591  11.375
  777    H    GLN  51           H        GLN  51   5.949  -4.035  10.418
  778    HA   GLN  51           HA       GLN  51   7.697  -5.144  12.432
  779   1HB   GLN  51          2HB       GLN  51   5.519  -6.396  10.722
  780   2HB   GLN  51          1HB       GLN  51   6.143  -7.056  12.235
  781   1HG   GLN  51          1HG       GLN  51   5.223  -5.304  13.520
  782   2HG   GLN  51          2HG       GLN  51   5.013  -4.263  12.112
  783   2HE2  GLN  51          2HE2      GLN  51   4.126  -7.708  12.130
  784   1HE2  GLN  51          1HE2      GLN  51   2.452  -7.452  12.006
  785    H    LEU  52           H        LEU  52   7.199  -5.824   8.964
  786    HA   LEU  52           HA       LEU  52   8.833  -8.107   8.681
  787   1HB   LEU  52          1HB       LEU  52   7.662  -5.989   7.058
  788   2HB   LEU  52          2HB       LEU  52   9.216  -6.512   6.405
  789    HG   LEU  52           HG       LEU  52   7.365  -7.866   5.487
  790   1HD1  LEU  52          1HD1      LEU  52   9.619  -8.917   7.037
  791   2HD1  LEU  52          2HD1      LEU  52   8.319 -10.091   6.838
  792   3HD1  LEU  52          3HD1      LEU  52   9.067  -9.357   5.421
  793   1HD2  LEU  52          1HD2      LEU  52   5.983  -7.590   7.640
  794   2HD2  LEU  52          2HD2      LEU  52   5.940  -9.177   6.872
  795   3HD2  LEU  52          3HD2      LEU  52   6.950  -8.911   8.294
  796    H    HIS  53           H        HIS  53   9.729  -4.667   8.787
  797    HA   HIS  53           HA       HIS  53  12.497  -4.984   8.100
  798   1HB   HIS  53          1HB       HIS  53  10.647  -2.968   9.129
  799   2HB   HIS  53          2HB       HIS  53  12.264  -2.791   9.811
  800    HD1  HIS  53           HD1      HIS  53  12.889  -0.726   8.399
  801    HD2  HIS  53           HD2      HIS  53  11.792  -4.024   6.098
  802    HE1  HIS  53           HE1      HIS  53  13.521  -0.174   6.010
  803    H    GLN  54           H        GLN  54  10.962  -4.551  11.318
  804    HA   GLN  54           HA       GLN  54  13.286  -4.974  12.889
  805   1HB   GLN  54          1HB       GLN  54  10.316  -5.330  13.252
  806   2HB   GLN  54          2HB       GLN  54  11.421  -5.773  14.555
  807   1HG   GLN  54          1HG       GLN  54  12.296  -3.255  13.623
  808   2HG   GLN  54          2HG       GLN  54  10.540  -3.143  13.748
  809   2HE2  GLN  54          2HE2      GLN  54  10.489  -1.884  15.703
  810   1HE2  GLN  54          1HE2      GLN  54  11.039  -2.486  17.191
  811    H    LEU  55           H        LEU  55  10.908  -7.311  11.619
  812    HA   LEU  55           HA       LEU  55  11.812  -9.657  12.902
  813   1HB   LEU  55          1HB       LEU  55  10.382  -8.891  10.416
  814   2HB   LEU  55          2HB       LEU  55  11.051 -10.523  10.437
  815    HG   LEU  55           HG       LEU  55   9.734  -9.821  12.953
  816   1HD1  LEU  55          1HD1      LEU  55   8.367  -9.295  10.385
  817   2HD1  LEU  55          2HD1      LEU  55   7.469 -10.320  11.506
  818   3HD1  LEU  55          3HD1      LEU  55   7.986  -8.709  12.005
  819   1HD2  LEU  55          1HD2      LEU  55   9.577 -12.040  10.902
  820   2HD2  LEU  55          2HD2      LEU  55  10.293 -12.099  12.513
  821   3HD2  LEU  55          3HD2      LEU  55   8.540 -12.008  12.328
  822    H    ARG  56           H        ARG  56  13.209  -7.863  10.214
  823    HA   ARG  56           HA       ARG  56  14.943  -9.828   9.124
  824   1HB   ARG  56          1HB       ARG  56  14.408  -7.516   8.267
  825   2HB   ARG  56          2HB       ARG  56  15.461  -6.864   9.522
  826   1HG   ARG  56          1HG       ARG  56  17.227  -8.533   8.543
  827   2HG   ARG  56          2HG       ARG  56  16.189  -8.514   7.117
  828   1HD   ARG  56          1HD       ARG  56  16.327  -5.976   7.167
  829   2HD   ARG  56          2HD       ARG  56  17.588  -6.151   8.404
  830    HE   ARG  56           HE       ARG  56  18.398  -7.893   6.417
  831   1HH1  ARG  56          1HH1      ARG  56  18.801  -4.700   7.198
  832   2HH1  ARG  56          2HH1      ARG  56  19.252  -4.164   5.614
  833   1HH2  ARG  56          1HH2      ARG  56  18.417  -7.157   4.075
  834   2HH2  ARG  56          2HH2      ARG  56  19.034  -5.555   3.845
  835    H    GLU  57           H        GLU  57  15.886  -7.253  11.440
  836    HA   GLU  57           HA       GLU  57  18.406  -8.347  12.142
  837   1HB   GLU  57          1HB       GLU  57  18.108  -6.877  14.155
  838   2HB   GLU  57          2HB       GLU  57  17.689  -6.064  12.646
  839   1HG   GLU  57          1HG       GLU  57  15.378  -6.217  13.059
  840   2HG   GLU  57          2HG       GLU  57  15.582  -7.508  14.243
  841    H    LEU  58           H        LEU  58  15.181  -9.249  13.128
  842    HA   LEU  58           HA       LEU  58  15.769 -10.584  15.590
  843   1HB   LEU  58          1HB       LEU  58  13.563  -9.949  14.158
  844   2HB   LEU  58          2HB       LEU  58  13.691 -11.661  13.749
  845    HG   LEU  58           HG       LEU  58  14.082 -11.024  16.611
  846   1HD1  LEU  58          1HD1      LEU  58  12.251  -9.450  15.918
  847   2HD1  LEU  58          2HD1      LEU  58  11.326 -10.844  15.357
  848   3HD1  LEU  58          3HD1      LEU  58  11.722 -10.679  17.067
  849   1HD2  LEU  58          1HD2      LEU  58  13.420 -13.234  14.950
  850   2HD2  LEU  58          2HD2      LEU  58  13.615 -13.226  16.702
  851   3HD2  LEU  58          3HD2      LEU  58  12.026 -12.942  15.990
  852    H    PHE  59           H        PHE  59  16.435 -11.434  12.286
  853    HA   PHE  59           HA       PHE  59  16.442 -14.221  12.231
  854   1HB   PHE  59          1HB       PHE  59  17.029 -12.731  10.365
  855   2HB   PHE  59          2HB       PHE  59  18.516 -12.264  11.190
  856    HD1  PHE  59           HD1      PHE  59  20.220 -14.118  11.766
  857    HD2  PHE  59           HD2      PHE  59  16.959 -14.660   8.987
  858    HE1  PHE  59           HE1      PHE  59  21.386 -16.089  10.782
  859    HE2  PHE  59           HE2      PHE  59  18.126 -16.631   8.003
  860    HZ   PHE  59           HZ       PHE  59  20.339 -17.346   8.900
  861    H    ILE  60           H        ILE  60  18.817 -12.076  13.782
  862    HA   ILE  60           HA       ILE  60  20.680 -14.191  14.477
  863    HB   ILE  60           HB       ILE  60  20.194 -11.387  15.535
  864   1HG1  ILE  60          1HG1      ILE  60  22.428 -12.287  13.722
  865   2HG1  ILE  60          2HG1      ILE  60  20.852 -11.862  13.053
  866   1HG2  ILE  60          1HG2      ILE  60  22.512 -13.302  15.932
  867   2HG2  ILE  60          2HG2      ILE  60  22.569 -11.586  16.335
  868   3HG2  ILE  60          3HG2      ILE  60  21.450 -12.654  17.183
  869   1HD1  ILE  60          1HD1      ILE  60  21.415  -9.803  14.859
  870   2HD1  ILE  60          2HD1      ILE  60  22.954 -10.116  14.055
  871   3HD1  ILE  60          3HD1      ILE  60  21.527  -9.711  13.101
  872    H    ALA  61           H        ALA  61  17.961 -12.607  16.128
  873    HA   ALA  61           HA       ALA  61  18.398 -13.901  18.687
  874   1HB   ALA  61          1HB       ALA  61  17.181 -11.813  18.487
  875   2HB   ALA  61          3HB       ALA  61  16.032 -12.540  17.364
  876   3HB   ALA  61          2HB       ALA  61  16.048 -13.040  19.056
  877    H    ALA  62           H        ALA  62  16.921 -14.874  15.692
  878    HA   ALA  62           HA       ALA  62  15.396 -17.074  16.979
  879   1HB   ALA  62          1HB       ALA  62  15.162 -17.296  14.232
  880   2HB   ALA  62          3HB       ALA  62  14.077 -16.368  15.266
  881   3HB   ALA  62          2HB       ALA  62  15.422 -15.566  14.455
  882    H    SER  63           H        SER  63  17.673 -16.836  14.212
  883    HA   SER  63           HA       SER  63  18.608 -19.604  14.861
  884   1HB   SER  63          1HB       SER  63  17.604 -19.096  12.626
  885   2HB   SER  63          2HB       SER  63  18.888 -17.922  12.348
  886    HG   SER  63           HG       SER  63  19.017 -20.367  11.702

  No H/Q in entry =         886
  Start of MODEL   17
    1    H    LEU   8           H        LEU   8 -30.498  16.466 -30.330
    2    HA   LEU   8           HA       LEU   8 -32.293  15.046 -32.256
    3   1HB   LEU   8          1HB       LEU   8 -29.529  16.099 -32.210
    4   2HB   LEU   8          2HB       LEU   8 -29.712  14.539 -33.013
    5    HG   LEU   8           HG       LEU   8 -31.755  15.667 -34.191
    6   1HD1  LEU   8          1HD1      LEU   8 -30.149  18.039 -33.201
    7   2HD1  LEU   8          2HD1      LEU   8 -31.316  18.135 -34.519
    8   3HD1  LEU   8          3HD1      LEU   8 -31.853  17.702 -32.896
    9   1HD2  LEU   8          1HD2      LEU   8 -29.337  15.058 -35.055
   10   2HD2  LEU   8          2HD2      LEU   8 -30.382  16.088 -36.032
   11   3HD2  LEU   8          3HD2      LEU   8 -29.109  16.807 -35.045
   12    H    GLU   9           H        GLU   9 -32.678  13.863 -29.916
   13    HA   GLU   9           HA       GLU   9 -32.419  11.854 -28.698
   14   1HB   GLU   9          1HB       GLU   9 -32.791  11.143 -31.106
   15   2HB   GLU   9          2HB       GLU   9 -31.039  10.995 -31.257
   16   1HG   GLU   9          1HG       GLU   9 -31.209   9.495 -29.137
   17   2HG   GLU   9          2HG       GLU   9 -32.922   9.383 -29.546
   18    HA   PRO  10           HA       PRO  10 -27.814  12.816 -28.227
   19   1HB   PRO  10          1HB       PRO  10 -27.950  14.350 -25.965
   20   2HB   PRO  10          2HB       PRO  10 -28.021  15.034 -27.601
   21   1HG   PRO  10          2HG       PRO  10 -30.224  14.496 -25.676
   22   2HG   PRO  10          1HG       PRO  10 -30.011  15.847 -26.801
   23   1HD   PRO  10          1HD       PRO  10 -31.685  13.736 -27.262
   24   2HD   PRO  10          2HD       PRO  10 -30.936  14.704 -28.551
   25    H    ASP  11           H        ASP  11 -30.109  12.561 -25.481
   26    HA   ASP  11           HA       ASP  11 -30.200  11.035 -23.687
   27   1HB   ASP  11          1HB       ASP  11 -29.301   9.644 -26.077
   28   2HB   ASP  11          2HB       ASP  11 -28.631   8.898 -24.626
   29    H    ASN  12           H        ASN  12 -27.028   9.973 -24.855
   30    HA   ASN  12           HA       ASN  12 -25.614  11.528 -22.777
   31   1HB   ASN  12          2HB       ASN  12 -24.819   9.471 -21.657
   32   2HB   ASN  12          1HB       ASN  12 -26.580   9.567 -21.610
   33   2HD2  ASN  12          2HD2      ASN  12 -27.800   8.103 -23.019
   34   1HD2  ASN  12          1HD2      ASN  12 -27.062   6.749 -23.729
   35    H    VAL  13           H        VAL  13 -25.616  10.905 -25.813
   36    HA   VAL  13           HA       VAL  13 -22.958   9.671 -26.171
   37    HB   VAL  13           HB       VAL  13 -25.308  10.467 -27.842
   38   1HG1  VAL  13          1HG1      VAL  13 -22.466  10.435 -28.819
   39   2HG1  VAL  13          2HG1      VAL  13 -23.747   9.831 -29.869
   40   3HG1  VAL  13          3HG1      VAL  13 -23.793  11.497 -29.292
   41   1HG2  VAL  13          1HG2      VAL  13 -23.480   8.066 -27.639
   42   2HG2  VAL  13          2HG2      VAL  13 -25.143   8.194 -27.064
   43   3HG2  VAL  13          3HG2      VAL  13 -24.806   8.190 -28.795
   44    HA   PRO  14           HA       PRO  14 -21.966  14.094 -27.529
   45   1HB   PRO  14          1HB       PRO  14 -23.859  16.049 -27.321
   46   2HB   PRO  14          2HB       PRO  14 -23.725  14.994 -28.743
   47   1HG   PRO  14          2HG       PRO  14 -25.714  14.985 -26.578
   48   2HG   PRO  14          1HG       PRO  14 -25.847  14.404 -28.242
   49   1HD   PRO  14          1HD       PRO  14 -25.446  12.845 -25.917
   50   2HD   PRO  14          2HD       PRO  14 -25.389  12.306 -27.600
   51    H    MET  15           H        MET  15 -24.398  14.273 -24.921
   52    HA   MET  15           HA       MET  15 -22.872  16.199 -23.376
   53   1HB   MET  15          1HB       MET  15 -25.477  15.291 -23.525
   54   2HB   MET  15          2HB       MET  15 -24.912  14.590 -22.007
   55   1HG   MET  15          1HG       MET  15 -25.423  16.618 -21.120
   56   2HG   MET  15          2HG       MET  15 -23.902  17.136 -21.847
   57   1HE   MET  15          1HE       MET  15 -25.726  18.841 -20.946
   58   2HE   MET  15          2HE       MET  15 -25.519  20.057 -22.203
   59   3HE   MET  15          3HE       MET  15 -27.122  19.406 -21.872
   60    H    ASP  16           H        ASP  16 -20.800  15.009 -23.197
   61    HA   ASP  16           HA       ASP  16 -20.579  13.501 -20.747
   62   1HB   ASP  16          1HB       ASP  16 -21.670  11.927 -22.490
   63   2HB   ASP  16          2HB       ASP  16 -20.086  11.902 -23.265
   64    H    MET  17           H        MET  17 -19.009  15.370 -20.786
   65    HA   MET  17           HA       MET  17 -16.467  14.609 -22.191
   66   1HB   MET  17          1HB       MET  17 -16.065  17.100 -22.215
   67   2HB   MET  17          2HB       MET  17 -17.467  16.597 -23.160
   68   1HG   MET  17          1HG       MET  17 -18.972  17.209 -21.345
   69   2HG   MET  17          2HG       MET  17 -17.603  17.591 -20.298
   70   1HE   MET  17          1HE       MET  17 -20.290  18.956 -21.854
   71   2HE   MET  17          2HE       MET  17 -19.870  20.311 -22.900
   72   3HE   MET  17          3HE       MET  17 -19.686  18.650 -23.480
   73    H    SER  18           H        SER  18 -17.996  15.432 -19.174
   74    HA   SER  18           HA       SER  18 -17.135  15.560 -16.978
   75   1HB   SER  18          1HB       SER  18 -14.604  14.308 -17.988
   76   2HB   SER  18          2HB       SER  18 -15.542  13.916 -16.551
   77    HG   SER  18           HG       SER  18 -15.729  12.948 -19.099
   78    HA   PRO  19           HA       PRO  19 -14.482  19.041 -16.752
   79   1HB   PRO  19          1HB       PRO  19 -13.011  18.625 -14.483
   80   2HB   PRO  19          2HB       PRO  19 -14.732  19.062 -14.457
   81   1HG   PRO  19          2HG       PRO  19 -13.455  16.389 -14.136
   82   2HG   PRO  19          1HG       PRO  19 -14.835  17.090 -13.276
   83   1HD   PRO  19          1HD       PRO  19 -15.098  15.281 -15.279
   84   2HD   PRO  19          2HD       PRO  19 -16.319  16.525 -14.930
   85    H    LYS  20           H        LYS  20 -13.154  15.978 -17.217
   86    HA   LYS  20           HA       LYS  20 -11.156  15.258 -18.233
   87   1HB   LYS  20          1HB       LYS  20 -11.854  17.416 -19.546
   88   2HB   LYS  20          2HB       LYS  20 -10.493  18.158 -18.707
   89   1HG   LYS  20          1HG       LYS  20 -10.306  15.611 -20.339
   90   2HG   LYS  20          2HG       LYS  20  -9.864  17.212 -20.935
   91   1HD   LYS  20          1HD       LYS  20  -8.456  17.180 -18.622
   92   2HD   LYS  20          2HD       LYS  20  -8.452  15.457 -19.001
   93   1HE   LYS  20          1HE       LYS  20  -7.603  15.992 -21.292
   94   2HE   LYS  20          2HE       LYS  20  -7.507  17.701 -20.821
   95   1HZ   LYS  20          1HZ       LYS  20  -6.229  15.493 -19.301
   96   2HZ   LYS  20          2HZ       LYS  20  -5.410  16.434 -20.450
   97   3HZ   LYS  20          3HZ       LYS  20  -6.034  17.162 -19.048
   98    H    ALA  21           H        ALA  21 -10.112  18.412 -16.853
   99    HA   ALA  21           HA       ALA  21  -7.623  17.538 -15.866
  100   1HB   ALA  21          1HB       ALA  21  -7.757  19.797 -15.633
  101   2HB   ALA  21          2HB       ALA  21  -8.506  19.461 -14.072
  102   3HB   ALA  21          3HB       ALA  21  -9.513  19.754 -15.489
  103    H    LEU  22           H        LEU  22 -10.589  17.991 -13.903
  104    HA   LEU  22           HA       LEU  22  -9.678  16.705 -11.553
  105   1HB   LEU  22          1HB       LEU  22 -11.661  17.942 -11.387
  106   2HB   LEU  22          2HB       LEU  22 -12.311  17.288 -12.884
  107    HG   LEU  22           HG       LEU  22 -12.761  15.146 -11.802
  108   1HD1  LEU  22          1HD1      LEU  22 -11.422  16.453  -9.420
  109   2HD1  LEU  22          2HD1      LEU  22 -12.378  14.975  -9.309
  110   3HD1  LEU  22          3HD1      LEU  22 -10.904  15.001 -10.277
  111   1HD2  LEU  22          1HD2      LEU  22 -13.783  17.691 -10.629
  112   2HD2  LEU  22          2HD2      LEU  22 -14.658  16.404 -11.459
  113   3HD2  LEU  22          3HD2      LEU  22 -14.180  16.200  -9.774
  114    H    GLN  23           H        GLN  23 -11.830  15.276 -14.042
  115    HA   GLN  23           HA       GLN  23 -11.809  12.608 -13.217
  116   1HB   GLN  23          1HB       GLN  23 -13.177  13.497 -15.033
  117   2HB   GLN  23          2HB       GLN  23 -11.738  13.818 -16.003
  118   1HG   GLN  23          1HG       GLN  23 -11.341  11.542 -16.401
  119   2HG   GLN  23          2HG       GLN  23 -12.294  11.033 -15.005
  120   2HE2  GLN  23          2HE2      GLN  23 -14.167  10.016 -15.722
  121   1HE2  GLN  23          1HE2      GLN  23 -15.111  10.523 -17.038
  122    H    GLN  24           H        GLN  24  -9.400  14.254 -15.282
  123    HA   GLN  24           HA       GLN  24  -7.764  11.933 -15.754
  124   1HB   GLN  24          1HB       GLN  24  -7.795  14.086 -17.043
  125   2HB   GLN  24          2HB       GLN  24  -7.022  14.876 -15.669
  126   1HG   GLN  24          1HG       GLN  24  -5.286  14.269 -17.238
  127   2HG   GLN  24          2HG       GLN  24  -5.157  13.189 -15.850
  128   2HE2  GLN  24          2HE2      GLN  24  -5.538  10.937 -16.194
  129   1HE2  GLN  24          1HE2      GLN  24  -5.890  10.280 -17.718
  130    H    LYS  25           H        LYS  25  -7.869  14.359 -13.180
  131    HA   LYS  25           HA       LYS  25  -5.362  13.597 -11.935
  132   1HB   LYS  25          1HB       LYS  25  -7.554  15.465 -11.601
  133   2HB   LYS  25          2HB       LYS  25  -7.113  14.757 -10.047
  134   1HG   LYS  25          2HG       LYS  25  -5.564  16.458 -10.097
  135   2HG   LYS  25          1HG       LYS  25  -4.644  15.240 -10.981
  136   1HD   LYS  25          1HD       LYS  25  -5.209  16.189 -13.089
  137   2HD   LYS  25          2HD       LYS  25  -6.479  17.189 -12.382
  138   1HE   LYS  25          1HE       LYS  25  -4.948  18.699 -11.438
  139   2HE   LYS  25          2HE       LYS  25  -3.619  17.522 -11.478
  140   1HZ   LYS  25          1HZ       LYS  25  -4.967  18.424 -13.951
  141   2HZ   LYS  25          2HZ       LYS  25  -3.658  19.284 -13.302
  142   3HZ   LYS  25          3HZ       LYS  25  -3.454  17.669 -13.788
  143    H    ILE  26           H        ILE  26  -8.795  12.897 -11.175
  144    HA   ILE  26           HA       ILE  26  -8.421  11.263  -8.907
  145    HB   ILE  26           HB       ILE  26 -10.415  11.107 -11.191
  146   1HG1  ILE  26          1HG1      ILE  26 -10.775  12.343  -8.455
  147   2HG1  ILE  26          2HG1      ILE  26 -10.140  13.269  -9.817
  148   1HG2  ILE  26          1HG2      ILE  26 -10.341   9.031  -9.807
  149   2HG2  ILE  26          2HG2      ILE  26 -10.634  10.012  -8.370
  150   3HG2  ILE  26          3HG2      ILE  26 -11.862   9.907  -9.633
  151   1HD1  ILE  26          1HD1      ILE  26 -12.599  11.699 -10.357
  152   2HD1  ILE  26          2HD1      ILE  26 -12.788  13.072  -9.269
  153   3HD1  ILE  26          3HD1      ILE  26 -12.155  13.318 -10.897
  154    H    HIS  27           H        HIS  27  -8.715  10.184 -12.319
  155    HA   HIS  27           HA       HIS  27  -8.114   7.437 -11.838
  156   1HB   HIS  27          1HB       HIS  27  -8.033   9.350 -14.150
  157   2HB   HIS  27          2HB       HIS  27  -7.354   7.735 -14.361
  158    HD1  HIS  27           HD1      HIS  27 -10.125   7.829 -11.964
  159    HD2  HIS  27           HD2      HIS  27  -9.728   7.315 -16.081
  160    HE1  HIS  27           HE1      HIS  27 -12.315   6.853 -12.777
  161    H    GLU  28           H        GLU  28  -6.063  10.259 -12.043
  162    HA   GLU  28           HA       GLU  28  -3.586   8.780 -12.540
  163   1HB   GLU  28          1HB       GLU  28  -4.558  11.524 -12.283
  164   2HB   GLU  28          2HB       GLU  28  -2.997  11.302 -11.494
  165   1HG   GLU  28          1HG       GLU  28  -3.563  10.338 -14.306
  166   2HG   GLU  28          2HG       GLU  28  -2.886  11.929 -13.958
  167    H    LEU  29           H        LEU  29  -4.981  10.500  -9.718
  168    HA   LEU  29           HA       LEU  29  -2.935   9.821  -7.852
  169   1HB   LEU  29          1HB       LEU  29  -5.784  10.707  -7.822
  170   2HB   LEU  29          2HB       LEU  29  -5.124  10.083  -6.310
  171    HG   LEU  29           HG       LEU  29  -3.108  11.666  -6.833
  172   1HD1  LEU  29          1HD1      LEU  29  -3.975  12.191  -9.138
  173   2HD1  LEU  29          2HD1      LEU  29  -5.325  13.038  -8.383
  174   3HD1  LEU  29          3HD1      LEU  29  -3.676  13.621  -8.150
  175   1HD2  LEU  29          1HD2      LEU  29  -5.763  12.170  -5.637
  176   2HD2  LEU  29          2HD2      LEU  29  -4.156  12.411  -4.951
  177   3HD2  LEU  29          3HD2      LEU  29  -4.847  13.626  -6.026
  178    H    GLU  30           H        GLU  30  -6.012   8.170  -8.630
  179    HA   GLU  30           HA       GLU  30  -5.909   6.088  -6.727
  180   1HB   GLU  30          1HB       GLU  30  -7.538   6.861  -8.753
  181   2HB   GLU  30          2HB       GLU  30  -6.790   5.445  -9.494
  182   1HG   GLU  30          1HG       GLU  30  -7.324   4.361  -7.121
  183   2HG   GLU  30          2HG       GLU  30  -8.565   5.614  -7.093
  184    H    GLY  31           H        GLY  31  -4.506   6.173 -10.021
  185   1HA   GLY  31          2HA       GLY  31  -2.891   4.786 -11.018
  186   2HA   GLY  31          1HA       GLY  31  -3.332   3.547  -9.841
  187    H    LEU  32           H        LEU  32  -2.274   6.765  -8.901
  188    HA   LEU  32           HA       LEU  32   0.521   6.153  -8.541
  189   1HB   LEU  32          1HB       LEU  32  -0.815   8.396  -8.674
  190   2HB   LEU  32          2HB       LEU  32  -1.053   8.167  -6.940
  191    HG   LEU  32           HG       LEU  32   1.486   7.836  -6.795
  192   1HD1  LEU  32          1HD1      LEU  32   1.212   8.007  -9.599
  193   2HD1  LEU  32          2HD1      LEU  32   2.008   9.499  -9.101
  194   3HD1  LEU  32          3HD1      LEU  32   2.714   7.940  -8.680
  195   1HD2  LEU  32          1HD2      LEU  32  -0.027  10.012  -6.421
  196   2HD2  LEU  32          2HD2      LEU  32   1.731  10.082  -6.304
  197   3HD2  LEU  32          3HD2      LEU  32   0.924  10.600  -7.785
  198    H    MET  33           H        MET  33  -2.345   5.600  -6.600
  199    HA   MET  33           HA       MET  33  -1.124   5.276  -4.032
  200   1HB   MET  33          1HB       MET  33  -3.656   4.912  -5.344
  201   2HB   MET  33          2HB       MET  33  -3.319   3.489  -4.358
  202   1HG   MET  33          1HG       MET  33  -3.566   4.634  -2.420
  203   2HG   MET  33          2HG       MET  33  -2.646   6.013  -3.019
  204   1HE   MET  33          1HE       MET  33  -5.600   4.000  -2.888
  205   2HE   MET  33          2HE       MET  33  -6.440   5.203  -1.913
  206   3HE   MET  33          3HE       MET  33  -6.962   4.882  -3.572
  207    H    MET  34           H        MET  34  -2.198   2.705  -6.295
  208    HA   MET  34           HA       MET  34  -0.879   0.559  -4.963
  209   1HB   MET  34          1HB       MET  34  -2.701   0.607  -6.791
  210   2HB   MET  34          2HB       MET  34  -1.372   0.773  -7.939
  211   1HG   MET  34          2HG       MET  34  -1.906  -1.585  -7.734
  212   2HG   MET  34          1HG       MET  34  -0.348  -1.300  -6.958
  213   1HE   MET  34          1HE       MET  34  -4.065  -1.412  -6.619
  214   2HE   MET  34          2HE       MET  34  -4.423  -1.815  -4.934
  215   3HE   MET  34          3HE       MET  34  -3.878  -0.194  -5.360
  216    H    GLN  35           H        GLN  35   0.266   2.890  -7.356
  217    HA   GLN  35           HA       GLN  35   2.599   1.671  -8.319
  218   1HB   GLN  35          1HB       GLN  35   1.741   3.822  -9.080
  219   2HB   GLN  35          2HB       GLN  35   2.037   4.539  -7.496
  220   1HG   GLN  35          2HG       GLN  35   4.073   5.136  -8.258
  221   2HG   GLN  35          1HG       GLN  35   4.498   3.425  -8.230
  222   2HE2  GLN  35          2HE2      GLN  35   2.483   5.511 -10.395
  223   1HE2  GLN  35          1HE2      GLN  35   3.180   4.936 -11.832
  224    H    HIS  36           H        HIS  36   2.881   4.172  -5.791
  225    HA   HIS  36           HA       HIS  36   5.383   3.332  -4.796
  226   1HB   HIS  36          1HB       HIS  36   3.031   4.876  -3.737
  227   2HB   HIS  36          2HB       HIS  36   4.402   4.552  -2.675
  228    HD1  HIS  36           HD1      HIS  36   3.386   7.305  -4.320
  229    HD2  HIS  36           HD2      HIS  36   6.849   5.041  -4.835
  230    HE1  HIS  36           HE1      HIS  36   5.075   8.823  -5.440
  231    H    ALA  37           H        ALA  37   2.111   2.479  -3.604
  232    HA   ALA  37           HA       ALA  37   2.786   0.880  -1.392
  233   1HB   ALA  37          1HB       ALA  37   0.644  -0.412  -2.431
  234   2HB   ALA  37          2HB       ALA  37   0.514   1.161  -1.643
  235   3HB   ALA  37          3HB       ALA  37   0.594   1.061  -3.402
  236    H    GLN  38           H        GLN  38   2.670  -0.019  -4.850
  237    HA   GLN  38           HA       GLN  38   3.175  -2.801  -4.601
  238   1HB   GLN  38          1HB       GLN  38   3.280  -0.680  -6.610
  239   2HB   GLN  38          2HB       GLN  38   4.510  -1.913  -6.891
  240   1HG   GLN  38          1HG       GLN  38   2.189  -3.334  -6.190
  241   2HG   GLN  38          2HG       GLN  38   1.644  -2.072  -7.295
  242   2HE2  GLN  38          2HE2      GLN  38   1.719  -4.881  -8.021
  243   1HE2  GLN  38          1HE2      GLN  38   2.862  -5.060  -9.263
  244    H    ASN  39           H        ASN  39   5.369  -0.018  -4.572
  245    HA   ASN  39           HA       ASN  39   7.747  -1.770  -4.318
  246   1HB   ASN  39          1HB       ASN  39   7.345   1.242  -4.373
  247   2HB   ASN  39          2HB       ASN  39   8.913   0.434  -4.404
  248   2HD2  ASN  39          2HD2      ASN  39   5.953   1.004  -6.292
  249   1HD2  ASN  39          1HD2      ASN  39   6.600   0.495  -7.776
  250    H    LEU  40           H        LEU  40   5.470  -1.288  -2.212
  251    HA   LEU  40           HA       LEU  40   5.330  -1.112   0.121
  252   1HB   LEU  40          1HB       LEU  40   8.172  -1.950  -0.447
  253   2HB   LEU  40          2HB       LEU  40   7.609  -1.739   1.211
  254    HG   LEU  40           HG       LEU  40   5.618  -3.252   0.478
  255   1HD1  LEU  40          1HD1      LEU  40   7.614  -3.589  -1.748
  256   2HD1  LEU  40          2HD1      LEU  40   6.591  -4.944  -1.269
  257   3HD1  LEU  40          3HD1      LEU  40   5.859  -3.447  -1.844
  258   1HD2  LEU  40          1HD2      LEU  40   7.623  -3.800   2.004
  259   2HD2  LEU  40          2HD2      LEU  40   6.795  -5.167   1.258
  260   3HD2  LEU  40          3HD2      LEU  40   8.326  -4.594   0.595
  261    H    GLU  41           H        GLU  41   6.170   1.303  -1.560
  262    HA   GLU  41           HA       GLU  41   7.996   2.899   0.009
  263   1HB   GLU  41          1HB       GLU  41   5.846   3.418  -2.051
  264   2HB   GLU  41          2HB       GLU  41   6.753   4.745  -1.323
  265   1HG   GLU  41          1HG       GLU  41   8.466   2.542  -2.229
  266   2HG   GLU  41          2HG       GLU  41   7.553   3.293  -3.539
  267    H    PHE  42           H        PHE  42   4.450   2.652  -0.134
  268    HA   PHE  42           HA       PHE  42   2.787   3.412   1.354
  269   1HB   PHE  42          1HB       PHE  42   5.125   2.451   2.980
  270   2HB   PHE  42          2HB       PHE  42   3.704   3.100   3.802
  271    HD1  PHE  42           HD1      PHE  42   1.454   2.260   2.187
  272    HD2  PHE  42           HD2      PHE  42   5.071   0.102   3.138
  273    HE1  PHE  42           HE1      PHE  42   0.258   0.102   1.836
  274    HE2  PHE  42           HE2      PHE  42   3.874  -2.057   2.788
  275    HZ   PHE  42           HZ       PHE  42   1.467  -2.054   2.139
  276    H    GLU  43           H        GLU  43   2.572   4.909   3.429
  277    HA   GLU  43           HA       GLU  43   2.668   7.054   4.356
  278   1HB   GLU  43          1HB       GLU  43   5.035   6.552   4.733
  279   2HB   GLU  43          2HB       GLU  43   5.421   6.959   3.065
  280   1HG   GLU  43          1HG       GLU  43   4.472   9.264   3.516
  281   2HG   GLU  43          2HG       GLU  43   4.431   8.824   5.224
  282    H    GLU  44           H        GLU  44   4.367   7.214   1.258
  283    HA   GLU  44           HA       GLU  44   2.874   9.609   0.443
  284   1HB   GLU  44          2HB       GLU  44   4.360   9.481  -1.503
  285   2HB   GLU  44          1HB       GLU  44   5.296   9.204  -0.035
  286   1HG   GLU  44          1HG       GLU  44   5.267   6.805  -0.400
  287   2HG   GLU  44          2HG       GLU  44   4.170   6.987  -1.769
  288    H    ALA  45           H        ALA  45   2.853   6.135  -0.204
  289    HA   ALA  45           HA       ALA  45   1.029   6.328  -2.485
  290   1HB   ALA  45          1HB       ALA  45   1.331   3.797  -0.981
  291   2HB   ALA  45          3HB       ALA  45   2.839   4.525  -1.533
  292   3HB   ALA  45          2HB       ALA  45   1.578   4.121  -2.697
  293    H    ALA  46           H        ALA  46   0.720   5.298   0.931
  294    HA   ALA  46           HA       ALA  46  -2.129   4.762   0.676
  295   1HB   ALA  46          1HB       ALA  46  -0.485   5.191   3.180
  296   2HB   ALA  46          3HB       ALA  46  -0.430   3.698   2.239
  297   3HB   ALA  46          2HB       ALA  46  -1.938   4.204   3.000
  298    H    GLN  47           H        GLN  47  -0.246   7.617   1.336
  299    HA   GLN  47           HA       GLN  47  -2.254   9.057   2.847
  300   1HB   GLN  47          1HB       GLN  47   0.295   9.594   1.410
  301   2HB   GLN  47          2HB       GLN  47  -0.760  10.980   1.683
  302   1HG   GLN  47          1HG       GLN  47   0.147   9.054   3.843
  303   2HG   GLN  47          2HG       GLN  47   0.852  10.646   3.553
  304   2HE2  GLN  47          2HE2      GLN  47  -0.719  12.544   3.736
  305   1HE2  GLN  47          1HE2      GLN  47  -2.003  12.415   4.838
  306    H    ILE  48           H        ILE  48  -1.510   8.743  -0.617
  307    HA   ILE  48           HA       ILE  48  -3.106  10.776  -1.714
  308    HB   ILE  48           HB       ILE  48  -2.625   7.914  -2.611
  309   1HG1  ILE  48          1HG1      ILE  48  -1.255  10.404  -3.619
  310   2HG1  ILE  48          2HG1      ILE  48  -0.682   9.596  -2.159
  311   1HG2  ILE  48          1HG2      ILE  48  -4.536   8.947  -3.802
  312   2HG2  ILE  48          2HG2      ILE  48  -3.522  10.329  -4.215
  313   3HG2  ILE  48          3HG2      ILE  48  -3.150   8.735  -4.871
  314   1HD1  ILE  48          1HD1      ILE  48  -1.141   8.082  -4.731
  315   2HD1  ILE  48          2HD1      ILE  48   0.395   8.877  -4.384
  316   3HD1  ILE  48          3HD1      ILE  48  -0.192   7.591  -3.328
  317    H    ARG  49           H        ARG  49  -4.077   7.745  -0.222
  318    HA   ARG  49           HA       ARG  49  -6.722   7.451  -1.154
  319   1HB   ARG  49          1HB       ARG  49  -5.734   5.769   0.203
  320   2HB   ARG  49          2HB       ARG  49  -5.287   6.923   1.453
  321   1HG   ARG  49          1HG       ARG  49  -8.145   6.989   1.088
  322   2HG   ARG  49          2HG       ARG  49  -7.624   5.323   1.334
  323   1HD   ARG  49          1HD       ARG  49  -8.111   6.518   3.494
  324   2HD   ARG  49          2HD       ARG  49  -6.427   5.968   3.384
  325    HE   ARG  49           HE       ARG  49  -5.825   8.297   2.679
  326   1HH1  ARG  49          1HH1      ARG  49  -9.145   8.287   2.828
  327   2HH1  ARG  49          2HH1      ARG  49  -9.296   9.653   3.881
  328   1HH2  ARG  49          1HH2      ARG  49  -5.904   9.813   4.590
  329   2HH2  ARG  49          2HH2      ARG  49  -7.460  10.518   4.879
  330    H    ASP  50           H        ASP  50  -5.337   9.853   0.976
  331    HA   ASP  50           HA       ASP  50  -7.882  10.767   2.094
  332   1HB   ASP  50          1HB       ASP  50  -5.392  10.919   2.948
  333   2HB   ASP  50          2HB       ASP  50  -5.346  12.378   1.958
  334    H    GLN  51           H        GLN  51  -5.800  11.627  -0.633
  335    HA   GLN  51           HA       GLN  51  -7.275  14.075  -1.276
  336   1HB   GLN  51          2HB       GLN  51  -5.307  12.405  -2.878
  337   2HB   GLN  51          1HB       GLN  51  -5.748  14.083  -3.200
  338   1HG   GLN  51          1HG       GLN  51  -4.762  14.819  -1.128
  339   2HG   GLN  51          2HG       GLN  51  -4.509  13.156  -0.596
  340   2HE2  GLN  51          2HE2      GLN  51  -3.817  14.777  -3.748
  341   1HE2  GLN  51          1HE2      GLN  51  -2.175  14.346  -3.773
  342    H    LEU  52           H        LEU  52  -7.020  10.795  -2.691
  343    HA   LEU  52           HA       LEU  52  -8.848  11.156  -4.839
  344   1HB   LEU  52          1HB       LEU  52  -7.209   9.211  -4.002
  345   2HB   LEU  52          2HB       LEU  52  -8.713   8.572  -3.336
  346    HG   LEU  52           HG       LEU  52  -8.341   7.698  -5.605
  347   1HD1  LEU  52          1HD1      LEU  52 -10.664   8.532  -4.653
  348   2HD1  LEU  52          2HD1      LEU  52 -10.523   9.727  -5.943
  349   3HD1  LEU  52          3HD1      LEU  52 -10.527   8.006  -6.331
  350   1HD2  LEU  52          1HD2      LEU  52  -7.098   9.953  -6.209
  351   2HD2  LEU  52          2HD2      LEU  52  -7.947   9.050  -7.463
  352   3HD2  LEU  52          3HD2      LEU  52  -8.705  10.461  -6.724
  353    H    HIS  53           H        HIS  53  -9.393  10.291  -1.433
  354    HA   HIS  53           HA       HIS  53 -12.121   9.553  -1.545
  355   1HB   HIS  53          1HB       HIS  53 -10.382   9.555   0.372
  356   2HB   HIS  53          2HB       HIS  53 -10.869  11.228   0.638
  357    HD1  HIS  53           HD1      HIS  53 -13.678  11.459   0.755
  358    HD2  HIS  53           HD2      HIS  53 -11.955   7.814   1.815
  359    HE1  HIS  53           HE1      HIS  53 -15.409  10.222   2.130
  360    H    GLN  54           H        GLN  54 -10.738  12.809  -0.942
  361    HA   GLN  54           HA       GLN  54 -13.325  14.129  -1.037
  362   1HB   GLN  54          1HB       GLN  54 -10.836  14.692  -0.083
  363   2HB   GLN  54          2HB       GLN  54 -10.827  15.638  -1.573
  364   1HG   GLN  54          1HG       GLN  54 -13.217  15.776   0.238
  365   2HG   GLN  54          2HG       GLN  54 -11.773  16.703   0.643
  366   2HE2  GLN  54          2HE2      GLN  54 -11.565  18.704  -0.387
  367   1HE2  GLN  54          1HE2      GLN  54 -12.441  19.181  -1.761
  368    H    LEU  55           H        LEU  55 -10.679  13.602  -3.353
  369    HA   LEU  55           HA       LEU  55 -11.658  15.316  -5.435
  370   1HB   LEU  55          1HB       LEU  55  -9.696  13.146  -5.027
  371   2HB   LEU  55          2HB       LEU  55 -10.281  13.292  -6.685
  372    HG   LEU  55           HG       LEU  55  -9.444  15.758  -5.188
  373   1HD1  LEU  55          1HD1      LEU  55  -7.701  13.686  -5.328
  374   2HD1  LEU  55          2HD1      LEU  55  -7.420  14.425  -6.904
  375   3HD1  LEU  55          3HD1      LEU  55  -7.200  15.374  -5.433
  376   1HD2  LEU  55          1HD2      LEU  55  -9.712  14.856  -8.051
  377   2HD2  LEU  55          2HD2      LEU  55 -10.428  16.263  -7.266
  378   3HD2  LEU  55          3HD2      LEU  55  -8.706  16.245  -7.643
  379    H    ARG  56           H        ARG  56 -12.350  11.944  -4.574
  380    HA   ARG  56           HA       ARG  56 -13.692  11.060  -6.886
  381   1HB   ARG  56          1HB       ARG  56 -13.135   9.685  -4.923
  382   2HB   ARG  56          2HB       ARG  56 -14.298  10.584  -3.947
  383   1HG   ARG  56          1HG       ARG  56 -16.027   9.875  -5.755
  384   2HG   ARG  56          2HG       ARG  56 -14.826   8.666  -6.210
  385   1HD   ARG  56          1HD       ARG  56 -14.865   7.681  -4.003
  386   2HD   ARG  56          2HD       ARG  56 -15.866   9.006  -3.377
  387    HE   ARG  56           HE       ARG  56 -17.742   8.128  -4.592
  388   1HH1  ARG  56          1HH1      ARG  56 -17.640   7.209  -7.019
  389   2HH1  ARG  56          2HH1      ARG  56 -17.149   5.548  -7.016
  390   1HH2  ARG  56          1HH2      ARG  56 -15.877   5.651  -3.792
  391   2HH2  ARG  56          2HH2      ARG  56 -16.152   4.667  -5.190
  392    H    GLU  57           H        GLU  57 -15.218  12.557  -3.998
  393    HA   GLU  57           HA       GLU  57 -17.826  12.830  -5.103
  394   1HB   GLU  57          2HB       GLU  57 -16.392  14.610  -3.104
  395   2HB   GLU  57          1HB       GLU  57 -18.136  14.388  -3.245
  396   1HG   GLU  57          1HG       GLU  57 -17.599  11.858  -2.889
  397   2HG   GLU  57          2HG       GLU  57 -16.064  12.447  -2.250
  398    H    LEU  58           H        LEU  58 -15.013  15.005  -5.191
  399    HA   LEU  58           HA       LEU  58 -16.176  17.322  -6.284
  400   1HB   LEU  58          1HB       LEU  58 -13.624  16.227  -5.794
  401   2HB   LEU  58          2HB       LEU  58 -13.620  16.675  -7.500
  402    HG   LEU  58           HG       LEU  58 -14.897  18.721  -5.870
  403   1HD1  LEU  58          1HD1      LEU  58 -12.184  17.697  -5.088
  404   2HD1  LEU  58          2HD1      LEU  58 -12.517  19.425  -4.988
  405   3HD1  LEU  58          3HD1      LEU  58 -13.491  18.285  -4.060
  406   1HD2  LEU  58          1HD2      LEU  58 -13.994  18.891  -8.229
  407   2HD2  LEU  58          2HD2      LEU  58 -13.430  20.161  -7.142
  408   3HD2  LEU  58          3HD2      LEU  58 -12.370  18.810  -7.546
  409    H    PHE  59           H        PHE  59 -15.639  14.209  -7.774
  410    HA   PHE  59           HA       PHE  59 -15.509  14.811 -10.513
  411   1HB   PHE  59          1HB       PHE  59 -15.461  12.579  -9.232
  412   2HB   PHE  59          2HB       PHE  59 -17.224  12.631  -9.305
  413    HD1  PHE  59           HD1      PHE  59 -14.204  12.974 -11.524
  414    HD2  PHE  59           HD2      PHE  59 -18.327  11.742 -11.177
  415    HE1  PHE  59           HE1      PHE  59 -14.135  12.089 -13.854
  416    HE2  PHE  59           HE2      PHE  59 -18.258  10.857 -13.507
  417    HZ   PHE  59           HZ       PHE  59 -16.163  11.030 -14.845
  418    H    ILE  60           H        ILE  60 -18.502  14.251  -8.609
  419    HA   ILE  60           HA       ILE  60 -20.221  15.168 -10.781
  420    HB   ILE  60           HB       ILE  60 -20.724  14.668  -7.828
  421   1HG1  ILE  60          1HG1      ILE  60 -21.649  12.690  -9.786
  422   2HG1  ILE  60          2HG1      ILE  60 -19.894  12.867  -9.769
  423   1HG2  ILE  60          1HG2      ILE  60 -22.401  15.661  -9.955
  424   2HG2  ILE  60          2HG2      ILE  60 -22.982  14.081  -9.432
  425   3HG2  ILE  60          3HG2      ILE  60 -22.812  15.389  -8.261
  426   1HD1  ILE  60          1HD1      ILE  60 -21.291  12.714  -7.135
  427   2HD1  ILE  60          2HD1      ILE  60 -21.146  11.226  -8.071
  428   3HD1  ILE  60          3HD1      ILE  60 -19.698  12.114  -7.597
  429    H    ALA  61           H        ALA  61 -19.005  16.552  -7.733
  430    HA   ALA  61           HA       ALA  61 -20.541  18.921  -7.630
  431   1HB   ALA  61          1HB       ALA  61 -17.641  19.048  -6.966
  432   2HB   ALA  61          2HB       ALA  61 -19.038  19.458  -5.971
  433   3HB   ALA  61          3HB       ALA  61 -18.568  17.770  -6.180
  434    H    ALA  62           H        ALA  62 -17.967  18.018  -9.809
  435    HA   ALA  62           HA       ALA  62 -17.668  20.823 -10.773
  436   1HB   ALA  62          1HB       ALA  62 -15.991  18.554 -10.429
  437   2HB   ALA  62          3HB       ALA  62 -16.086  18.858 -12.163
  438   3HB   ALA  62          2HB       ALA  62 -15.539  20.132 -11.072
  439    H    SER  63           H        SER  63 -17.671  17.701 -12.511
  440    HA   SER  63           HA       SER  63 -19.939  18.644 -14.197
  441   1HB   SER  63          1HB       SER  63 -17.169  18.800 -14.868
  442   2HB   SER  63          2HB       SER  63 -17.887  17.545 -15.875
  443    HG   SER  63           HG       SER  63 -18.030  20.095 -16.267
  444    H    LEU   8           H        LEU   8  30.033 -34.303   6.474
  445    HA   LEU   8           HA       LEU   8  31.769 -35.767   4.528
  446   1HB   LEU   8          1HB       LEU   8  29.020 -35.983   5.600
  447   2HB   LEU   8          2HB       LEU   8  29.164 -36.304   3.872
  448    HG   LEU   8           HG       LEU   8  31.199 -37.790   4.574
  449   1HD1  LEU   8          1HD1      LEU   8  29.646 -37.502   7.161
  450   2HD1  LEU   8          2HD1      LEU   8  30.788 -38.809   6.850
  451   3HD1  LEU   8          3HD1      LEU   8  31.350 -37.138   6.894
  452   1HD2  LEU   8          1HD2      LEU   8  28.756 -38.403   3.787
  453   2HD2  LEU   8          2HD2      LEU   8  29.794 -39.652   4.473
  454   3HD2  LEU   8          3HD2      LEU   8  28.551 -38.894   5.469
  455    H    GLU   9           H        GLU   9  32.185 -33.191   4.062
  456    HA   GLU   9           HA       GLU   9  31.923 -31.442   2.494
  457   1HB   GLU   9          1HB       GLU   9  32.236 -33.548   1.113
  458   2HB   GLU   9          2HB       GLU   9  30.480 -33.623   0.960
  459   1HG   GLU   9          1HG       GLU   9  30.672 -31.164   0.131
  460   2HG   GLU   9          2HG       GLU   9  32.375 -31.548  -0.126
  461    HA   PRO  10           HA       PRO  10  27.343 -31.196   3.637
  462   1HB   PRO  10          1HB       PRO  10  27.545 -29.475   5.756
  463   2HB   PRO  10          2HB       PRO  10  27.593 -31.241   5.938
  464   1HG   PRO  10          2HG       PRO  10  29.827 -29.276   5.935
  465   2HG   PRO  10          1HG       PRO  10  29.610 -30.739   6.908
  466   1HD   PRO  10          1HD       PRO  10  31.245 -30.598   4.723
  467   2HD   PRO  10          2HD       PRO  10  30.483 -32.099   5.294
  468    H    ASP  11           H        ASP  11  29.690 -28.529   4.141
  469    HA   ASP  11           HA       ASP  11  29.796 -26.373   3.196
  470   1HB   ASP  11          1HB       ASP  11  28.829 -28.246   1.192
  471   2HB   ASP  11          2HB       ASP  11  28.180 -26.631   0.908
  472    H    ASN  12           H        ASN  12  26.587 -27.135   1.902
  473    HA   ASN  12           HA       ASN  12  25.237 -25.572   4.017
  474   1HB   ASN  12          2HB       ASN  12  24.437 -23.895   2.385
  475   2HB   ASN  12          1HB       ASN  12  26.200 -23.905   2.457
  476   2HD2  ASN  12          2HD2      ASN  12  27.372 -24.851   0.625
  477   1HD2  ASN  12          1HD2      ASN  12  26.599 -25.129  -0.860
  478    H    VAL  13           H        VAL  13  25.169 -28.299   2.545
  479    HA   VAL  13           HA       VAL  13  22.488 -28.244   1.310
  480    HB   VAL  13           HB       VAL  13  24.814 -30.112   1.546
  481   1HG1  VAL  13          1HG1      VAL  13  21.951 -30.992   1.291
  482   2HG1  VAL  13          2HG1      VAL  13  23.201 -31.844   0.384
  483   3HG1  VAL  13          3HG1      VAL  13  23.283 -31.772   2.145
  484   1HG2  VAL  13          1HG2      VAL  13  22.957 -29.195  -0.658
  485   2HG2  VAL  13          2HG2      VAL  13  24.633 -28.708  -0.402
  486   3HG2  VAL  13          3HG2      VAL  13  24.260 -30.359  -0.897
  487    HA   PRO  14           HA       PRO  14  21.530 -30.805   5.174
  488   1HB   PRO  14          1HB       PRO  14  23.451 -31.199   7.069
  489   2HB   PRO  14          2HB       PRO  14  23.274 -32.254   5.653
  490   1HG   PRO  14          2HG       PRO  14  25.308 -30.210   6.230
  491   2HG   PRO  14          1HG       PRO  14  25.398 -31.637   5.191
  492   1HD   PRO  14          1HD       PRO  14  25.022 -28.956   4.376
  493   2HD   PRO  14          2HD       PRO  14  24.925 -30.410   3.377
  494    H    MET  15           H        MET  15  24.015 -28.398   6.051
  495    HA   MET  15           HA       MET  15  22.548 -27.450   8.369
  496   1HB   MET  15          1HB       MET  15  25.136 -27.371   7.407
  497   2HB   MET  15          2HB       MET  15  24.594 -25.707   7.184
  498   1HG   MET  15          1HG       MET  15  25.150 -25.451   9.371
  499   2HG   MET  15          2HG       MET  15  23.622 -26.272   9.688
  500   1HE   MET  15          1HE       MET  15  25.486 -25.930  11.544
  501   2HE   MET  15          2HE       MET  15  25.272 -27.482  12.350
  502   3HE   MET  15          3HE       MET  15  26.872 -27.001  11.791
  503    H    ASP  16           H        ASP  16  20.464 -26.903   7.320
  504    HA   ASP  16           HA       ASP  16  20.273 -24.119   6.586
  505   1HB   ASP  16          1HB       ASP  16  21.307 -25.351   4.556
  506   2HB   ASP  16          2HB       ASP  16  19.706 -26.061   4.339
  507    H    MET  17           H        MET  17  18.728 -24.670   8.395
  508    HA   MET  17           HA       MET  17  16.148 -25.756   7.310
  509   1HB   MET  17          1HB       MET  17  15.781 -26.490   9.696
  510   2HB   MET  17          2HB       MET  17  17.155 -27.272   8.915
  511   1HG   MET  17          1HG       MET  17  18.705 -25.735   9.996
  512   2HG   MET  17          2HG       MET  17  17.363 -24.822  10.689
  513   1HE   MET  17          1HE       MET  17  20.036 -26.746  11.496
  514   2HE   MET  17          2HE       MET  17  19.613 -28.131  12.500
  515   3HE   MET  17          3HE       MET  17  19.396 -28.206  10.746
  516    H    SER  18           H        SER  18  17.750 -23.129   8.938
  517    HA   SER  18           HA       SER  18  16.935 -21.050   9.709
  518   1HB   SER  18          1HB       SER  18  14.369 -21.616   8.268
  519   2HB   SER  18          2HB       SER  18  15.331 -20.142   8.289
  520    HG   SER  18           HG       SER  18  15.451 -22.305   6.626
  521    HA   PRO  19           HA       PRO  19  14.336 -21.796  13.158
  522   1HB   PRO  19          1HB       PRO  19  12.907 -19.480  13.441
  523   2HB   PRO  19          2HB       PRO  19  14.634 -19.608  13.834
  524   1HG   PRO  19          2HG       PRO  19  13.327 -18.510  11.392
  525   2HG   PRO  19          1HG       PRO  19  14.733 -17.910  12.285
  526   1HD   PRO  19          1HD       PRO  19  14.932 -19.312   9.970
  527   2HD   PRO  19          2HD       PRO  19  16.176 -19.355  11.239
  528    H    LYS  20           H        LYS  20  12.957 -21.337  10.116
  529    HA   LYS  20           HA       LYS  20  10.929 -22.070   9.172
  530   1HB   LYS  20          1HB       LYS  20  11.629 -23.960  10.847
  531   2HB   LYS  20          2HB       LYS  20  10.296 -23.349  11.826
  532   1HG   LYS  20          1HG       LYS  20  10.041 -24.175   8.920
  533   2HG   LYS  20          2HG       LYS  20   9.609 -25.200  10.289
  534   1HD   LYS  20          1HD       LYS  20   8.248 -22.955  10.953
  535   2HD   LYS  20          2HD       LYS  20   8.212 -22.820   9.194
  536   1HE   LYS  20          1HE       LYS  20   7.324 -25.155   9.062
  537   2HE   LYS  20          2HE       LYS  20   7.261 -25.195  10.836
  538   1HZ   LYS  20          1HZ       LYS  20   5.985 -23.083   9.184
  539   2HZ   LYS  20          2HZ       LYS  20   5.155 -24.441   9.769
  540   3HZ   LYS  20          3HZ       LYS  20   5.818 -23.317  10.858
  541    H    ALA  21           H        ALA  21   9.956 -21.643  12.610
  542    HA   ALA  21           HA       ALA  21   7.477 -20.406  12.104
  543   1HB   ALA  21          1HB       ALA  21   9.405 -20.715  14.299
  544   2HB   ALA  21          3HB       ALA  21   7.646 -20.836  14.332
  545   3HB   ALA  21          2HB       ALA  21   8.424 -19.256  14.445
  546    H    LEU  22           H        LEU  22  10.488 -18.704  13.047
  547    HA   LEU  22           HA       LEU  22   9.609 -16.069  12.511
  548   1HB   LEU  22          1HB       LEU  22  11.611 -16.297  13.704
  549   2HB   LEU  22          2HB       LEU  22  12.222 -17.552  12.635
  550    HG   LEU  22           HG       LEU  22  12.664 -15.906  10.888
  551   1HD1  LEU  22          1HD1      LEU  22  11.393 -13.981  12.850
  552   2HD1  LEU  22          2HD1      LEU  22  12.329 -13.463  11.449
  553   3HD1  LEU  22          3HD1      LEU  22  10.837 -14.376  11.223
  554   1HD2  LEU  22          1HD2      LEU  22  13.745 -15.532  13.642
  555   2HD2  LEU  22          2HD2      LEU  22  14.586 -15.970  12.154
  556   3HD2  LEU  22          3HD2      LEU  22  14.138 -14.291  12.453
  557    H    GLN  23           H        GLN  23  11.690 -18.073  10.383
  558    HA   GLN  23           HA       GLN  23  11.649 -16.513   8.067
  559   1HB   GLN  23          1HB       GLN  23  12.991 -18.531   8.370
  560   2HB   GLN  23          2HB       GLN  23  11.537 -19.528   8.425
  561   1HG   GLN  23          1HG       GLN  23  11.101 -19.247   6.139
  562   2HG   GLN  23          2HG       GLN  23  12.075 -17.780   6.035
  563   2HE2  GLN  23          2HE2      GLN  23  13.918 -18.202   4.819
  564   1HE2  GLN  23          1HE2      GLN  23  14.843 -19.623   4.907
  565    H    GLN  24           H        GLN  24   9.220 -18.927   9.094
  566    HA   GLN  24           HA       GLN  24   7.543 -18.684   6.768
  567   1HB   GLN  24          1HB       GLN  24   7.578 -20.540   8.457
  568   2HB   GLN  24          2HB       GLN  24   6.843 -19.439   9.623
  569   1HG   GLN  24          2HG       GLN  24   5.067 -20.741   8.624
  570   2HG   GLN  24          1HG       GLN  24   4.952 -19.098   7.992
  571   2HE2  GLN  24          2HE2      GLN  24   5.294 -18.783   5.730
  572   1HE2  GLN  24          1HE2      GLN  24   5.607 -20.058   4.654
  573    H    LYS  25           H        LYS  25   7.735 -16.921   9.830
  574    HA   LYS  25           HA       LYS  25   5.243 -15.470   9.507
  575   1HB   LYS  25          1HB       LYS  25   7.467 -15.725  11.349
  576   2HB   LYS  25          2HB       LYS  25   7.049 -14.025  11.128
  577   1HG   LYS  25          2HG       LYS  25   5.523 -14.538  12.772
  578   2HG   LYS  25          1HG       LYS  25   4.568 -15.018  11.367
  579   1HD   LYS  25          1HD       LYS  25   5.102 -17.319  11.660
  580   2HD   LYS  25          2HD       LYS  25   6.400 -16.951  12.797
  581   1HE   LYS  25          1HE       LYS  25   4.909 -16.459  14.544
  582   2HE   LYS  25          2HE       LYS  25   3.565 -16.136  13.430
  583   1HZ   LYS  25          1HZ       LYS  25   4.874 -18.786  13.555
  584   2HZ   LYS  25          2HZ       LYS  25   3.590 -18.392  14.591
  585   3HZ   LYS  25          3HZ       LYS  25   3.355 -18.387  12.907
  586    H    ILE  26           H        ILE  26   8.681 -14.594   8.990
  587    HA   ILE  26           HA       ILE  26   8.332 -11.946   8.086
  588    HB   ILE  26           HB       ILE  26  10.275 -14.119   7.240
  589   1HG1  ILE  26          1HG1      ILE  26  10.709 -11.863   9.205
  590   2HG1  ILE  26          2HG1      ILE  26  10.059 -13.422   9.711
  591   1HG2  ILE  26          1HG2      ILE  26  10.202 -12.194   5.653
  592   2HG2  ILE  26          2HG2      ILE  26  10.538 -11.107   7.000
  593   3HG2  ILE  26          3HG2      ILE  26  11.738 -12.303   6.513
  594   1HD1  ILE  26          1HD1      ILE  26  12.484 -13.527   8.005
  595   2HD1  ILE  26          2HD1      ILE  26  12.715 -12.882   9.631
  596   3HD1  ILE  26          3HD1      ILE  26  12.053 -14.502   9.410
  597    H    HIS  27           H        HIS  27   8.541 -14.907   6.065
  598    HA   HIS  27           HA       HIS  27   7.912 -13.644   3.584
  599   1HB   HIS  27          1HB       HIS  27   7.810 -16.407   4.751
  600   2HB   HIS  27          2HB       HIS  27   7.104 -16.135   3.158
  601    HD1  HIS  27           HD1      HIS  27   9.925 -13.909   3.886
  602    HD2  HIS  27           HD2      HIS  27   9.437 -17.696   2.214
  603    HE1  HIS  27           HE1      HIS  27  12.085 -14.441   2.675
  604    H    GLU  28           H        GLU  28   5.897 -14.621   6.266
  605    HA   GLU  28           HA       GLU  28   3.389 -14.632   4.754
  606   1HB   GLU  28          1HB       GLU  28   4.405 -15.192   7.437
  607   2HB   GLU  28          2HB       GLU  28   2.856 -14.348   7.481
  608   1HG   GLU  28          1HG       GLU  28   3.352 -16.771   5.737
  609   2HG   GLU  28          2HG       GLU  28   2.704 -16.885   7.374
  610    H    LEU  29           H        LEU  29   4.866 -12.447   7.187
  611    HA   LEU  29           HA       LEU  29   2.848 -10.434   7.114
  612   1HB   LEU  29          1HB       LEU  29   5.710 -10.705   7.917
  613   2HB   LEU  29          2HB       LEU  29   5.072  -9.067   7.767
  614    HG   LEU  29           HG       LEU  29   3.069  -9.994   9.172
  615   1HD1  LEU  29          1HD1      LEU  29   3.895 -12.365   8.992
  616   2HD1  LEU  29          2HD1      LEU  29   5.272 -11.908   9.995
  617   3HD1  LEU  29          3HD1      LEU  29   3.636 -11.827  10.652
  618   1HD2  LEU  29          1HD2      LEU  29   5.754  -9.035   9.947
  619   2HD2  LEU  29          2HD2      LEU  29   4.165  -8.422  10.405
  620   3HD2  LEU  29          3HD2      LEU  29   4.850  -9.812  11.247
  621    H    GLU  30           H        GLU  30   5.887 -10.750   5.251
  622    HA   GLU  30           HA       GLU  30   5.794  -8.327   3.808
  623   1HB   GLU  30          1HB       GLU  30   7.391 -10.516   3.932
  624   2HB   GLU  30          2HB       GLU  30   6.610 -10.804   2.377
  625   1HG   GLU  30          1HG       GLU  30   7.176  -8.229   2.013
  626   2HG   GLU  30          2HG       GLU  30   8.435  -8.582   3.198
  627    H    GLY  31           H        GLY  31   4.325 -11.483   2.967
  628   1HA   GLY  31          2HA       GLY  31   2.672 -12.012   1.382
  629   2HA   GLY  31          1HA       GLY  31   3.119 -10.536   0.527
  630    H    LEU  32           H        LEU  32   2.125 -10.546   3.899
  631    HA   LEU  32           HA       LEU  32  -0.670  -9.981   3.469
  632   1HB   LEU  32          1HB       LEU  32   0.695 -10.776   5.554
  633   2HB   LEU  32          2HB       LEU  32   0.963  -9.054   5.828
  634    HG   LEU  32           HG       LEU  32  -1.577  -8.779   5.602
  635   1HD1  LEU  32          1HD1      LEU  32  -1.356 -11.518   4.952
  636   2HD1  LEU  32          2HD1      LEU  32  -2.121 -11.460   6.540
  637   3HD1  LEU  32          3HD1      LEU  32  -2.841 -10.596   5.182
  638   1HD2  LEU  32          1HD2      LEU  32  -0.025  -9.073   7.764
  639   2HD2  LEU  32          2HD2      LEU  32  -1.780  -8.954   7.898
  640   3HD2  LEU  32          3HD2      LEU  32  -0.997 -10.533   7.952
  641    H    MET  33           H        MET  33   2.228  -8.008   3.445
  642    HA   MET  33           HA       MET  33   1.054  -5.437   3.898
  643   1HB   MET  33          1HB       MET  33   3.554  -6.627   3.125
  644   2HB   MET  33          2HB       MET  33   3.218  -5.270   2.050
  645   1HG   MET  33          1HG       MET  33   3.522  -3.746   3.698
  646   2HG   MET  33          2HG       MET  33   2.608  -4.702   4.864
  647   1HE   MET  33          1HE       MET  33   5.536  -4.042   2.919
  648   2HE   MET  33          2HE       MET  33   6.411  -3.468   4.336
  649   3HE   MET  33          3HE       MET  33   6.896  -4.973   3.542
  650    H    MET  34           H        MET  34   2.047  -6.879   0.763
  651    HA   MET  34           HA       MET  34   0.726  -4.965  -0.883
  652   1HB   MET  34          1HB       MET  34   2.511  -6.757  -1.398
  653   2HB   MET  34          2HB       MET  34   1.160  -7.883  -1.544
  654   1HG   MET  34          2HG       MET  34   1.666  -7.016  -3.752
  655   2HG   MET  34          1HG       MET  34   0.129  -6.331  -3.227
  656   1HE   MET  34          1HE       MET  34   3.850  -6.031  -3.307
  657   2HE   MET  34          2HE       MET  34   4.238  -4.308  -3.213
  658   3HE   MET  34          3HE       MET  34   3.705  -5.176  -1.774
  659    H    GLN  35           H        GLN  35  -0.435  -7.909   0.683
  660    HA   GLN  35           HA       GLN  35  -2.805  -8.443  -0.717
  661   1HB   GLN  35          1HB       GLN  35  -1.933  -9.806   1.105
  662   2HB   GLN  35          2HB       GLN  35  -2.187  -8.492   2.255
  663   1HG   GLN  35          2HG       GLN  35  -4.229  -9.362   2.645
  664   2HG   GLN  35          1HG       GLN  35  -4.677  -8.835   1.023
  665   2HE2  GLN  35          2HE2      GLN  35  -2.677 -11.541   2.357
  666   1HE2  GLN  35          1HE2      GLN  35  -3.413 -12.739   1.407
  667    H    HIS  36           H        HIS  36  -3.000  -6.741   2.410
  668    HA   HIS  36           HA       HIS  36  -5.492  -5.505   1.941
  669   1HB   HIS  36          1HB       HIS  36  -3.098  -4.974   3.679
  670   2HB   HIS  36          2HB       HIS  36  -4.450  -3.844   3.701
  671    HD1  HIS  36           HD1      HIS  36  -3.431  -6.227   5.844
  672    HD2  HIS  36           HD2      HIS  36  -6.934  -6.013   3.593
  673    HE1  HIS  36           HE1      HIS  36  -5.122  -7.711   7.007
  674    H    ALA  37           H        ALA  37  -2.208  -4.170   1.405
  675    HA   ALA  37           HA       ALA  37  -2.859  -1.581   0.524
  676   1HB   ALA  37          1HB       ALA  37  -0.588  -1.938   0.676
  677   2HB   ALA  37          3HB       ALA  37  -0.706  -3.591   0.075
  678   3HB   ALA  37          2HB       ALA  37  -0.756  -2.237  -1.054
  679    H    GLN  38           H        GLN  38  -2.827  -4.633  -1.336
  680    HA   GLN  38           HA       GLN  38  -3.366  -3.585  -3.918
  681   1HB   GLN  38          1HB       GLN  38  -3.484  -6.119  -2.463
  682   2HB   GLN  38          2HB       GLN  38  -4.735  -6.014  -3.701
  683   1HG   GLN  38          1HG       GLN  38  -2.419  -4.969  -4.905
  684   2HG   GLN  38          2HG       GLN  38  -1.880  -6.399  -4.025
  685   2HE2  GLN  38          2HE2      GLN  38  -2.008  -6.283  -6.923
  686   1HE2  GLN  38          1HE2      GLN  38  -3.179  -7.402  -7.429
  687    H    ASN  39           H        ASN  39  -5.519  -4.325  -1.202
  688    HA   ASN  39           HA       ASN  39  -7.915  -3.540  -2.761
  689   1HB   ASN  39          1HB       ASN  39  -7.473  -4.467   0.098
  690   2HB   ASN  39          2HB       ASN  39  -9.052  -4.239  -0.655
  691   2HD2  ASN  39          2HD2      ASN  39  -6.126  -6.259  -0.708
  692   1HD2  ASN  39          1HD2      ASN  39  -6.810  -7.522  -1.612
  693    H    LEU  40           H        LEU  40  -5.590  -1.698  -1.738
  694    HA   LEU  40           HA       LEU  40  -5.400   0.482  -0.899
  695   1HB   LEU  40          1HB       LEU  40  -8.265   0.224  -1.810
  696   2HB   LEU  40          2HB       LEU  40  -7.664   1.742  -1.142
  697    HG   LEU  40           HG       LEU  40  -5.710   1.447  -2.839
  698   1HD1  LEU  40          1HD1      LEU  40  -7.755  -0.557  -3.766
  699   2HD1  LEU  40          2HD1      LEU  40  -6.741   0.277  -4.944
  700   3HD1  LEU  40          3HD1      LEU  40  -6.001  -0.718  -3.689
  701   1HD2  LEU  40          1HD2      LEU  40  -7.690   3.097  -2.886
  702   2HD2  LEU  40          2HD2      LEU  40  -6.898   2.763  -4.427
  703   3HD2  LEU  40          3HD2      LEU  40  -8.433   1.988  -4.038
  704    H    GLU  41           H        GLU  41  -6.241  -1.812   0.945
  705    HA   GLU  41           HA       GLU  41  -8.011  -0.739   2.960
  706   1HB   GLU  41          1HB       GLU  41  -5.898  -2.896   2.821
  707   2HB   GLU  41          2HB       GLU  41  -6.769  -2.568   4.319
  708   1HG   GLU  41          1HG       GLU  41  -8.532  -2.772   1.983
  709   2HG   GLU  41          2HG       GLU  41  -7.636  -4.257   2.306
  710    H    PHE  42           H        PHE  42  -4.473  -0.862   2.615
  711    HA   PHE  42           HA       PHE  42  -2.770   0.318   3.740
  712   1HB   PHE  42          1HB       PHE  42  -5.087   2.188   3.334
  713   2HB   PHE  42          2HB       PHE  42  -3.640   2.765   4.163
  714    HD1  PHE  42           HD1      PHE  42  -1.436   1.427   2.851
  715    HD2  PHE  42           HD2      PHE  42  -5.063   3.012   1.129
  716    HE1  PHE  42           HE1      PHE  42  -0.278   1.694   0.661
  717    HE2  PHE  42           HE2      PHE  42  -3.905   3.280  -1.063
  718    HZ   PHE  42           HZ       PHE  42  -1.510   2.622  -1.293
  719    H    GLU  43           H        GLU  43  -2.491   1.868   5.768
  720    HA   GLU  43           HA       GLU  43  -2.539   2.139   8.089
  721   1HB   GLU  43          1HB       GLU  43  -4.903   2.683   7.761
  722   2HB   GLU  43          2HB       GLU  43  -5.318   0.975   7.679
  723   1HG   GLU  43          1HG       GLU  43  -4.329   0.727   9.997
  724   2HG   GLU  43          2HG       GLU  43  -4.260   2.489  10.067
  725    H    GLU  44           H        GLU  44  -4.299  -0.846   7.382
  726    HA   GLU  44           HA       GLU  44  -2.790  -2.340   9.412
  727   1HB   GLU  44          2HB       GLU  44  -4.317  -4.143   8.756
  728   2HB   GLU  44          1HB       GLU  44  -5.227  -2.643   8.932
  729   1HG   GLU  44          1HG       GLU  44  -5.238  -2.300   6.528
  730   2HG   GLU  44          2HG       GLU  44  -4.168  -3.682   6.288
  731    H    ALA  45           H        ALA  45  -2.831  -1.958   5.899
  732    HA   ALA  45           HA       ALA  45  -1.051  -4.226   5.392
  733   1HB   ALA  45          1HB       ALA  45  -2.866  -2.765   3.974
  734   2HB   ALA  45          2HB       ALA  45  -1.634  -3.783   3.227
  735   3HB   ALA  45          3HB       ALA  45  -1.357  -2.051   3.407
  736    H    ALA  46           H        ALA  46  -0.686  -0.663   5.381
  737    HA   ALA  46           HA       ALA  46   2.150  -0.798   4.741
  738   1HB   ALA  46          1HB       ALA  46   1.999   1.592   4.881
  739   2HB   ALA  46          3HB       ALA  46   0.469   1.033   4.205
  740   3HB   ALA  46          2HB       ALA  46   0.565   1.502   5.904
  741    H    GLN  47           H        GLN  47   0.320  -0.958   7.701
  742    HA   GLN  47           HA       GLN  47   2.378   0.041   9.477
  743   1HB   GLN  47          1HB       GLN  47  -0.192  -1.449   9.625
  744   2HB   GLN  47          2HB       GLN  47   0.888  -1.605  11.011
  745   1HG   GLN  47          1HG       GLN  47  -0.002   1.032   9.807
  746   2HG   GLN  47          2HG       GLN  47  -0.691   0.306  11.260
  747   2HE2  GLN  47          2HE2      GLN  47   0.910  -0.090  13.101
  748   1HE2  GLN  47          1HE2      GLN  47   2.214   0.982  13.271
  749    H    ILE  48           H        ILE  48   1.559  -3.174   8.192
  750    HA   ILE  48           HA       ILE  48   3.160  -4.835   9.792
  751    HB   ILE  48           HB       ILE  48   2.621  -4.861   6.804
  752   1HG1  ILE  48          1HG1      ILE  48   1.266  -6.522   8.924
  753   2HG1  ILE  48          2HG1      ILE  48   0.712  -4.883   8.582
  754   1HG2  ILE  48          1HG2      ILE  48   4.521  -6.329   7.413
  755   2HG2  ILE  48          2HG2      ILE  48   3.517  -7.108   8.636
  756   3HG2  ILE  48          3HG2      ILE  48   3.111  -7.270   6.927
  757   1HD1  ILE  48          1HD1      ILE  48   1.096  -6.917   6.382
  758   2HD1  ILE  48          2HD1      ILE  48  -0.421  -6.789   7.273
  759   3HD1  ILE  48          3HD1      ILE  48   0.170  -5.418   6.335
  760    H    ARG  49           H        ARG  49   4.120  -2.549   7.303
  761    HA   ARG  49           HA       ARG  49   6.740  -3.399   6.703
  762   1HB   ARG  49          1HB       ARG  49   5.758  -1.598   5.502
  763   2HB   ARG  49          2HB       ARG  49   5.352  -0.727   6.975
  764   1HG   ARG  49          1HG       ARG  49   8.203  -1.140   6.879
  765   2HG   ARG  49          2HG       ARG  49   7.664  -0.416   5.364
  766   1HD   ARG  49          1HD       ARG  49   8.211   1.298   7.121
  767   2HD   ARG  49          2HD       ARG  49   6.518   1.379   6.596
  768    HE   ARG  49           HE       ARG  49   5.935   0.042   8.633
  769   1HH1  ARG  49          1HH1      ARG  49   9.256   0.136   8.603
  770   2HH1  ARG  49          2HH1      ARG  49   9.447   0.749  10.212
  771   1HH2  ARG  49          1HH2      ARG  49   6.073   1.432  10.635
  772   2HH2  ARG  49          2HH2      ARG  49   7.645   1.483  11.362
  773    H    ASP  50           H        ASP  50   5.433  -2.030   9.642
  774    HA   ASP  50           HA       ASP  50   8.012  -1.263  10.790
  775   1HB   ASP  50          1HB       ASP  50   5.543  -0.449  11.229
  776   2HB   ASP  50          2HB       ASP  50   5.496  -1.817  12.341
  777    H    GLN  51           H        GLN  51   5.886  -4.088  10.868
  778    HA   GLN  51           HA       GLN  51   7.380  -5.433  12.998
  779   1HB   GLN  51          2HB       GLN  51   5.357  -6.454  10.975
  780   2HB   GLN  51          1HB       GLN  51   5.816  -7.253  12.480
  781   1HG   GLN  51          1HG       GLN  51   4.882  -5.466  13.801
  782   2HG   GLN  51          2HG       GLN  51   4.618  -4.473  12.367
  783   2HE2  GLN  51          2HE2      GLN  51   3.883  -7.947  13.024
  784   1HE2  GLN  51          1HE2      GLN  51   2.236  -7.821  12.635
  785    H    LEU  52           H        LEU  52   7.052  -5.838   9.455
  786    HA   LEU  52           HA       LEU  52   8.840  -8.026   9.147
  787   1HB   LEU  52          1HB       LEU  52   7.193  -6.639   7.557
  788   2HB   LEU  52          2HB       LEU  52   8.701  -5.841   7.109
  789    HG   LEU  52           HG       LEU  52   8.269  -7.755   5.626
  790   1HD1  LEU  52          1HD1      LEU  52  10.623  -7.121   6.654
  791   2HD1  LEU  52          2HD1      LEU  52  10.473  -8.699   7.428
  792   3HD1  LEU  52          3HD1      LEU  52  10.445  -8.573   5.669
  793   1HD2  LEU  52          1HD2      LEU  52   7.045  -8.964   7.634
  794   2HD2  LEU  52          2HD2      LEU  52   7.858  -9.917   6.392
  795   3HD2  LEU  52          3HD2      LEU  52   8.650  -9.628   7.941
  796    H    HIS  53           H        HIS  53   9.444  -4.525   9.290
  797    HA   HIS  53           HA       HIS  53  12.159  -4.463   8.499
  798   1HB   HIS  53          1HB       HIS  53  10.459  -2.601   9.087
  799   2HB   HIS  53          2HB       HIS  53  10.975  -2.837  10.757
  800    HD1  HIS  53           HD1      HIS  53  13.788  -2.835  10.957
  801    HD2  HIS  53           HD2      HIS  53  12.037  -0.742   7.805
  802    HE1  HIS  53           HE1      HIS  53  15.529  -1.189  10.135
  803    H    GLN  54           H        GLN  54  10.833  -4.802  11.817
  804    HA   GLN  54           HA       GLN  54  13.436  -5.315  13.004
  805   1HB   GLN  54          1HB       GLN  54  10.974  -4.526  13.865
  806   2HB   GLN  54          2HB       GLN  54  10.949  -6.224  14.342
  807   1HG   GLN  54          1HG       GLN  54  13.377  -4.567  14.949
  808   2HG   GLN  54          2HG       GLN  54  11.954  -4.424  15.982
  809   2HE2  GLN  54          2HE2      GLN  54  11.752  -5.984  17.604
  810   1HE2  GLN  54          1HE2      GLN  54  12.607  -7.450  17.648
  811    H    LEU  55           H        LEU  55  10.735  -7.339  11.883
  812    HA   LEU  55           HA       LEU  55  11.694  -9.841  12.905
  813   1HB   LEU  55          1HB       LEU  55   9.712  -8.795  10.982
  814   2HB   LEU  55          2HB       LEU  55  10.266 -10.433  10.633
  815    HG   LEU  55           HG       LEU  55   9.492  -9.698  13.441
  816   1HD1  LEU  55          1HD1      LEU  55   7.719  -9.206  11.451
  817   2HD1  LEU  55          2HD1      LEU  55   7.415 -10.924  11.709
  818   3HD1  LEU  55          3HD1      LEU  55   7.239  -9.787  13.046
  819   1HD2  LEU  55          1HD2      LEU  55   9.688 -12.184  11.748
  820   2HD2  LEU  55          2HD2      LEU  55  10.440 -11.849  13.307
  821   3HD2  LEU  55          3HD2      LEU  55   8.710 -12.177  13.215
  822    H    ARG  56           H        ARG  56  12.357  -8.057   9.912
  823    HA   ARG  56           HA       ARG  56  13.640 -10.035   8.374
  824   1HB   ARG  56          1HB       ARG  56  13.105  -7.751   7.633
  825   2HB   ARG  56          2HB       ARG  56  14.299  -7.095   8.753
  826   1HG   ARG  56          1HG       ARG  56  15.981  -8.648   7.521
  827   2HG   ARG  56          2HG       ARG  56  14.754  -8.717   6.255
  828   1HD   ARG  56          1HD       ARG  56  14.825  -6.321   5.946
  829   2HD   ARG  56          2HD       ARG  56  15.857  -6.117   7.376
  830    HE   ARG  56           HE       ARG  56  17.694  -7.059   6.151
  831   1HH1  ARG  56          1HH1      ARG  56  17.530  -9.114   4.573
  832   2HH1  ARG  56          2HH1      ARG  56  17.018  -8.626   2.992
  833   1HH2  ARG  56          1HH2      ARG  56  15.813  -5.549   4.045
  834   2HH2  ARG  56          2HH2      ARG  56  16.046  -6.606   2.693
  835    H    GLU  57           H        GLU  57  15.245  -7.727  10.609
  836    HA   GLU  57           HA       GLU  57  17.833  -8.904  10.502
  837   1HB   GLU  57          2HB       GLU  57  16.465  -7.481  12.811
  838   2HB   GLU  57          1HB       GLU  57  18.203  -7.580  12.524
  839   1HG   GLU  57          1HG       GLU  57  17.639  -6.501  10.215
  840   2HG   GLU  57          2HG       GLU  57  16.125  -6.035  10.992
  841    H    LEU  58           H        LEU  58  15.049  -9.571  12.613
  842    HA   LEU  58           HA       LEU  58  16.222 -11.305  14.495
  843   1HB   LEU  58          1HB       LEU  58  13.665 -10.480  13.636
  844   2HB   LEU  58          2HB       LEU  58  13.634 -12.242  13.574
  845    HG   LEU  58           HG       LEU  58  14.970 -11.292  15.978
  846   1HD1  LEU  58          1HD1      LEU  58  12.260 -10.205  15.273
  847   2HD1  LEU  58          2HD1      LEU  58  12.619 -10.612  16.951
  848   3HD1  LEU  58          3HD1      LEU  58  13.595  -9.411  16.107
  849   1HD2  LEU  58          1HD2      LEU  58  14.021 -13.585  15.479
  850   2HD2  LEU  58          2HD2      LEU  58  13.497 -12.901  17.018
  851   3HD2  LEU  58          3HD2      LEU  58  12.411 -12.880  15.629
  852    H    PHE  59           H        PHE  59  15.612 -11.824  11.096
  853    HA   PHE  59           HA       PHE  59  15.434 -14.618  10.885
  854   1HB   PHE  59          1HB       PHE  59  15.381 -12.748   9.119
  855   2HB   PHE  59          2HB       PHE  59  17.142 -12.860   9.113
  856    HD1  PHE  59           HD1      PHE  59  14.082 -15.036   8.860
  857    HD2  PHE  59           HD2      PHE  59  18.195 -14.415   7.702
  858    HE1  PHE  59           HE1      PHE  59  13.954 -17.011   7.342
  859    HE2  PHE  59           HE2      PHE  59  18.066 -16.388   6.184
  860    HZ   PHE  59           HZ       PHE  59  15.946 -17.687   6.004
  861    H    ILE  60           H        ILE  60  18.457 -12.682  10.838
  862    HA   ILE  60           HA       ILE  60  20.144 -15.052  11.059
  863    HB   ILE  60           HB       ILE  60  20.701 -12.088  11.421
  864   1HG1  ILE  60          1HG1      ILE  60  21.557 -13.407   8.946
  865   2HG1  ILE  60          2HG1      ILE  60  19.805 -13.415   9.155
  866   1HG2  ILE  60          1HG2      ILE  60  22.347 -14.438  11.727
  867   2HG2  ILE  60          2HG2      ILE  60  22.917 -13.490  10.354
  868   3HG2  ILE  60          3HG2      ILE  60  22.789 -12.744  11.947
  869   1HD1  ILE  60          1HD1      ILE  60  21.253 -10.871   9.741
  870   2HD1  ILE  60          2HD1      ILE  60  21.069 -11.335   8.050
  871   3HD1  ILE  60          3HD1      ILE  60  19.643 -11.116   9.064
  872    H    ALA  61           H        ALA  61  19.008 -12.514  13.287
  873    HA   ALA  61           HA       ALA  61  20.580 -13.123  15.554
  874   1HB   ALA  61          1HB       ALA  61  18.622 -11.372  14.910
  875   2HB   ALA  61          3HB       ALA  61  19.118 -11.666  16.575
  876   3HB   ALA  61          2HB       ALA  61  17.696 -12.479  15.923
  877    H    ALA  62           H        ALA  62  17.949 -14.908  14.112
  878    HA   ALA  62           HA       ALA  62  17.669 -16.634  16.525
  879   1HB   ALA  62          1HB       ALA  62  16.032 -17.374  14.273
  880   2HB   ALA  62          3HB       ALA  62  15.968 -15.624  14.484
  881   3HB   ALA  62          2HB       ALA  62  15.524 -16.689  15.818
  882    H    SER  63           H        SER  63  17.593 -17.399  13.035
  883    HA   SER  63           HA       SER  63  19.838 -19.320  13.410
  884   1HB   SER  63          1HB       SER  63  17.058 -19.964  13.418
  885   2HB   SER  63          2HB       SER  63  17.737 -20.577  11.913
  886    HG   SER  63           HG       SER  63  17.907 -21.691  14.239

  No H/Q in entry =         886
  Start of MODEL   18
    1    H    LEU   8           H        LEU   8 -12.537  -3.440  -8.102
    2    HA   LEU   8           HA       LEU   8 -15.495  -3.331  -8.358
    3   1HB   LEU   8          1HB       LEU   8 -13.725  -1.291  -7.187
    4   2HB   LEU   8          2HB       LEU   8 -14.781  -0.665  -8.455
    5    HG   LEU   8           HG       LEU   8 -16.712  -1.801  -7.284
    6   1HD1  LEU   8          1HD1      LEU   8 -14.456  -2.503  -5.471
    7   2HD1  LEU   8          2HD1      LEU   8 -15.981  -2.057  -4.705
    8   3HD1  LEU   8          3HD1      LEU   8 -15.925  -3.406  -5.839
    9   1HD2  LEU   8          1HD2      LEU   8 -15.854   0.663  -6.988
   10   2HD2  LEU   8          2HD2      LEU   8 -17.066   0.034  -5.871
   11   3HD2  LEU   8          3HD2      LEU   8 -15.372   0.110  -5.384
   12    H    GLU   9           H        GLU   9 -16.145  -2.643 -10.461
   13    HA   GLU   9           HA       GLU   9 -14.072  -1.756 -12.384
   14   1HB   GLU   9          1HB       GLU   9 -15.423  -4.438 -12.293
   15   2HB   GLU   9          2HB       GLU   9 -14.998  -3.747 -13.860
   16   1HG   GLU   9          1HG       GLU   9 -12.687  -3.303 -12.517
   17   2HG   GLU   9          2HG       GLU   9 -13.234  -4.770 -11.705
   18    HA   PRO  10           HA       PRO  10 -18.337  -0.077 -13.083
   19   1HB   PRO  10          1HB       PRO  10 -17.583   2.545 -13.279
   20   2HB   PRO  10          2HB       PRO  10 -17.972   1.764 -11.735
   21   1HG   PRO  10          2HG       PRO  10 -15.321   2.381 -12.929
   22   2HG   PRO  10          1HG       PRO  10 -15.844   2.449 -11.239
   23   1HD   PRO  10          1HD       PRO  10 -14.352   0.412 -12.298
   24   2HD   PRO  10          2HD       PRO  10 -15.415   0.236 -10.885
   25    H    ASP  11           H        ASP  11 -15.391   1.342 -14.568
   26    HA   ASP  11           HA       ASP  11 -14.798   1.629 -16.834
   27   1HB   ASP  11          1HB       ASP  11 -16.181  -0.847 -16.545
   28   2HB   ASP  11          2HB       ASP  11 -16.738  -0.111 -18.048
   29    H    ASN  12           H        ASN  12 -18.249   0.868 -17.325
   30    HA   ASN  12           HA       ASN  12 -19.069   3.643 -17.598
   31   1HB   ASN  12          1HB       ASN  12 -17.508   3.026 -19.594
   32   2HB   ASN  12          2HB       ASN  12 -18.884   2.088 -20.177
   33   2HD2  ASN  12          2HD2      ASN  12 -21.077   3.497 -19.989
   34   1HD2  ASN  12          1HD2      ASN  12 -20.944   5.078 -20.593
   35    H    VAL  13           H        VAL  13 -20.132   1.358 -16.254
   36    HA   VAL  13           HA       VAL  13 -22.166  -0.018 -17.709
   37    HB   VAL  13           HB       VAL  13 -21.430   0.564 -14.872
   38   1HG1  VAL  13          1HG1      VAL  13 -24.171  -0.325 -15.757
   39   2HG1  VAL  13          2HG1      VAL  13 -23.489  -0.921 -14.244
   40   3HG1  VAL  13          3HG1      VAL  13 -23.738   0.809 -14.477
   41   1HG2  VAL  13          1HG2      VAL  13 -20.466  -1.319 -16.122
   42   2HG2  VAL  13          2HG2      VAL  13 -21.446  -1.899 -14.775
   43   3HG2  VAL  13          3HG2      VAL  13 -22.083  -1.956 -16.418
   44    HA   PRO  14           HA       PRO  14 -25.204   3.366 -16.330
   45   1HB   PRO  14          1HB       PRO  14 -24.265   5.574 -15.015
   46   2HB   PRO  14          2HB       PRO  14 -24.763   4.091 -14.176
   47   1HG   PRO  14          2HG       PRO  14 -22.041   5.094 -14.785
   48   2HG   PRO  14          1HG       PRO  14 -22.622   4.166 -13.399
   49   1HD   PRO  14          1HD       PRO  14 -21.213   3.114 -15.533
   50   2HD   PRO  14          2HD       PRO  14 -22.231   2.189 -14.416
   51    H    MET  15           H        MET  15 -22.821   5.964 -16.303
   52    HA   MET  15           HA       MET  15 -22.386   6.225 -19.104
   53   1HB   MET  15          1HB       MET  15 -25.018   6.901 -18.143
   54   2HB   MET  15          2HB       MET  15 -24.230   8.365 -18.731
   55   1HG   MET  15          1HG       MET  15 -24.147   7.614 -20.898
   56   2HG   MET  15          2HG       MET  15 -23.933   5.932 -20.417
   57   1HE   MET  15          1HE       MET  15 -26.175   8.884 -20.993
   58   2HE   MET  15          2HE       MET  15 -26.129   7.885 -22.452
   59   3HE   MET  15          3HE       MET  15 -27.649   8.130 -21.597
   60    H    ASP  16           H        ASP  16 -20.663   7.623 -19.225
   61    HA   ASP  16           HA       ASP  16 -19.122   9.302 -18.594
   62   1HB   ASP  16          1HB       ASP  16 -21.591  10.379 -18.889
   63   2HB   ASP  16          2HB       ASP  16 -21.293  10.786 -17.199
   64    H    MET  17           H        MET  17 -18.678   7.349 -16.933
   65    HA   MET  17           HA       MET  17 -19.386   7.406 -14.227
   66   1HB   MET  17          1HB       MET  17 -17.170   6.304 -13.912
   67   2HB   MET  17          2HB       MET  17 -18.035   5.674 -15.313
   68   1HG   MET  17          1HG       MET  17 -16.742   7.198 -16.781
   69   2HG   MET  17          2HG       MET  17 -15.848   7.774 -15.373
   70   1HE   MET  17          1HE       MET  17 -15.167   6.756 -18.014
   71   2HE   MET  17          2HE       MET  17 -13.605   6.030 -17.645
   72   3HE   MET  17          3HE       MET  17 -14.922   5.032 -18.278
   73    H    SER  18           H        SER  18 -16.953   9.400 -15.896
   74    HA   SER  18           HA       SER  18 -16.965  11.251 -13.566
   75   1HB   SER  18          1HB       SER  18 -14.642   9.676 -14.660
   76   2HB   SER  18          2HB       SER  18 -14.372  11.210 -13.838
   77    HG   SER  18           HG       SER  18 -14.690   8.885 -12.728
   78    HA   PRO  19           HA       PRO  19 -16.558  14.192 -16.828
   79   1HB   PRO  19          1HB       PRO  19 -15.595  16.340 -15.457
   80   2HB   PRO  19          2HB       PRO  19 -17.252  15.739 -15.256
   81   1HG   PRO  19          2HG       PRO  19 -14.928  15.486 -13.466
   82   2HG   PRO  19          1HG       PRO  19 -16.652  15.498 -13.079
   83   1HD   PRO  19          1HD       PRO  19 -14.968  13.240 -13.241
   84   2HD   PRO  19          2HD       PRO  19 -16.737  13.242 -13.090
   85    H    LYS  20           H        LYS  20 -14.096  12.427 -16.399
   86    HA   LYS  20           HA       LYS  20 -11.916  12.355 -17.305
   87   1HB   LYS  20          1HB       LYS  20 -13.198  13.841 -19.019
   88   2HB   LYS  20          2HB       LYS  20 -12.359  15.189 -18.251
   89   1HG   LYS  20          1HG       LYS  20 -10.862  12.754 -19.214
   90   2HG   LYS  20          2HG       LYS  20 -11.214  14.105 -20.291
   91   1HD   LYS  20          1HD       LYS  20 -10.247  15.380 -18.045
   92   2HD   LYS  20          2HD       LYS  20  -9.259  13.919 -18.106
   93   1HE   LYS  20          2HE       LYS  20  -8.000  15.144 -19.587
   94   2HE   LYS  20          1HE       LYS  20  -9.258  14.673 -20.748
   95   1HZ   LYS  20          1HZ       LYS  20 -10.527  16.633 -20.111
   96   2HZ   LYS  20          2HZ       LYS  20  -9.309  17.094 -19.021
   97   3HZ   LYS  20          3HZ       LYS  20  -8.999  17.080 -20.692
   98    H    ALA  21           H        ALA  21 -12.349  15.800 -16.364
   99    HA   ALA  21           HA       ALA  21  -9.814  16.259 -15.264
  100   1HB   ALA  21          1HB       ALA  21 -11.603  17.935 -15.615
  101   2HB   ALA  21          3HB       ALA  21 -12.528  17.223 -14.293
  102   3HB   ALA  21          2HB       ALA  21 -10.986  18.015 -13.965
  103    H    LEU  22           H        LEU  22 -12.717  15.048 -13.554
  104    HA   LEU  22           HA       LEU  22 -11.411  14.591 -11.025
  105   1HB   LEU  22          1HB       LEU  22 -13.969  14.503 -12.119
  106   2HB   LEU  22          2HB       LEU  22 -13.638  12.814 -11.751
  107    HG   LEU  22           HG       LEU  22 -14.666  13.818  -9.807
  108   1HD1  LEU  22          1HD1      LEU  22 -12.122  12.612  -9.811
  109   2HD1  LEU  22          2HD1      LEU  22 -12.008  13.946  -8.661
  110   3HD1  LEU  22          3HD1      LEU  22 -13.247  12.708  -8.455
  111   1HD2  LEU  22          1HD2      LEU  22 -14.123  16.166 -10.387
  112   2HD2  LEU  22          2HD2      LEU  22 -13.690  15.794  -8.717
  113   3HD2  LEU  22          3HD2      LEU  22 -12.437  15.872  -9.956
  114    H    GLN  23           H        GLN  23 -12.445  12.329 -13.577
  115    HA   GLN  23           HA       GLN  23 -11.351   9.932 -12.686
  116   1HB   GLN  23          1HB       GLN  23 -12.747  10.227 -14.684
  117   2HB   GLN  23          2HB       GLN  23 -11.452  11.115 -15.483
  118   1HG   GLN  23          2HG       GLN  23 -10.816   9.109 -16.321
  119   2HG   GLN  23          1HG       GLN  23 -10.195   8.775 -14.704
  120   2HE2  GLN  23          2HE2      GLN  23 -11.134   7.031 -13.608
  121   1HE2  GLN  23          1HE2      GLN  23 -12.575   6.264 -14.074
  122    H    GLN  24           H        GLN  24  -9.681  12.336 -14.765
  123    HA   GLN  24           HA       GLN  24  -7.148  11.001 -14.794
  124   1HB   GLN  24          1HB       GLN  24  -8.240  13.003 -16.153
  125   2HB   GLN  24          2HB       GLN  24  -7.421  13.984 -14.937
  126   1HG   GLN  24          1HG       GLN  24  -5.630  11.930 -15.865
  127   2HG   GLN  24          2HG       GLN  24  -6.283  12.806 -17.250
  128   2HE2  GLN  24          2HE2      GLN  24  -3.589  12.881 -15.542
  129   1HE2  GLN  24          1HE2      GLN  24  -3.327  14.551 -15.376
  130    H    LYS  25           H        LYS  25  -8.564  13.390 -12.582
  131    HA   LYS  25           HA       LYS  25  -6.170  13.981 -11.105
  132   1HB   LYS  25          1HB       LYS  25  -9.134  14.226 -10.758
  133   2HB   LYS  25          2HB       LYS  25  -8.110  14.487  -9.346
  134   1HG   LYS  25          1HG       LYS  25  -6.975  16.299 -10.358
  135   2HG   LYS  25          2HG       LYS  25  -7.534  15.858 -11.972
  136   1HD   LYS  25          1HD       LYS  25  -9.531  16.914 -11.706
  137   2HD   LYS  25          2HD       LYS  25  -9.693  16.388 -10.030
  138   1HE   LYS  25          1HE       LYS  25  -8.956  18.398  -9.291
  139   2HE   LYS  25          2HE       LYS  25  -7.486  18.254 -10.275
  140   1HZ   LYS  25          1HZ       LYS  25 -10.121  18.922 -11.452
  141   2HZ   LYS  25          2HZ       LYS  25  -9.057  20.120 -10.896
  142   3HZ   LYS  25          3HZ       LYS  25  -8.585  19.086 -12.159
  143    H    ILE  26           H        ILE  26  -8.787  11.602 -10.577
  144    HA   ILE  26           HA       ILE  26  -7.709  10.538  -8.122
  145    HB   ILE  26           HB       ILE  26  -9.578   9.423 -10.237
  146   1HG1  ILE  26          1HG1      ILE  26 -10.189  10.685  -7.548
  147   2HG1  ILE  26          2HG1      ILE  26 -10.230  11.570  -9.073
  148   1HG2  ILE  26          1HG2      ILE  26  -8.554   7.676  -8.755
  149   2HG2  ILE  26          2HG2      ILE  26  -9.204   8.539  -7.361
  150   3HG2  ILE  26          3HG2      ILE  26 -10.300   7.830  -8.547
  151   1HD1  ILE  26          1HD1      ILE  26 -11.822   9.698  -9.887
  152   2HD1  ILE  26          2HD1      ILE  26 -11.995   9.295  -8.179
  153   3HD1  ILE  26          3HD1      ILE  26 -12.470  10.891  -8.761
  154    H    HIS  27           H        HIS  27  -7.703   9.223 -11.463
  155    HA   HIS  27           HA       HIS  27  -6.040   6.976 -10.961
  156   1HB   HIS  27          1HB       HIS  27  -6.981   8.607 -13.238
  157   2HB   HIS  27          2HB       HIS  27  -5.483   7.727 -13.543
  158    HD1  HIS  27           HD1      HIS  27  -5.915   5.141 -12.049
  159    HD2  HIS  27           HD2      HIS  27  -8.937   6.949 -14.280
  160    HE1  HIS  27           HE1      HIS  27  -7.575   3.314 -12.619
  161    H    GLU  28           H        GLU  28  -5.258  10.368 -11.252
  162    HA   GLU  28           HA       GLU  28  -2.476  10.124 -11.951
  163   1HB   GLU  28          1HB       GLU  28  -4.402  12.135 -10.993
  164   2HB   GLU  28          2HB       GLU  28  -2.743  12.440 -10.473
  165   1HG   GLU  28          1HG       GLU  28  -2.870  11.608 -13.266
  166   2HG   GLU  28          2HG       GLU  28  -3.820  13.065 -12.970
  167    H    LEU  29           H        LEU  29  -3.837  11.062  -8.767
  168    HA   LEU  29           HA       LEU  29  -1.424  10.485  -7.320
  169   1HB   LEU  29          1HB       LEU  29  -4.322  10.987  -6.700
  170   2HB   LEU  29          2HB       LEU  29  -3.239  10.486  -5.400
  171    HG   LEU  29           HG       LEU  29  -1.731  12.413  -6.611
  172   1HD1  LEU  29          1HD1      LEU  29  -3.608  12.970  -8.145
  173   2HD1  LEU  29          2HD1      LEU  29  -4.619  13.336  -6.746
  174   3HD1  LEU  29          3HD1      LEU  29  -3.196  14.321  -7.088
  175   1HD2  LEU  29          1HD2      LEU  29  -2.648  12.002  -4.154
  176   2HD2  LEU  29          2HD2      LEU  29  -2.046  13.590  -4.630
  177   3HD2  LEU  29          3HD2      LEU  29  -3.781  13.277  -4.599
  178    H    GLU  30           H        GLU  30  -4.350   8.578  -7.989
  179    HA   GLU  30           HA       GLU  30  -3.835   6.380  -6.249
  180   1HB   GLU  30          1HB       GLU  30  -5.935   6.924  -7.524
  181   2HB   GLU  30          2HB       GLU  30  -5.125   6.387  -8.997
  182   1HG   GLU  30          1HG       GLU  30  -4.828   4.414  -6.895
  183   2HG   GLU  30          2HG       GLU  30  -6.532   4.778  -7.170
  184    H    GLY  31           H        GLY  31  -2.926   6.882  -9.676
  185   1HA   GLY  31          2HA       GLY  31  -1.219   5.895 -10.949
  186   2HA   GLY  31          1HA       GLY  31  -1.598   4.411 -10.074
  187    H    LEU  32           H        LEU  32  -0.544   7.372  -8.490
  188    HA   LEU  32           HA       LEU  32   2.263   6.610  -8.310
  189   1HB   LEU  32          1HB       LEU  32   1.498   8.936  -8.266
  190   2HB   LEU  32          2HB       LEU  32   0.526   8.613  -6.829
  191    HG   LEU  32           HG       LEU  32   2.682   7.918  -5.671
  192   1HD1  LEU  32          1HD1      LEU  32   3.738   8.966  -8.287
  193   2HD1  LEU  32          2HD1      LEU  32   4.706   9.114  -6.820
  194   3HD1  LEU  32          3HD1      LEU  32   4.218   7.521  -7.399
  195   1HD2  LEU  32          1HD2      LEU  32   1.676  10.556  -6.339
  196   2HD2  LEU  32          2HD2      LEU  32   2.355   9.981  -4.817
  197   3HD2  LEU  32          3HD2      LEU  32   3.420  10.605  -6.077
  198    H    MET  33           H        MET  33  -0.615   6.195  -6.309
  199    HA   MET  33           HA       MET  33   0.855   5.228  -3.970
  200   1HB   MET  33          1HB       MET  33  -1.282   6.406  -3.792
  201   2HB   MET  33          2HB       MET  33  -2.062   5.193  -4.808
  202   1HG   MET  33          1HG       MET  33  -0.634   4.176  -2.409
  203   2HG   MET  33          2HG       MET  33  -2.116   5.085  -2.112
  204   1HE   MET  33          1HE       MET  33  -4.027   4.650  -2.297
  205   2HE   MET  33          2HE       MET  33  -4.834   3.746  -3.576
  206   3HE   MET  33          3HE       MET  33  -4.560   2.987  -2.010
  207    H    MET  34           H        MET  34  -0.621   3.830  -6.833
  208    HA   MET  34           HA       MET  34  -0.666   1.092  -5.803
  209   1HB   MET  34          1HB       MET  34  -2.147   2.228  -7.581
  210   2HB   MET  34          2HB       MET  34  -0.781   2.018  -8.678
  211   1HG   MET  34          1HG       MET  34  -1.445  -0.100  -9.047
  212   2HG   MET  34          2HG       MET  34  -1.130  -0.462  -7.351
  213   1HE   MET  34          1HE       MET  34  -2.628  -1.507  -6.057
  214   2HE   MET  34          2HE       MET  34  -4.332  -1.791  -6.396
  215   3HE   MET  34          3HE       MET  34  -3.095  -2.373  -7.518
  216    H    GLN  35           H        GLN  35   1.380   2.913  -8.113
  217    HA   GLN  35           HA       GLN  35   3.092   0.833  -8.932
  218   1HB   GLN  35          2HB       GLN  35   4.671   2.692  -9.386
  219   2HB   GLN  35          1HB       GLN  35   3.026   3.111  -9.864
  220   1HG   GLN  35          1HG       GLN  35   2.710   4.328  -7.746
  221   2HG   GLN  35          2HG       GLN  35   4.350   3.903  -7.254
  222   2HE2  GLN  35          2HE2      GLN  35   2.834   5.272 -10.243
  223   1HE2  GLN  35          1HE2      GLN  35   3.983   6.509 -10.425
  224    H    HIS  36           H        HIS  36   3.207   2.784  -5.953
  225    HA   HIS  36           HA       HIS  36   5.750   1.623  -5.084
  226   1HB   HIS  36          1HB       HIS  36   3.612   3.386  -3.874
  227   2HB   HIS  36          2HB       HIS  36   5.018   2.860  -2.947
  228    HD1  HIS  36           HD1      HIS  36   3.937   5.381  -5.365
  229    HD2  HIS  36           HD2      HIS  36   7.572   3.683  -4.230
  230    HE1  HIS  36           HE1      HIS  36   5.750   6.915  -6.244
  231    H    ALA  37           H        ALA  37   2.337   1.318  -4.019
  232    HA   ALA  37           HA       ALA  37   2.627  -0.551  -1.946
  233   1HB   ALA  37          1HB       ALA  37   0.329  -1.334  -3.249
  234   2HB   ALA  37          2HB       ALA  37   0.582   0.283  -3.907
  235   3HB   ALA  37          3HB       ALA  37   0.437   0.052  -2.165
  236    H    GLN  38           H        GLN  38   2.667  -1.102  -5.456
  237    HA   GLN  38           HA       GLN  38   2.635  -3.996  -5.315
  238   1HB   GLN  38          1HB       GLN  38   3.293  -1.869  -7.343
  239   2HB   GLN  38          2HB       GLN  38   3.617  -3.563  -7.714
  240   1HG   GLN  38          1HG       GLN  38   1.219  -4.063  -7.078
  241   2HG   GLN  38          2HG       GLN  38   0.949  -2.322  -6.998
  242   2HE2  GLN  38          2HE2      GLN  38  -0.637  -3.049  -8.863
  243   1HE2  GLN  38          1HE2      GLN  38   0.003  -3.009 -10.435
  244    H    ASN  39           H        ASN  39   5.206  -1.538  -5.493
  245    HA   ASN  39           HA       ASN  39   7.308  -3.631  -5.447
  246   1HB   ASN  39          1HB       ASN  39   7.184  -0.625  -5.730
  247   2HB   ASN  39          2HB       ASN  39   8.724  -1.457  -5.504
  248   2HD2  ASN  39          2HD2      ASN  39   9.291  -0.749  -7.753
  249   1HD2  ASN  39          1HD2      ASN  39   8.665  -1.605  -9.079
  250    H    LEU  40           H        LEU  40   5.388  -2.846  -3.112
  251    HA   LEU  40           HA       LEU  40   5.558  -2.619  -0.773
  252   1HB   LEU  40          1HB       LEU  40   7.979  -4.029  -1.779
  253   2HB   LEU  40          2HB       LEU  40   8.035  -3.470  -0.106
  254    HG   LEU  40           HG       LEU  40   5.496  -4.569  -0.321
  255   1HD1  LEU  40          1HD1      LEU  40   6.538  -5.489  -2.567
  256   2HD1  LEU  40          2HD1      LEU  40   7.343  -6.629  -1.488
  257   3HD1  LEU  40          3HD1      LEU  40   5.582  -6.555  -1.538
  258   1HD2  LEU  40          1HD2      LEU  40   7.201  -4.762   1.528
  259   2HD2  LEU  40          2HD2      LEU  40   6.371  -6.274   1.163
  260   3HD2  LEU  40          3HD2      LEU  40   8.012  -6.006   0.577
  261    H    GLU  41           H        GLU  41   6.536  -0.381  -2.620
  262    HA   GLU  41           HA       GLU  41   8.438   0.973  -0.742
  263   1HB   GLU  41          1HB       GLU  41   7.806   1.115  -3.677
  264   2HB   GLU  41          2HB       GLU  41   8.523   2.518  -2.885
  265   1HG   GLU  41          1HG       GLU  41   9.791  -0.086  -2.257
  266   2HG   GLU  41          2HG       GLU  41   9.990   0.478  -3.917
  267    H    PHE  42           H        PHE  42   5.267   0.721  -0.877
  268    HA   PHE  42           HA       PHE  42   4.363   3.397  -1.215
  269   1HB   PHE  42          2HB       PHE  42   2.242   2.468  -0.688
  270   2HB   PHE  42          1HB       PHE  42   3.124   1.260  -1.602
  271    HD1  PHE  42           HD1      PHE  42   4.973   0.720   1.082
  272    HD2  PHE  42           HD2      PHE  42   0.771   0.645   0.110
  273    HE1  PHE  42           HE1      PHE  42   4.584  -0.917   2.908
  274    HE2  PHE  42           HE2      PHE  42   0.379  -0.995   1.947
  275    HZ   PHE  42           HZ       PHE  42   2.287  -1.775   3.346
  276    H    GLU  43           H        GLU  43   6.470   3.007   0.997
  277    HA   GLU  43           HA       GLU  43   5.260   3.288   3.558
  278   1HB   GLU  43          1HB       GLU  43   7.664   3.001   3.237
  279   2HB   GLU  43          2HB       GLU  43   7.755   4.497   2.306
  280   1HG   GLU  43          1HG       GLU  43   6.881   5.694   4.378
  281   2HG   GLU  43          2HG       GLU  43   7.165   4.190   5.257
  282    H    GLU  44           H        GLU  44   6.619   5.960   1.626
  283    HA   GLU  44           HA       GLU  44   4.727   7.885   2.798
  284   1HB   GLU  44          1HB       GLU  44   6.036   9.460   1.375
  285   2HB   GLU  44          2HB       GLU  44   7.086   8.447   2.367
  286   1HG   GLU  44          1HG       GLU  44   7.856   7.235   0.561
  287   2HG   GLU  44          2HG       GLU  44   6.359   7.438  -0.348
  288    H    ALA  45           H        ALA  45   4.957   5.864  -0.031
  289    HA   ALA  45           HA       ALA  45   3.279   7.422  -1.805
  290   1HB   ALA  45          1HB       ALA  45   3.998   5.800  -3.216
  291   2HB   ALA  45          3HB       ALA  45   4.876   5.099  -1.853
  292   3HB   ALA  45          2HB       ALA  45   3.247   4.538  -2.235
  293    H    ALA  46           H        ALA  46   2.610   4.557   0.254
  294    HA   ALA  46           HA       ALA  46  -0.106   4.181  -0.368
  295   1HB   ALA  46          1HB       ALA  46   1.472   2.825   1.112
  296   2HB   ALA  46          3HB       ALA  46   1.120   3.984   2.395
  297   3HB   ALA  46          2HB       ALA  46  -0.175   2.992   1.720
  298    H    GLN  47           H        GLN  47   1.375   6.571   1.794
  299    HA   GLN  47           HA       GLN  47  -0.896   7.495   3.179
  300   1HB   GLN  47          1HB       GLN  47   1.723   8.560   2.268
  301   2HB   GLN  47          2HB       GLN  47   0.527   9.761   2.760
  302   1HG   GLN  47          1HG       GLN  47   1.672   9.229   4.762
  303   2HG   GLN  47          2HG       GLN  47   0.182   8.294   4.853
  304   2HE2  GLN  47          2HE2      GLN  47   0.417   5.958   3.897
  305   1HE2  GLN  47          1HE2      GLN  47   1.875   5.154   4.227
  306    H    ILE  48           H        ILE  48   0.049   8.009  -0.180
  307    HA   ILE  48           HA       ILE  48  -1.507  10.250  -0.889
  308    HB   ILE  48           HB       ILE  48  -0.916   7.652  -2.348
  309   1HG1  ILE  48          1HG1      ILE  48   1.059   8.950  -1.610
  310   2HG1  ILE  48          2HG1      ILE  48   0.900   8.975  -3.366
  311   1HG2  ILE  48          1HG2      ILE  48  -2.236  10.201  -3.221
  312   2HG2  ILE  48          2HG2      ILE  48  -1.194   9.348  -4.360
  313   3HG2  ILE  48          3HG2      ILE  48  -2.604   8.538  -3.680
  314   1HD1  ILE  48          1HD1      ILE  48  -0.629  11.150  -2.496
  315   2HD1  ILE  48          2HD1      ILE  48   0.814  11.191  -1.484
  316   3HD1  ILE  48          3HD1      ILE  48   0.969  11.225  -3.240
  317    H    ARG  49           H        ARG  49  -2.485   6.946  -0.177
  318    HA   ARG  49           HA       ARG  49  -5.105   6.888  -1.236
  319   1HB   ARG  49          1HB       ARG  49  -4.137   4.927  -0.293
  320   2HB   ARG  49          2HB       ARG  49  -3.750   5.742   1.217
  321   1HG   ARG  49          1HG       ARG  49  -6.590   5.906   0.772
  322   2HG   ARG  49          2HG       ARG  49  -6.076   4.228   0.606
  323   1HD   ARG  49          1HD       ARG  49  -6.644   4.816   2.975
  324   2HD   ARG  49          2HD       ARG  49  -4.944   4.341   2.799
  325    HE   ARG  49           HE       ARG  49  -4.437   6.831   2.642
  326   1HH1  ARG  49          1HH1      ARG  49  -7.630   7.083   2.781
  327   2HH1  ARG  49          2HH1      ARG  49  -7.754   7.847   4.330
  328   1HH2  ARG  49          1HH2      ARG  49  -4.463   7.203   5.208
  329   2HH2  ARG  49          2HH2      ARG  49  -5.961   7.915   5.705
  330    H    ASP  50           H        ASP  50  -3.769   8.631   1.492
  331    HA   ASP  50           HA       ASP  50  -6.246   9.270   2.831
  332   1HB   ASP  50          1HB       ASP  50  -3.563   9.526   3.309
  333   2HB   ASP  50          2HB       ASP  50  -3.990  11.190   2.907
  334    H    GLN  51           H        GLN  51  -4.369  10.782   0.223
  335    HA   GLN  51           HA       GLN  51  -6.078  13.156   0.078
  336   1HB   GLN  51          1HB       GLN  51  -4.090  11.987  -1.899
  337   2HB   GLN  51          2HB       GLN  51  -4.659  13.656  -1.849
  338   1HG   GLN  51          1HG       GLN  51  -3.609  14.010   0.310
  339   2HG   GLN  51          2HG       GLN  51  -3.169  12.304   0.419
  340   2HE2  GLN  51          2HE2      GLN  51  -2.942  14.154  -2.610
  341   1HE2  GLN  51          1HE2      GLN  51  -1.247  14.129  -2.696
  342    H    LEU  52           H        LEU  52  -5.808  10.052  -1.619
  343    HA   LEU  52           HA       LEU  52  -7.540  10.535  -3.809
  344   1HB   LEU  52          1HB       LEU  52  -6.344   8.313  -2.346
  345   2HB   LEU  52          2HB       LEU  52  -7.937   7.891  -2.969
  346    HG   LEU  52           HG       LEU  52  -6.143   7.389  -4.610
  347   1HD1  LEU  52          1HD1      LEU  52  -8.347   9.321  -5.100
  348   2HD1  LEU  52          2HD1      LEU  52  -7.148   9.170  -6.384
  349   3HD1  LEU  52          3HD1      LEU  52  -8.041   7.750  -5.840
  350   1HD2  LEU  52          1HD2      LEU  52  -5.672  10.376  -4.377
  351   2HD2  LEU  52          2HD2      LEU  52  -4.516   9.083  -4.061
  352   3HD2  LEU  52          3HD2      LEU  52  -5.054   9.401  -5.710
  353    H    HIS  53           H        HIS  53  -8.247  10.001  -0.414
  354    HA   HIS  53           HA       HIS  53 -11.062   9.342  -0.782
  355   1HB   HIS  53          1HB       HIS  53  -9.130   9.904   1.413
  356   2HB   HIS  53          2HB       HIS  53 -10.834  10.157   1.788
  357    HD1  HIS  53           HD1      HIS  53 -11.707   8.105   2.892
  358    HD2  HIS  53           HD2      HIS  53  -9.094   7.168  -0.218
  359    HE1  HIS  53           HE1      HIS  53 -11.674   5.579   2.721
  360    H    GLN  54           H        GLN  54  -9.279  12.290   0.196
  361    HA   GLN  54           HA       GLN  54 -11.567  13.966   0.565
  362   1HB   GLN  54          1HB       GLN  54  -9.294  14.445   1.379
  363   2HB   GLN  54          2HB       GLN  54  -8.717  14.583  -0.283
  364   1HG   GLN  54          1HG       GLN  54  -9.621  16.658  -0.563
  365   2HG   GLN  54          2HG       GLN  54 -11.059  16.267   0.382
  366   2HE2  GLN  54          2HE2      GLN  54  -8.313  18.177   0.456
  367   1HE2  GLN  54          1HE2      GLN  54  -8.165  18.374   2.135
  368    H    LEU  55           H        LEU  55  -9.553  13.301  -2.303
  369    HA   LEU  55           HA       LEU  55 -10.622  15.223  -4.080
  370   1HB   LEU  55          1HB       LEU  55  -9.411  12.481  -4.292
  371   2HB   LEU  55          2HB       LEU  55 -10.039  13.254  -5.749
  372    HG   LEU  55           HG       LEU  55  -8.528  15.203  -4.305
  373   1HD1  LEU  55          1HD1      LEU  55  -7.487  12.497  -4.062
  374   2HD1  LEU  55          2HD1      LEU  55  -6.372  13.533  -4.953
  375   3HD1  LEU  55          3HD1      LEU  55  -6.894  13.989  -3.332
  376   1HD2  LEU  55          1HD2      LEU  55  -8.960  15.069  -6.766
  377   2HD2  LEU  55          2HD2      LEU  55  -7.250  15.274  -6.385
  378   3HD2  LEU  55          3HD2      LEU  55  -7.866  13.688  -6.850
  379    H    ARG  56           H        ARG  56 -11.973  12.172  -2.950
  380    HA   ARG  56           HA       ARG  56 -13.950  11.663  -4.896
  381   1HB   ARG  56          1HB       ARG  56 -13.405  10.182  -3.029
  382   2HB   ARG  56          2HB       ARG  56 -13.981  11.382  -1.872
  383   1HG   ARG  56          1HG       ARG  56 -16.137  11.085  -3.588
  384   2HG   ARG  56          2HG       ARG  56 -15.505   9.445  -3.453
  385   1HD   ARG  56          1HD       ARG  56 -15.388  10.148  -0.850
  386   2HD   ARG  56          2HD       ARG  56 -16.751  11.163  -1.363
  387    HE   ARG  56           HE       ARG  56 -17.115   8.593  -2.515
  388   1HH1  ARG  56          1HH1      ARG  56 -18.565  10.475  -0.312
  389   2HH1  ARG  56          2HH1      ARG  56 -18.988   9.231   0.817
  390   1HH2  ARG  56          1HH2      ARG  56 -16.993   6.824  -0.684
  391   2HH2  ARG  56          2HH2      ARG  56 -18.098   7.164   0.606
  392    H    GLU  57           H        GLU  57 -14.139  13.786  -2.027
  393    HA   GLU  57           HA       GLU  57 -16.804  14.639  -2.182
  394   1HB   GLU  57          1HB       GLU  57 -15.327  15.231  -0.368
  395   2HB   GLU  57          2HB       GLU  57 -14.222  16.060  -1.464
  396   1HG   GLU  57          1HG       GLU  57 -17.071  16.980  -1.347
  397   2HG   GLU  57          2HG       GLU  57 -15.984  17.426  -0.034
  398    H    LEU  58           H        LEU  58 -14.033  16.434  -3.552
  399    HA   LEU  58           HA       LEU  58 -15.333  18.386  -5.025
  400   1HB   LEU  58          1HB       LEU  58 -12.851  16.743  -5.454
  401   2HB   LEU  58          2HB       LEU  58 -13.305  17.971  -6.635
  402    HG   LEU  58           HG       LEU  58 -13.431  18.837  -3.809
  403   1HD1  LEU  58          1HD1      LEU  58 -10.963  17.741  -5.055
  404   2HD1  LEU  58          2HD1      LEU  58 -10.800  19.286  -4.219
  405   3HD1  LEU  58          3HD1      LEU  58 -11.401  17.872  -3.351
  406   1HD2  LEU  58          1HD2      LEU  58 -13.704  20.160  -6.059
  407   2HD2  LEU  58          2HD2      LEU  58 -12.805  20.899  -4.734
  408   3HD2  LEU  58          3HD2      LEU  58 -11.940  20.146  -6.073
  409    H    PHE  59           H        PHE  59 -15.216  14.948  -5.784
  410    HA   PHE  59           HA       PHE  59 -15.742  14.859  -8.524
  411   1HB   PHE  59          1HB       PHE  59 -15.471  12.942  -6.953
  412   2HB   PHE  59          2HB       PHE  59 -17.087  13.259  -6.324
  413    HD1  PHE  59           HD1      PHE  59 -19.078  13.170  -7.927
  414    HD2  PHE  59           HD2      PHE  59 -15.156  11.687  -8.957
  415    HE1  PHE  59           HE1      PHE  59 -20.071  11.834  -9.782
  416    HE2  PHE  59           HE2      PHE  59 -16.149  10.351 -10.814
  417    HZ   PHE  59           HZ       PHE  59 -18.607  10.425 -11.226
  418    H    ILE  60           H        ILE  60 -18.166  15.296  -5.919
  419    HA   ILE  60           HA       ILE  60 -20.446  15.525  -7.631
  420    HB   ILE  60           HB       ILE  60 -19.826  16.667  -4.886
  421   1HG1  ILE  60          1HG1      ILE  60 -21.543  14.268  -5.348
  422   2HG1  ILE  60          2HG1      ILE  60 -19.802  14.065  -5.543
  423   1HG2  ILE  60          1HG2      ILE  60 -22.047  17.131  -6.584
  424   2HG2  ILE  60          2HG2      ILE  60 -22.592  16.000  -5.346
  425   3HG2  ILE  60          3HG2      ILE  60 -21.896  17.551  -4.877
  426   1HD1  ILE  60          1HD1      ILE  60 -20.314  15.620  -3.176
  427   2HD1  ILE  60          2HD1      ILE  60 -21.267  14.136  -3.117
  428   3HD1  ILE  60          3HD1      ILE  60 -19.517  14.053  -3.313
  429    H    ALA  61           H        ALA  61 -18.236  17.985  -6.287
  430    HA   ALA  61           HA       ALA  61 -19.572  20.315  -7.192
  431   1HB   ALA  61          1HB       ALA  61 -17.426  19.838  -5.718
  432   2HB   ALA  61          3HB       ALA  61 -16.581  20.053  -7.251
  433   3HB   ALA  61          2HB       ALA  61 -17.568  21.360  -6.598
  434    H    ALA  62           H        ALA  62 -17.834  17.887  -8.978
  435    HA   ALA  62           HA       ALA  62 -17.662  19.657 -11.378
  436   1HB   ALA  62          1HB       ALA  62 -16.216  17.351 -10.251
  437   2HB   ALA  62          3HB       ALA  62 -15.630  18.628 -11.316
  438   3HB   ALA  62          2HB       ALA  62 -16.484  17.240 -11.990
  439    H    SER  63           H        SER  63 -18.408  16.194 -10.806
  440    HA   SER  63           HA       SER  63 -20.054  15.985 -13.178
  441   1HB   SER  63          1HB       SER  63 -18.719  14.228 -11.771
  442   2HB   SER  63          2HB       SER  63 -20.174  14.160 -10.781
  443    HG   SER  63           HG       SER  63 -20.018  13.758 -13.592
  444    H    LEU   8           H        LEU   8  12.239  -7.030  -5.847
  445    HA   LEU   8           HA       LEU   8  15.192  -7.357  -5.878
  446   1HB   LEU   8          1HB       LEU   8  13.480  -6.790  -3.550
  447   2HB   LEU   8          2HB       LEU   8  14.516  -8.203  -3.336
  448    HG   LEU   8           HG       LEU   8  16.455  -6.788  -4.129
  449   1HD1  LEU   8          1HD1      LEU   8  14.230  -4.811  -4.236
  450   2HD1  LEU   8          2HD1      LEU   8  15.778  -4.232  -3.621
  451   3HD1  LEU   8          3HD1      LEU   8  15.677  -4.930  -5.237
  452   1HD2  LEU   8          1HD2      LEU   8  15.642  -7.196  -1.667
  453   2HD2  LEU   8          2HD2      LEU   8  16.868  -5.967  -1.974
  454   3HD2  LEU   8          3HD2      LEU   8  15.188  -5.493  -1.728
  455    H    GLU   9           H        GLU   9  15.805  -9.579  -5.834
  456    HA   GLU   9           HA       GLU   9  13.703 -11.641  -5.491
  457   1HB   GLU   9          1HB       GLU   9  15.015 -10.809  -8.061
  458   2HB   GLU   9          2HB       GLU   9  14.566 -12.500  -7.840
  459   1HG   GLU   9          1HG       GLU   9  12.292 -11.301  -6.983
  460   2HG   GLU   9          2HG       GLU   9  12.835 -10.112  -8.167
  461    HA   PRO  10           HA       PRO  10  17.976 -12.865  -4.172
  462   1HB   PRO  10          1HB       PRO  10  17.258 -13.791  -1.699
  463   2HB   PRO  10          2HB       PRO  10  17.669 -12.094  -2.015
  464   1HG   PRO  10          2HG       PRO  10  15.002 -13.370  -1.709
  465   2HG   PRO  10          1HG       PRO  10  15.563 -11.779  -1.172
  466   1HD   PRO  10          1HD       PRO  10  14.018 -12.185  -3.395
  467   2HD   PRO  10          2HD       PRO  10  15.109 -10.798  -3.182
  468    H    ASP  11           H        ASP  11  15.019 -14.644  -3.175
  469    HA   ASP  11           HA       ASP  11  14.381 -16.886  -3.538
  470   1HB   ASP  11          1HB       ASP  11  15.732 -15.923  -5.856
  471   2HB   ASP  11          2HB       ASP  11  16.266 -17.583  -5.591
  472    H    ASN  12           H        ASN  12  17.807 -17.198  -4.479
  473    HA   ASN  12           HA       ASN  12  18.663 -18.268  -1.916
  474   1HB   ASN  12          1HB       ASN  12  17.049 -19.977  -3.045
  475   2HB   ASN  12          2HB       ASN  12  18.396 -20.290  -4.140
  476   2HD2  ASN  12          2HD2      ASN  12  20.615 -20.551  -2.782
  477   1HD2  ASN  12          1HD2      ASN  12  20.492 -21.580  -1.437
  478    H    VAL  13           H        VAL  13  19.721 -16.345  -3.742
  479    HA   VAL  13           HA       VAL  13  21.701 -17.379  -5.518
  480    HB   VAL  13           HB       VAL  13  21.038 -14.816  -4.133
  481   1HG1  VAL  13          1HG1      VAL  13  23.745 -15.455  -5.296
  482   2HG1  VAL  13          2HG1      VAL  13  23.088 -13.823  -5.420
  483   3HG1  VAL  13          3HG1      VAL  13  23.357 -14.547  -3.834
  484   1HG2  VAL  13          1HG2      VAL  13  20.017 -15.456  -6.275
  485   2HG2  VAL  13          2HG2      VAL  13  21.018 -14.017  -6.466
  486   3HG2  VAL  13          3HG2      VAL  13  21.618 -15.585  -7.004
  487    HA   PRO  14           HA       PRO  14  24.820 -17.079  -1.946
  488   1HB   PRO  14          1HB       PRO  14  23.945 -16.437   0.565
  489   2HB   PRO  14          2HB       PRO  14  24.438 -15.217  -0.625
  490   1HG   PRO  14          2HG       PRO  14  21.718 -16.041   0.219
  491   2HG   PRO  14          1HG       PRO  14  22.317 -14.457  -0.287
  492   1HD   PRO  14          1HD       PRO  14  20.844 -16.174  -1.876
  493   2HD   PRO  14          2HD       PRO  14  21.873 -14.858  -2.464
  494    H    MET  15           H        MET  15  22.478 -17.757   0.599
  495    HA   MET  15           HA       MET  15  21.984 -20.507   0.058
  496   1HB   MET  15          1HB       MET  15  24.647 -19.825   0.925
  497   2HB   MET  15          2HB       MET  15  23.867 -20.795   2.176
  498   1HG   MET  15          1HG       MET  15  23.724 -22.654   0.838
  499   2HG   MET  15          2HG       MET  15  23.496 -21.707  -0.632
  500   1HE   MET  15          1HE       MET  15  25.769 -23.143   1.985
  501   2HE   MET  15          2HE       MET  15  25.675 -24.254   0.611
  502   3HE   MET  15          3HE       MET  15  27.218 -23.532   1.060
  503    H    ASP  16           H        ASP  16  20.279 -20.995   1.398
  504    HA   ASP  16           HA       ASP  16  18.779 -20.845   3.219
  505   1HB   ASP  16          1HB       ASP  16  21.256 -21.479   4.115
  506   2HB   ASP  16          2HB       ASP  16  21.003 -19.972   4.994
  507    H    MET  17           H        MET  17  18.343 -18.687   1.832
  508    HA   MET  17           HA       MET  17  19.113 -16.123   2.647
  509   1HB   MET  17          1HB       MET  17  16.887 -15.468   1.729
  510   2HB   MET  17          2HB       MET  17  17.711 -16.644   0.705
  511   1HG   MET  17          1HG       MET  17  16.408 -18.465   1.772
  512   2HG   MET  17          2HG       MET  17  15.556 -17.266   2.746
  513   1HE   MET  17          1HE       MET  17  14.801 -19.492   1.028
  514   2HE   MET  17          2HE       MET  17  13.236 -18.904   0.471
  515   3HE   MET  17          3HE       MET  17  14.523 -19.246  -0.694
  516    H    SER  18           H        SER  18  16.673 -18.252   4.131
  517    HA   SER  18           HA       SER  18  16.764 -16.551   6.570
  518   1HB   SER  18          1HB       SER  18  14.393 -17.107   4.797
  519   2HB   SER  18          2HB       SER  18  14.166 -16.755   6.506
  520    HG   SER  18           HG       SER  18  14.473 -15.031   4.591
  521    HA   PRO  19           HA       PRO  19  16.329 -20.511   8.462
  522   1HB   PRO  19          1HB       PRO  19  15.430 -19.797  10.932
  523   2HB   PRO  19          2HB       PRO  19  17.081 -19.461  10.380
  524   1HG   PRO  19          2HG       PRO  19  14.795 -17.633  10.698
  525   2HG   PRO  19          1HG       PRO  19  16.526 -17.296  10.784
  526   1HD   PRO  19          1HD       PRO  19  14.805 -16.775   8.610
  527   2HD   PRO  19          2HD       PRO  19  16.577 -16.661   8.619
  528    H    LYS  20           H        LYS  20  13.851 -19.552   6.946
  529    HA   LYS  20           HA       LYS  20  11.651 -20.362   6.663
  530   1HB   LYS  20          1HB       LYS  20  12.916 -22.452   7.569
  531   2HB   LYS  20          2HB       LYS  20  12.115 -22.088   9.097
  532   1HG   LYS  20          1HG       LYS  20  10.560 -22.286   6.519
  533   2HG   LYS  20          2HG       LYS  20  10.908 -23.712   7.499
  534   1HD   LYS  20          1HD       LYS  20  10.010 -21.909   9.384
  535   2HD   LYS  20          2HD       LYS  20   9.000 -21.533   7.988
  536   1HE   LYS  20          2HE       LYS  20   7.726 -23.280   8.762
  537   2HE   LYS  20          1HE       LYS  20   8.952 -24.279   7.954
  538   1HZ   LYS  20          1HZ       LYS  20  10.264 -24.252   9.985
  539   2HZ   LYS  20          2HZ       LYS  20   9.077 -23.320  10.765
  540   3HZ   LYS  20          3HZ       LYS  20   8.728 -24.911  10.281
  541    H    ALA  21           H        ALA  21  12.156 -20.455  10.224
  542    HA   ALA  21           HA       ALA  21   9.653 -19.489  11.029
  543   1HB   ALA  21          1HB       ALA  21  12.402 -18.883  12.175
  544   2HB   ALA  21          3HB       ALA  21  10.881 -18.768  13.060
  545   3HB   ALA  21          2HB       ALA  21  11.459 -20.338  12.499
  546    H    LEU  22           H        LEU  22  12.576 -17.555  10.299
  547    HA   LEU  22           HA       LEU  22  11.320 -14.979  10.613
  548   1HB   LEU  22          1HB       LEU  22  13.851 -16.045  10.162
  549   2HB   LEU  22          2HB       LEU  22  13.503 -15.202   8.656
  550    HG   LEU  22           HG       LEU  22  14.589 -13.645  10.154
  551   1HD1  LEU  22          1HD1      LEU  22  12.029 -13.261   9.049
  552   2HD1  LEU  22          2HD1      LEU  22  11.960 -12.540  10.659
  553   3HD1  LEU  22          3HD1      LEU  22  13.185 -12.008   9.507
  554   1HD2  LEU  22          1HD2      LEU  22  14.068 -14.865  12.247
  555   2HD2  LEU  22          2HD2      LEU  22  13.667 -13.152  12.378
  556   3HD2  LEU  22          3HD2      LEU  22  12.388 -14.340  12.125
  557    H    GLN  23           H        GLN  23  12.262 -16.794   7.694
  558    HA   GLN  23           HA       GLN  23  11.152 -15.233   5.676
  559   1HB   GLN  23          1HB       GLN  23  12.508 -17.256   5.358
  560   2HB   GLN  23          2HB       GLN  23  11.208 -18.253   6.006
  561   1HG   GLN  23          2HG       GLN  23  10.524 -18.470   3.858
  562   2HG   GLN  23          1HG       GLN  23   9.934 -16.815   4.014
  563   2HE2  GLN  23          2HE2      GLN  23  10.871 -15.281   2.637
  564   1HE2  GLN  23          1HE2      GLN  23  12.290 -15.532   1.738
  565    H    GLN  24           H        GLN  24   9.474 -17.885   7.418
  566    HA   GLN  24           HA       GLN  24   6.920 -17.487   6.183
  567   1HB   GLN  24          1HB       GLN  24   8.011 -19.381   7.690
  568   2HB   GLN  24          2HB       GLN  24   7.233 -18.483   8.995
  569   1HG   GLN  24          1HG       GLN  24   5.392 -18.753   6.798
  570   2HG   GLN  24          2HG       GLN  24   6.027 -20.342   7.228
  571   2HE2  GLN  24          2HE2      GLN  24   3.373 -18.682   7.845
  572   1HE2  GLN  24          1HE2      GLN  24   3.140 -18.997   9.497
  573    H    LYS  25           H        LYS  25   8.420 -16.077   9.075
  574    HA   LYS  25           HA       LYS  25   6.069 -14.790  10.114
  575   1HB   LYS  25          1HB       LYS  25   9.044 -14.579  10.387
  576   2HB   LYS  25          2HB       LYS  25   8.056 -13.284  11.063
  577   1HG   LYS  25          1HG       LYS  25   6.925 -14.753  12.532
  578   2HG   LYS  25          2HG       LYS  25   7.442 -16.181  11.636
  579   1HD   LYS  25          1HD       LYS  25   9.459 -16.264  12.682
  580   2HD   LYS  25          2HD       LYS  25   9.652 -14.511  12.654
  581   1HE   LYS  25          1HE       LYS  25   8.962 -14.367  14.807
  582   2HE   LYS  25          2HE       LYS  25   7.468 -15.243  14.418
  583   1HZ   LYS  25          1HZ       LYS  25  10.086 -16.606  14.666
  584   2HZ   LYS  25          2HZ       LYS  25   9.053 -16.399  15.995
  585   3HZ   LYS  25          3HZ       LYS  25   8.538 -17.305  14.652
  586    H    ILE  26           H        ILE  26   8.662 -13.648   7.933
  587    HA   ILE  26           HA       ILE  26   7.623 -10.972   7.639
  588    HB   ILE  26           HB       ILE  26   9.427 -12.712   5.925
  589   1HG1  ILE  26          1HG1      ILE  26  10.117 -10.508   7.892
  590   2HG1  ILE  26          2HG1      ILE  26  10.137 -12.224   8.303
  591   1HG2  ILE  26          1HG2      ILE  26   8.411 -10.773   4.698
  592   2HG2  ILE  26          2HG2      ILE  26   9.105  -9.696   5.910
  593   3HG2  ILE  26          3HG2      ILE  26  10.163 -10.648   4.869
  594   1HD1  ILE  26          1HD1      ILE  26  11.682 -12.493   6.243
  595   2HD1  ILE  26          2HD1      ILE  26  11.888 -10.744   6.342
  596   3HD1  ILE  26          3HD1      ILE  26  12.373 -11.768   7.693
  597    H    HIS  27           H        HIS  27   7.522 -13.796   5.422
  598    HA   HIS  27           HA       HIS  27   5.837 -12.642   3.449
  599   1HB   HIS  27          1HB       HIS  27   6.751 -15.306   4.340
  600   2HB   HIS  27          2HB       HIS  27   5.234 -15.322   3.440
  601    HD1  HIS  27           HD1      HIS  27   5.661 -13.156   1.381
  602    HD2  HIS  27           HD2      HIS  27   8.659 -15.863   2.412
  603    HE1  HIS  27           HE1      HIS  27   7.280 -13.207  -0.565
  604    H    GLU  28           H        GLU  28   5.100 -13.880   6.631
  605    HA   GLU  28           HA       GLU  28   2.300 -14.432   6.254
  606   1HB   GLU  28          1HB       GLU  28   4.276 -14.123   8.416
  607   2HB   GLU  28          2HB       GLU  28   2.635 -13.685   8.890
  608   1HG   GLU  28          1HG       GLU  28   2.687 -16.124   7.291
  609   2HG   GLU  28          2HG       GLU  28   3.664 -16.273   8.752
  610    H    LEU  29           H        LEU  29   3.745 -11.674   8.036
  611    HA   LEU  29           HA       LEU  29   1.357 -10.080   7.949
  612   1HB   LEU  29          1HB       LEU  29   4.276  -9.682   8.546
  613   2HB   LEU  29          2HB       LEU  29   3.215  -8.274   8.460
  614    HG   LEU  29           HG       LEU  29   1.709  -9.960   9.991
  615   1HD1  LEU  29          1HD1      LEU  29   3.560 -11.621  10.046
  616   2HD1  LEU  29          2HD1      LEU  29   4.607 -10.404  10.777
  617   3HD1  LEU  29          3HD1      LEU  29   3.192 -10.990  11.651
  618   1HD2  LEU  29          1HD2      LEU  29   2.674  -7.504  10.282
  619   2HD2  LEU  29          2HD2      LEU  29   2.085  -8.406  11.679
  620   3HD2  LEU  29          3HD2      LEU  29   3.816  -8.316  11.352
  621    H    GLU  30           H        GLU  30   4.238 -10.224   5.868
  622    HA   GLU  30           HA       GLU  30   3.730  -7.920   4.272
  623   1HB   GLU  30          1HB       GLU  30   5.809  -9.334   4.384
  624   2HB   GLU  30          2HB       GLU  30   4.959 -10.577   3.465
  625   1HG   GLU  30          1HG       GLU  30   4.679  -7.993   2.182
  626   2HG   GLU  30          2HG       GLU  30   6.381  -8.389   2.417
  627    H    GLY  31           H        GLY  31   2.753 -11.332   3.791
  628   1HA   GLY  31          2HA       GLY  31   1.003 -12.239   2.516
  629   2HA   GLY  31          1HA       GLY  31   1.379 -10.981   1.337
  630    H    LEU  32           H        LEU  32   0.405 -10.294   4.649
  631    HA   LEU  32           HA       LEU  32  -2.408  -9.856   4.029
  632   1HB   LEU  32          1HB       LEU  32  -1.608 -10.493   6.254
  633   2HB   LEU  32          2HB       LEU  32  -0.609  -9.041   6.336
  634    HG   LEU  32           HG       LEU  32  -2.749  -7.696   6.047
  635   1HD1  LEU  32          1HD1      LEU  32  -3.847 -10.484   6.323
  636   2HD1  LEU  32          2HD1      LEU  32  -4.780  -9.105   6.904
  637   3HD1  LEU  32          3HD1      LEU  32  -4.329  -9.210   5.203
  638   1HD2  LEU  32          1HD2      LEU  32  -1.719  -9.110   8.362
  639   2HD2  LEU  32          2HD2      LEU  32  -2.372  -7.475   8.260
  640   3HD2  LEU  32          3HD2      LEU  32  -3.455  -8.843   8.519
  641    H    MET  33           H        MET  33   0.507  -7.870   4.144
  642    HA   MET  33           HA       MET  33  -0.924  -5.326   3.917
  643   1HB   MET  33          1HB       MET  33   1.234  -5.530   5.052
  644   2HB   MET  33          2HB       MET  33   1.973  -6.169   3.584
  645   1HG   MET  33          1HG       MET  33   0.584  -3.554   3.327
  646   2HG   MET  33          2HG       MET  33   2.086  -3.555   4.251
  647   1HE   MET  33          1HE       MET  33   3.985  -3.642   3.741
  648   2HE   MET  33          2HE       MET  33   4.749  -4.619   2.489
  649   3HE   MET  33          3HE       MET  33   4.496  -2.895   2.220
  650    H    MET  34           H        MET  34   0.466  -7.694   1.729
  651    HA   MET  34           HA       MET  34   0.492  -5.923  -0.599
  652   1HB   MET  34          1HB       MET  34   1.950  -7.977  -0.052
  653   2HB   MET  34          2HB       MET  34   0.558  -8.944  -0.540
  654   1HG   MET  34          1HG       MET  34   1.183  -8.702  -2.686
  655   2HG   MET  34          2HG       MET  34   0.898  -6.968  -2.542
  656   1HE   MET  34          1HE       MET  34   2.410  -5.453  -3.205
  657   2HE   MET  34          2HE       MET  34   4.101  -5.728  -3.613
  658   3HE   MET  34          3HE       MET  34   2.827  -6.615  -4.461
  659    H    GLN  35           H        GLN  35  -1.577  -8.623   0.525
  660    HA   GLN  35           HA       GLN  35  -3.338  -8.782  -1.666
  661   1HB   GLN  35          1HB       GLN  35  -4.899  -9.723   0.019
  662   2HB   GLN  35          2HB       GLN  35  -3.259 -10.329   0.249
  663   1HG   GLN  35          1HG       GLN  35  -2.877  -8.654   2.014
  664   2HG   GLN  35          2HG       GLN  35  -4.512  -8.033   1.782
  665   2HE2  GLN  35          2HE2      GLN  35  -3.043 -11.314   2.207
  666   1HE2  GLN  35          1HE2      GLN  35  -4.176 -11.824   3.363
  667    H    HIS  36           H        HIS  36  -3.357  -6.486   1.059
  668    HA   HIS  36           HA       HIS  36  -5.897  -5.277   0.248
  669   1HB   HIS  36          1HB       HIS  36  -3.707  -4.660   2.239
  670   2HB   HIS  36          2HB       HIS  36  -5.100  -3.598   2.028
  671    HD1  HIS  36           HD1      HIS  36  -4.036  -6.654   3.729
  672    HD2  HIS  36           HD2      HIS  36  -7.668  -5.018   2.504
  673    HE1  HIS  36           HE1      HIS  36  -5.844  -7.904   4.986
  674    H    ALA  37           H        ALA  37  -2.466  -4.227   0.190
  675    HA   ALA  37           HA       ALA  37  -2.738  -1.702  -1.001
  676   1HB   ALA  37          1HB       ALA  37  -0.544  -2.122  -0.531
  677   2HB   ALA  37          3HB       ALA  37  -0.725  -3.855  -0.806
  678   3HB   ALA  37          2HB       ALA  37  -0.481  -2.767  -2.172
  679    H    GLN  38           H        GLN  38  -2.865  -4.905  -2.532
  680    HA   GLN  38           HA       GLN  38  -2.874  -3.942  -5.265
  681   1HB   GLN  38          1HB       GLN  38  -3.544  -6.483  -3.794
  682   2HB   GLN  38          2HB       GLN  38  -3.901  -6.347  -5.516
  683   1HG   GLN  38          1HG       GLN  38  -1.498  -5.635  -5.863
  684   2HG   GLN  38          2HG       GLN  38  -1.200  -6.062  -4.178
  685   2HE2  GLN  38          2HE2      GLN  38   0.333  -7.667  -5.442
  686   1HE2  GLN  38          1HE2      GLN  38  -0.342  -9.173  -5.841
  687    H    ASN  39           H        ASN  39  -5.411  -4.771  -2.907
  688    HA   ASN  39           HA       ASN  39  -7.542  -4.093  -4.855
  689   1HB   ASN  39          1HB       ASN  39  -7.380  -5.228  -2.059
  690   2HB   ASN  39          2HB       ASN  39  -8.926  -4.747  -2.759
  691   2HD2  ASN  39          2HD2      ASN  39  -9.533  -7.094  -2.715
  692   1HD2  ASN  39          1HD2      ASN  39  -8.949  -8.130  -3.926
  693    H    LEU  40           H        LEU  40  -5.559  -2.113  -3.477
  694    HA   LEU  40           HA       LEU  40  -5.673   0.065  -2.585
  695   1HB   LEU  40          1HB       LEU  40  -8.138  -0.454  -4.173
  696   2HB   LEU  40          2HB       LEU  40  -8.148   0.989  -3.158
  697    HG   LEU  40           HG       LEU  40  -5.631   1.054  -4.326
  698   1HD1  LEU  40          1HD1      LEU  40  -6.737  -0.814  -5.827
  699   2HD1  LEU  40          2HD1      LEU  40  -7.535   0.559  -6.594
  700   3HD1  LEU  40          3HD1      LEU  40  -5.773   0.460  -6.574
  701   1HD2  LEU  40          1HD2      LEU  40  -7.296   2.910  -3.945
  702   2HD2  LEU  40          2HD2      LEU  40  -6.498   2.981  -5.515
  703   3HD2  LEU  40          3HD2      LEU  40  -8.148   2.371  -5.392
  704    H    GLU  41           H        GLU  41  -6.657  -2.329  -0.949
  705    HA   GLU  41           HA       GLU  41  -8.498  -0.886   0.925
  706   1HB   GLU  41          1HB       GLU  41  -7.929  -3.748   0.207
  707   2HB   GLU  41          2HB       GLU  41  -8.608  -3.380   1.794
  708   1HG   GLU  41          1HG       GLU  41  -9.900  -2.010  -0.495
  709   2HG   GLU  41          2HG       GLU  41 -10.127  -3.759  -0.426
  710    H    PHE  42           H        PHE  42  -5.334  -0.999   0.579
  711    HA   PHE  42           HA       PHE  42  -4.397  -2.105   3.028
  712   1HB   PHE  42          2HB       PHE  42  -2.280  -1.370   2.244
  713   2HB   PHE  42          1HB       PHE  42  -3.200  -1.884   0.843
  714    HD1  PHE  42           HD1      PHE  42  -4.997   0.872   1.134
  715    HD2  PHE  42           HD2      PHE  42  -0.819  -0.108   0.696
  716    HE1  PHE  42           HE1      PHE  42  -4.593   3.084   0.083
  717    HE2  PHE  42           HE2      PHE  42  -0.412   2.117  -0.356
  718    HZ   PHE  42           HZ       PHE  42  -2.301   3.712  -0.661
  719    H    GLU  43           H        GLU  43  -6.459   0.163   3.329
  720    HA   GLU  43           HA       GLU  43  -5.190   2.515   4.306
  721   1HB   GLU  43          1HB       GLU  43  -7.604   2.330   3.989
  722   2HB   GLU  43          2HB       GLU  43  -7.694   1.012   5.158
  723   1HG   GLU  43          1HG       GLU  43  -6.755   2.639   6.880
  724   2HG   GLU  43          2HG       GLU  43  -7.042   3.916   5.696
  725    H    GLU  44           H        GLU  44  -6.551  -0.079   6.342
  726    HA   GLU  44           HA       GLU  44  -4.605   0.462   8.481
  727   1HB   GLU  44          1HB       GLU  44  -5.921  -1.331   9.611
  728   2HB   GLU  44          2HB       GLU  44  -6.964  -0.074   8.946
  729   1HG   GLU  44          1HG       GLU  44  -7.791  -1.442   7.284
  730   2HG   GLU  44          2HG       GLU  44  -6.312  -2.397   7.188
  731    H    ALA  45           H        ALA  45  -4.928  -1.667   5.741
  732    HA   ALA  45           HA       ALA  45  -3.266  -3.841   6.691
  733   1HB   ALA  45          1HB       ALA  45  -4.898  -3.195   4.485
  734   2HB   ALA  45          3HB       ALA  45  -4.041  -4.716   4.749
  735   3HB   ALA  45          2HB       ALA  45  -3.288  -3.427   3.804
  736    H    ALA  46           H        ALA  46  -2.595  -1.059   4.521
  737    HA   ALA  46           HA       ALA  46   0.100  -1.592   3.927
  738   1HB   ALA  46          1HB       ALA  46   0.199   0.747   3.384
  739   2HB   ALA  46          3HB       ALA  46  -1.464   0.239   3.085
  740   3HB   ALA  46          2HB       ALA  46  -1.066   1.132   4.555
  741    H    GLN  47           H        GLN  47  -1.296  -0.182   6.865
  742    HA   GLN  47           HA       GLN  47   1.020   0.841   8.100
  743   1HB   GLN  47          1HB       GLN  47  -1.603  -0.292   8.915
  744   2HB   GLN  47          2HB       GLN  47  -0.378  -0.186  10.181
  745   1HG   GLN  47          1HG       GLN  47  -1.487   1.904  10.268
  746   2HG   GLN  47          2HG       GLN  47  -0.008   2.234   9.367
  747   2HE2  GLN  47          2HE2      GLN  47  -0.300   1.993   6.861
  748   1HE2  GLN  47          1HE2      GLN  47  -1.763   2.563   6.215
  749    H    ILE  48           H        ILE  48   0.008  -2.508   7.650
  750    HA   ILE  48           HA       ILE  48   1.582  -3.855   9.561
  751    HB   ILE  48           HB       ILE  48   0.918  -4.499   6.668
  752   1HG1  ILE  48          1HG1      ILE  48  -1.020  -4.129   8.164
  753   2HG1  ILE  48          2HG1      ILE  48  -0.900  -5.822   7.681
  754   1HG2  ILE  48          1HG2      ILE  48   2.256  -6.087   8.831
  755   2HG2  ILE  48          2HG2      ILE  48   1.176  -6.916   7.711
  756   3HG2  ILE  48          3HG2      ILE  48   2.590  -6.057   7.100
  757   1HD1  ILE  48          1HD1      ILE  48   0.681  -5.638   9.983
  758   2HD1  ILE  48          2HD1      ILE  48  -0.738  -4.655  10.342
  759   3HD1  ILE  48          3HD1      ILE  48  -0.931  -6.344   9.875
  760    H    ARG  49           H        ARG  49   2.525  -2.243   6.580
  761    HA   ARG  49           HA       ARG  49   5.119  -3.286   6.167
  762   1HB   ARG  49          1HB       ARG  49   4.143  -1.804   4.577
  763   2HB   ARG  49          2HB       ARG  49   3.802  -0.585   5.799
  764   1HG   ARG  49          1HG       ARG  49   6.634  -1.107   5.770
  765   2HG   ARG  49          2HG       ARG  49   6.092  -0.775   4.126
  766   1HD   ARG  49          1HD       ARG  49   6.721   1.315   5.356
  767   2HD   ARG  49          2HD       ARG  49   5.010   1.312   4.886
  768    HE   ARG  49           HE       ARG  49   4.538   0.456   7.236
  769   1HH1  ARG  49          1HH1      ARG  49   7.736   0.463   7.451
  770   2HH1  ARG  49          2HH1      ARG  49   7.906   1.725   8.624
  771   1HH2  ARG  49          1HH2      ARG  49   4.625   2.808   8.328
  772   2HH2  ARG  49          2HH2      ARG  49   6.145   3.053   9.121
  773    H    ASP  50           H        ASP  50   3.870  -1.150   8.645
  774    HA   ASP  50           HA       ASP  50   6.387  -0.093   9.589
  775   1HB   ASP  50          1HB       ASP  50   3.720   0.338  10.027
  776   2HB   ASP  50          2HB       ASP  50   4.162  -0.531  11.497
  777    H    GLN  51           H        GLN  51   4.474  -2.993  10.330
  778    HA   GLN  51           HA       GLN  51   6.216  -3.840  12.526
  779   1HB   GLN  51          2HB       GLN  51   4.167  -5.365  10.883
  780   2HB   GLN  51          1HB       GLN  51   4.761  -5.804  12.484
  781   1HG   GLN  51          1HG       GLN  51   3.765  -3.822  13.463
  782   2HG   GLN  51          2HG       GLN  51   3.303  -3.220  11.869
  783   2HE2  GLN  51          2HE2      GLN  51   3.035  -6.647  12.780
  784   1HE2  GLN  51          1HE2      GLN  51   1.338  -6.693  12.766
  785    H    LEU  52           H        LEU  52   5.862  -4.571   9.074
  786    HA   LEU  52           HA       LEU  52   7.551  -6.838   8.873
  787   1HB   LEU  52          1HB       LEU  52   6.354  -4.779   7.189
  788   2HB   LEU  52          2HB       LEU  52   7.927  -5.282   6.573
  789    HG   LEU  52           HG       LEU  52   6.088  -6.679   5.660
  790   1HD1  LEU  52          1HD1      LEU  52   8.310  -7.739   7.324
  791   2HD1  LEU  52          2HD1      LEU  52   7.080  -8.906   6.836
  792   3HD1  LEU  52          3HD1      LEU  52   7.964  -7.993   5.613
  793   1HD2  LEU  52          1HD2      LEU  52   5.668  -7.304   8.597
  794   2HD2  LEU  52          2HD2      LEU  52   4.499  -6.610   7.473
  795   3HD2  LEU  52          3HD2      LEU  52   5.005  -8.291   7.294
  796    H    HIS  53           H        HIS  53   8.324  -3.445   9.320
  797    HA   HIS  53           HA       HIS  53  11.120  -3.656   8.525
  798   1HB   HIS  53          1HB       HIS  53   9.247  -1.682   9.731
  799   2HB   HIS  53          2HB       HIS  53  10.963  -1.425  10.046
  800    HD1  HIS  53           HD1      HIS  53  11.830   0.206   8.377
  801    HD2  HIS  53           HD2      HIS  53   9.133  -2.459   6.644
  802    HE1  HIS  53           HE1      HIS  53  11.755   0.768   5.908
  803    H    GLN  54           H        GLN  54   9.405  -3.533  11.664
  804    HA   GLN  54           HA       GLN  54  11.726  -3.700  13.328
  805   1HB   GLN  54          1HB       GLN  54   9.478  -3.019  14.067
  806   2HB   GLN  54          2HB       GLN  54   8.867  -4.640  13.736
  807   1HG   GLN  54          1HG       GLN  54   9.796  -5.519  15.625
  808   2HG   GLN  54          2HG       GLN  54  11.248  -4.526  15.491
  809   2HE2  GLN  54          2HE2      GLN  54   8.534  -4.956  17.399
  810   1HE2  GLN  54          1HE2      GLN  54   8.426  -3.401  18.070
  811    H    LEU  55           H        LEU  55   9.638  -6.222  11.913
  812    HA   LEU  55           HA       LEU  55  10.695  -8.494  13.222
  813   1HB   LEU  55          1HB       LEU  55   9.439  -7.890  10.561
  814   2HB   LEU  55          2HB       LEU  55  10.045  -9.518  10.872
  815    HG   LEU  55           HG       LEU  55   8.597  -8.668  13.183
  816   1HD1  LEU  55          1HD1      LEU  55   7.522  -7.642  10.682
  817   2HD1  LEU  55          2HD1      LEU  55   6.403  -8.773  11.443
  818   3HD1  LEU  55          3HD1      LEU  55   6.968  -7.359  12.332
  819   1HD2  LEU  55          1HD2      LEU  55   8.971 -10.994  12.341
  820   2HD2  LEU  55          2HD2      LEU  55   7.274 -10.658  12.681
  821   3HD2  LEU  55          3HD2      LEU  55   7.855 -10.660  11.017
  822    H    ARG  56           H        ARG  56  12.026  -6.559  10.595
  823    HA   ARG  56           HA       ARG  56  13.951  -8.311   9.510
  824   1HB   ARG  56          1HB       ARG  56  13.426  -6.089   8.636
  825   2HB   ARG  56          2HB       ARG  56  14.044  -5.335  10.106
  826   1HG   ARG  56          1HG       ARG  56  16.158  -6.932   9.285
  827   2HG   ARG  56          2HG       ARG  56  15.504  -6.321   7.765
  828   1HD   ARG  56          1HD       ARG  56  15.457  -4.027   9.186
  829   2HD   ARG  56          2HD       ARG  56  16.823  -4.832   9.984
  830    HE   ARG  56           HE       ARG  56  17.121  -5.206   7.184
  831   1HH1  ARG  56          1HH1      ARG  56  18.649  -3.659   9.587
  832   2HH1  ARG  56          2HH1      ARG  56  19.078  -2.229   8.710
  833   1HH2  ARG  56          1HH2      ARG  56  17.015  -2.942   6.016
  834   2HH2  ARG  56          2HH2      ARG  56  18.153  -1.823   6.688
  835    H    GLU  57           H        GLU  57  14.236  -6.176  12.361
  836    HA   GLU  57           HA       GLU  57  16.909  -6.614  13.078
  837   1HB   GLU  57          1HB       GLU  57  15.482  -5.022  14.195
  838   2HB   GLU  57          2HB       GLU  57  14.366  -6.289  14.698
  839   1HG   GLU  57          1HG       GLU  57  17.230  -6.490  15.554
  840   2HG   GLU  57          2HG       GLU  57  16.179  -5.341  16.379
  841    H    LEU  58           H        LEU  58  14.136  -8.394  14.463
  842    HA   LEU  58           HA       LEU  58  15.431 -10.387  15.884
  843   1HB   LEU  58          1HB       LEU  58  12.917 -10.283  14.239
  844   2HB   LEU  58          2HB       LEU  58  13.361 -11.775  15.068
  845    HG   LEU  58           HG       LEU  58  13.564  -9.318  16.704
  846   1HD1  LEU  58          1HD1      LEU  58  11.053 -10.155  15.349
  847   2HD1  LEU  58          2HD1      LEU  58  10.931  -9.794  17.071
  848   3HD1  LEU  58          3HD1      LEU  58  11.530  -8.569  15.953
  849   1HD2  LEU  58          1HD2      LEU  58  13.806 -11.857  17.321
  850   2HD2  LEU  58          2HD2      LEU  58  12.949 -10.784  18.428
  851   3HD2  LEU  58          3HD2      LEU  58  12.043 -11.836  17.340
  852    H    PHE  59           H        PHE  59  15.246 -10.127  12.376
  853    HA   PHE  59           HA       PHE  59  15.710 -12.735  11.495
  854   1HB   PHE  59          1HB       PHE  59  15.444 -10.675  10.113
  855   2HB   PHE  59          2HB       PHE  59  17.079 -10.191  10.564
  856    HD1  PHE  59           HD1      PHE  59  19.032 -11.734   9.978
  857    HD2  PHE  59           HD2      PHE  59  15.066 -12.230   8.345
  858    HE1  PHE  59           HE1      PHE  59  19.963 -13.147   8.147
  859    HE2  PHE  59           HE2      PHE  59  15.997 -13.642   6.514
  860    HZ   PHE  59           HZ       PHE  59  18.445 -14.101   6.415
  861    H    ILE  60           H        ILE  60  18.197 -10.405  12.608
  862    HA   ILE  60           HA       ILE  60  20.442 -12.150  12.291
  863    HB   ILE  60           HB       ILE  60  19.900  -9.838  14.183
  864   1HG1  ILE  60          1HG1      ILE  60  21.570  -9.622  11.718
  865   2HG1  ILE  60          2HG1      ILE  60  19.822  -9.722  11.504
  866   1HG2  ILE  60          1HG2      ILE  60  22.089 -11.635  14.095
  867   2HG2  ILE  60          2HG2      ILE  60  22.645 -10.134  13.355
  868   3HG2  ILE  60          3HG2      ILE  60  21.982 -10.119  14.990
  869   1HD1  ILE  60          1HD1      ILE  60  20.411  -7.907  13.659
  870   2HD1  ILE  60          2HD1      ILE  60  21.342  -7.442  12.236
  871   3HD1  ILE  60          3HD1      ILE  60  19.586  -7.576  12.135
  872    H    ALA  61           H        ALA  61  18.299 -11.528  15.079
  873    HA   ALA  61           HA       ALA  61  19.649 -13.088  17.024
  874   1HB   ALA  61          1HB       ALA  61  17.530 -11.502  17.033
  875   2HB   ALA  61          3HB       ALA  61  16.654 -13.017  16.818
  876   3HB   ALA  61          2HB       ALA  61  17.675 -12.784  18.236
  877    H    ALA  62           H        ALA  62  17.836 -14.073  14.221
  878    HA   ALA  62           HA       ALA  62  17.637 -16.876  15.234
  879   1HB   ALA  62          1HB       ALA  62  16.183 -15.111  13.378
  880   2HB   ALA  62          2HB       ALA  62  15.592 -16.487  14.309
  881   3HB   ALA  62          3HB       ALA  62  16.410 -16.750  12.769
  882    H    SER  63           H        SER  63  18.343 -15.348  12.065
  883    HA   SER  63           HA       SER  63  19.932 -17.589  11.152
  884   1HB   SER  63          1HB       SER  63  18.602 -15.714   9.900
  885   2HB   SER  63          2HB       SER  63  20.079 -14.772  10.088
  886    HG   SER  63           HG       SER  63  19.853 -17.347   8.901

  No H/Q in entry =         886
  Start of MODEL   19
    1    H    LEU   8           H        LEU   8 -11.631   6.209 -30.587
    2    HA   LEU   8           HA       LEU   8  -9.199   7.086 -30.825
    3   1HB   LEU   8          1HB       LEU   8 -10.394   7.349 -33.408
    4   2HB   LEU   8          2HB       LEU   8  -9.912   8.961 -32.873
    5    HG   LEU   8           HG       LEU   8  -8.065   7.839 -34.065
    6   1HD1  LEU   8          1HD1      LEU   8  -7.666   9.393 -32.099
    7   2HD1  LEU   8          2HD1      LEU   8  -7.470   7.956 -31.097
    8   3HD1  LEU   8          3HD1      LEU   8  -6.353   8.261 -32.427
    9   1HD2  LEU   8          1HD2      LEU   8  -9.002   5.581 -32.656
   10   2HD2  LEU   8          2HD2      LEU   8  -7.610   5.654 -33.738
   11   3HD2  LEU   8          3HD2      LEU   8  -7.397   5.914 -32.006
   12    H    GLU   9           H        GLU   9  -9.292   8.372 -29.016
   13    HA   GLU   9           HA       GLU   9  -9.916  10.145 -27.582
   14   1HB   GLU   9          1HB       GLU   9  -9.131  11.116 -29.952
   15   2HB   GLU   9          2HB       GLU   9 -10.804  11.672 -29.994
   16   1HG   GLU   9          2HG       GLU   9 -10.169  13.406 -28.704
   17   2HG   GLU   9          1HG       GLU   9  -9.920  12.250 -27.396
   18    HA   PRO  10           HA       PRO  10 -14.384   9.072 -27.927
   19   1HB   PRO  10          1HB       PRO  10 -14.702   8.450 -25.282
   20   2HB   PRO  10          2HB       PRO  10 -14.129   7.280 -26.487
   21   1HG   PRO  10          2HG       PRO  10 -12.583   8.849 -24.488
   22   2HG   PRO  10          1HG       PRO  10 -12.355   7.182 -25.037
   23   1HD   PRO  10          1HD       PRO  10 -10.834   9.282 -25.897
   24   2HD   PRO  10          2HD       PRO  10 -11.121   7.812 -26.856
   25    H    ASP  11           H        ASP  11 -12.804  10.792 -25.216
   26    HA   ASP  11           HA       ASP  11 -13.317  12.855 -24.192
   27   1HB   ASP  11          1HB       ASP  11 -13.981  13.007 -26.995
   28   2HB   ASP  11          2HB       ASP  11 -15.137  13.965 -26.070
   29    H    ASN  12           H        ASN  12 -16.397  12.491 -25.932
   30    HA   ASN  12           HA       ASN  12 -17.773  11.605 -23.464
   31   1HB   ASN  12          2HB       ASN  12 -19.221  13.617 -23.486
   32   2HB   ASN  12          1HB       ASN  12 -17.527  14.055 -23.263
   33   2HD2  ASN  12          2HD2      ASN  12 -20.173  14.006 -25.649
   34   1HD2  ASN  12          1HD2      ASN  12 -19.449  15.105 -26.722
   35    H    VAL  13           H        VAL  13 -17.354  10.831 -26.433
   36    HA   VAL  13           HA       VAL  13 -19.893  11.109 -27.764
   37    HB   VAL  13           HB       VAL  13 -17.350   9.558 -28.042
   38   1HG1  VAL  13          1HG1      VAL  13 -19.976   8.730 -29.243
   39   2HG1  VAL  13          2HG1      VAL  13 -18.508   8.577 -30.208
   40   3HG1  VAL  13          3HG1      VAL  13 -18.646   7.722 -28.672
   41   1HG2  VAL  13          1HG2      VAL  13 -18.109  11.914 -28.984
   42   2HG2  VAL  13          2HG2      VAL  13 -17.102  10.838 -29.952
   43   3HG2  VAL  13          3HG2      VAL  13 -18.839  10.923 -30.246
   44    HA   PRO  14           HA       PRO  14 -20.901   6.751 -26.118
   45   1HB   PRO  14          1HB       PRO  14 -19.168   5.538 -24.388
   46   2HB   PRO  14          2HB       PRO  14 -19.022   5.384 -26.151
   47   1HG   PRO  14          2HG       PRO  14 -17.482   7.084 -24.265
   48   2HG   PRO  14          1HG       PRO  14 -16.946   6.244 -25.729
   49   1HD   PRO  14          1HD       PRO  14 -17.483   8.937 -25.596
   50   2HD   PRO  14          2HD       PRO  14 -17.537   7.967 -27.078
   51    H    MET  15           H        MET  15 -18.860   8.355 -23.664
   52    HA   MET  15           HA       MET  15 -21.091   9.323 -22.139
   53   1HB   MET  15          1HB       MET  15 -20.794   6.644 -21.901
   54   2HB   MET  15          2HB       MET  15 -19.694   7.173 -20.626
   55   1HG   MET  15          2HG       MET  15 -21.695   7.084 -19.450
   56   2HG   MET  15          1HG       MET  15 -21.709   8.764 -19.986
   57   1HE   MET  15          1HE       MET  15 -22.760   5.365 -20.120
   58   2HE   MET  15          2HE       MET  15 -24.340   5.977 -19.634
   59   3HE   MET  15          3HE       MET  15 -24.149   5.201 -21.204
   60    H    ASP  16           H        ASP  16 -20.238  10.036 -19.851
   61    HA   ASP  16           HA       ASP  16 -17.353  10.320 -19.534
   62   1HB   ASP  16          1HB       ASP  16 -18.062  11.869 -21.448
   63   2HB   ASP  16          2HB       ASP  16 -18.938  12.804 -20.235
   64    H    MET  17           H        MET  17 -18.468   9.378 -17.500
   65    HA   MET  17           HA       MET  17 -20.206  10.791 -15.801
   66   1HB   MET  17          1HB       MET  17 -19.102   9.441 -14.026
   67   2HB   MET  17          2HB       MET  17 -19.412   8.482 -15.474
   68   1HG   MET  17          1HG       MET  17 -17.060   8.965 -16.217
   69   2HG   MET  17          2HG       MET  17 -16.778   9.740 -14.658
   70   1HE   MET  17          1HE       MET  17 -17.217   6.913 -16.777
   71   2HE   MET  17          2HE       MET  17 -15.589   6.562 -16.180
   72   3HE   MET  17          3HE       MET  17 -16.910   5.442 -15.857
   73    H    SER  18           H        SER  18 -16.683  11.138 -16.184
   74    HA   SER  18           HA       SER  18 -16.729  13.440 -14.277
   75   1HB   SER  18          1HB       SER  18 -14.532  11.690 -15.420
   76   2HB   SER  18          2HB       SER  18 -14.236  13.056 -14.348
   77    HG   SER  18           HG       SER  18 -14.409  11.332 -13.020
   78    HA   PRO  19           HA       PRO  19 -16.362  16.144 -17.774
   79   1HB   PRO  19          1HB       PRO  19 -15.389  18.356 -16.494
   80   2HB   PRO  19          2HB       PRO  19 -17.084  17.839 -16.375
   81   1HG   PRO  19          2HG       PRO  19 -14.837  17.405 -14.468
   82   2HG   PRO  19          1HG       PRO  19 -16.516  17.849 -14.132
   83   1HD   PRO  19          1HD       PRO  19 -15.600  15.324 -13.831
   84   2HD   PRO  19          2HD       PRO  19 -17.268  15.680 -14.324
   85    H    LYS  20           H        LYS  20 -14.283  14.369 -17.899
   86    HA   LYS  20           HA       LYS  20 -12.063  14.097 -18.617
   87   1HB   LYS  20          1HB       LYS  20 -12.004  17.051 -19.198
   88   2HB   LYS  20          2HB       LYS  20 -11.344  15.725 -20.141
   89   1HG   LYS  20          2HG       LYS  20 -13.193  15.989 -21.427
   90   2HG   LYS  20          1HG       LYS  20 -14.027  15.126 -20.132
   91   1HD   LYS  20          1HD       LYS  20 -15.225  16.961 -19.637
   92   2HD   LYS  20          2HD       LYS  20 -13.743  17.883 -19.380
   93   1HE   LYS  20          2HE       LYS  20 -14.765  19.065 -21.150
   94   2HE   LYS  20          1HE       LYS  20 -13.684  17.962 -22.026
   95   1HZ   LYS  20          1HZ       LYS  20 -15.545  16.335 -22.037
   96   2HZ   LYS  20          2HZ       LYS  20 -16.563  17.550 -21.426
   97   3HZ   LYS  20          3HZ       LYS  20 -15.854  17.730 -22.956
   98    H    ALA  21           H        ALA  21 -11.794  17.469 -17.410
   99    HA   ALA  21           HA       ALA  21  -9.283  17.257 -16.202
  100   1HB   ALA  21          1HB       ALA  21 -10.532  19.339 -16.469
  101   2HB   ALA  21          3HB       ALA  21 -11.763  18.780 -15.337
  102   3HB   ALA  21          2HB       ALA  21 -10.134  19.134 -14.763
  103    H    LEU  22           H        LEU  22 -12.451  16.603 -14.686
  104    HA   LEU  22           HA       LEU  22 -11.415  15.777 -12.130
  105   1HB   LEU  22          1HB       LEU  22 -13.851  16.296 -13.295
  106   2HB   LEU  22          2HB       LEU  22 -13.904  14.544 -13.145
  107    HG   LEU  22           HG       LEU  22 -14.835  15.441 -11.127
  108   1HD1  LEU  22          1HD1      LEU  22 -12.642  13.770 -11.145
  109   2HD1  LEU  22          2HD1      LEU  22 -12.168  15.003  -9.974
  110   3HD1  LEU  22          3HD1      LEU  22 -13.660  14.091  -9.738
  111   1HD2  LEU  22          1HD2      LEU  22 -13.943  17.724 -11.377
  112   2HD2  LEU  22          2HD2      LEU  22 -13.619  17.097  -9.758
  113   3HD2  LEU  22          3HD2      LEU  22 -12.329  17.143 -10.961
  114    H    GLN  23           H        GLN  23 -12.576  13.941 -14.958
  115    HA   GLN  23           HA       GLN  23 -12.105  11.315 -14.094
  116   1HB   GLN  23          1HB       GLN  23 -13.004  12.492 -16.326
  117   2HB   GLN  23          2HB       GLN  23 -11.372  12.116 -16.882
  118   1HG   GLN  23          1HG       GLN  23 -11.667   9.778 -16.472
  119   2HG   GLN  23          2HG       GLN  23 -13.160  10.056 -15.575
  120   2HE2  GLN  23          2HE2      GLN  23 -11.909  11.037 -18.828
  121   1HE2  GLN  23          1HE2      GLN  23 -13.325  10.604 -19.658
  122    H    GLN  24           H        GLN  24  -9.816  13.311 -16.007
  123    HA   GLN  24           HA       GLN  24  -7.606  11.519 -15.818
  124   1HB   GLN  24          1HB       GLN  24  -8.257  14.073 -16.879
  125   2HB   GLN  24          2HB       GLN  24  -6.790  14.280 -15.921
  126   1HG   GLN  24          1HG       GLN  24  -6.242  11.938 -17.221
  127   2HG   GLN  24          2HG       GLN  24  -7.201  12.786 -18.435
  128   2HE2  GLN  24          2HE2      GLN  24  -4.127  12.756 -16.754
  129   1HE2  GLN  24          1HE2      GLN  24  -3.445  14.077 -17.575
  130    H    LYS  25           H        LYS  25  -8.504  14.328 -13.792
  131    HA   LYS  25           HA       LYS  25  -6.276  14.426 -12.080
  132   1HB   LYS  25          1HB       LYS  25  -9.148  15.139 -12.027
  133   2HB   LYS  25          2HB       LYS  25  -8.390  14.998 -10.441
  134   1HG   LYS  25          1HG       LYS  25  -6.995  16.789 -10.792
  135   2HG   LYS  25          2HG       LYS  25  -6.865  16.480 -12.523
  136   1HD   LYS  25          1HD       LYS  25  -8.700  17.743 -13.023
  137   2HD   LYS  25          2HD       LYS  25  -9.562  17.247 -11.566
  138   1HE   LYS  25          1HE       LYS  25  -8.475  18.861 -10.224
  139   2HE   LYS  25          2HE       LYS  25  -7.168  19.088 -11.403
  140   1HZ   LYS  25          1HZ       LYS  25 -10.003  19.622 -12.070
  141   2HZ   LYS  25          2HZ       LYS  25  -9.002  20.822 -11.411
  142   3HZ   LYS  25          3HZ       LYS  25  -8.613  20.122 -12.910
  143    H    ILE  26           H        ILE  26  -9.272  12.507 -11.619
  144    HA   ILE  26           HA       ILE  26  -8.380  11.178  -9.231
  145    HB   ILE  26           HB       ILE  26 -10.406  10.452 -11.371
  146   1HG1  ILE  26          1HG1      ILE  26 -10.760  11.779  -8.665
  147   2HG1  ILE  26          2HG1      ILE  26 -10.726  12.646 -10.201
  148   1HG2  ILE  26          1HG2      ILE  26  -9.433   8.913  -9.187
  149   2HG2  ILE  26          2HG2      ILE  26 -11.042   9.479  -8.741
  150   3HG2  ILE  26          3HG2      ILE  26 -10.812   8.557 -10.227
  151   1HD1  ILE  26          1HD1      ILE  26 -12.691  10.449  -9.488
  152   2HD1  ILE  26          2HD1      ILE  26 -13.049  12.176  -9.460
  153   3HD1  ILE  26          3HD1      ILE  26 -12.672  11.377 -10.987
  154    H    HIS  27           H        HIS  27  -8.696   9.878 -12.565
  155    HA   HIS  27           HA       HIS  27  -7.397   7.409 -12.137
  156   1HB   HIS  27          1HB       HIS  27  -8.684   8.135 -14.145
  157   2HB   HIS  27          2HB       HIS  27  -7.352   9.202 -14.588
  158    HD1  HIS  27           HD1      HIS  27  -6.577   7.971 -16.684
  159    HD2  HIS  27           HD2      HIS  27  -6.774   5.489 -13.339
  160    HE1  HIS  27           HE1      HIS  27  -5.476   5.788 -17.345
  161    H    GLU  28           H        GLU  28  -6.047  10.616 -12.330
  162    HA   GLU  28           HA       GLU  28  -3.334   9.787 -13.015
  163   1HB   GLU  28          1HB       GLU  28  -4.805  12.255 -12.183
  164   2HB   GLU  28          2HB       GLU  28  -3.050  12.248 -12.000
  165   1HG   GLU  28          1HG       GLU  28  -4.416  11.440 -14.575
  166   2HG   GLU  28          2HG       GLU  28  -3.929  13.102 -14.241
  167    H    LEU  29           H        LEU  29  -4.993  10.767  -9.998
  168    HA   LEU  29           HA       LEU  29  -2.641  10.365  -8.333
  169   1HB   LEU  29          1HB       LEU  29  -5.610  10.628  -7.761
  170   2HB   LEU  29          2HB       LEU  29  -4.351  10.684  -6.526
  171    HG   LEU  29           HG       LEU  29  -4.130  12.505  -8.896
  172   1HD1  LEU  29          1HD1      LEU  29  -6.478  12.696  -7.991
  173   2HD1  LEU  29          2HD1      LEU  29  -5.780  13.139  -6.434
  174   3HD1  LEU  29          3HD1      LEU  29  -5.526  14.174  -7.840
  175   1HD2  LEU  29          1HD2      LEU  29  -2.493  12.087  -6.827
  176   2HD2  LEU  29          2HD2      LEU  29  -2.704  13.697  -7.517
  177   3HD2  LEU  29          3HD2      LEU  29  -3.574  13.243  -6.051
  178    H    GLU  30           H        GLU  30  -5.570   8.458  -9.052
  179    HA   GLU  30           HA       GLU  30  -5.189   6.340  -7.210
  180   1HB   GLU  30          1HB       GLU  30  -7.113   6.939  -8.846
  181   2HB   GLU  30          2HB       GLU  30  -6.205   6.002 -10.033
  182   1HG   GLU  30          1HG       GLU  30  -6.374   4.568  -7.521
  183   2HG   GLU  30          2HG       GLU  30  -7.984   4.997  -8.100
  184    H    GLY  31           H        GLY  31  -3.876   6.773 -10.501
  185   1HA   GLY  31          2HA       GLY  31  -2.202   5.580 -11.641
  186   2HA   GLY  31          1HA       GLY  31  -2.557   4.210 -10.587
  187    H    LEU  32           H        LEU  32  -1.713   7.334  -9.253
  188    HA   LEU  32           HA       LEU  32   1.137   6.730  -8.959
  189   1HB   LEU  32          1HB       LEU  32  -0.128   8.997  -9.178
  190   2HB   LEU  32          2HB       LEU  32  -0.450   8.808  -7.454
  191    HG   LEU  32           HG       LEU  32   2.100   8.382  -7.238
  192   1HD1  LEU  32          1HD1      LEU  32   2.487   8.141  -9.678
  193   2HD1  LEU  32          2HD1      LEU  32   1.995   9.818  -9.909
  194   3HD1  LEU  32          3HD1      LEU  32   3.454   9.446  -8.990
  195   1HD2  LEU  32          1HD2      LEU  32   0.683  10.495  -6.653
  196   2HD2  LEU  32          2HD2      LEU  32   2.434  10.664  -6.770
  197   3HD2  LEU  32          3HD2      LEU  32   1.407  11.184  -8.106
  198    H    MET  33           H        MET  33  -1.781   6.335  -7.040
  199    HA   MET  33           HA       MET  33  -0.453   5.914  -4.494
  200   1HB   MET  33          1HB       MET  33  -2.771   6.639  -4.678
  201   2HB   MET  33          2HB       MET  33  -3.185   5.196  -5.603
  202   1HG   MET  33          1HG       MET  33  -1.890   4.539  -3.069
  203   2HG   MET  33          2HG       MET  33  -3.368   5.471  -2.837
  204   1HE   MET  33          1HE       MET  33  -5.434   5.114  -4.039
  205   2HE   MET  33          2HE       MET  33  -6.188   3.526  -4.145
  206   3HE   MET  33          3HE       MET  33  -5.670   4.144  -2.578
  207    H    MET  34           H        MET  34  -2.108   3.624  -6.715
  208    HA   MET  34           HA       MET  34  -1.359   1.222  -5.441
  209   1HB   MET  34          1HB       MET  34  -2.794   1.963  -7.618
  210   2HB   MET  34          2HB       MET  34  -1.360   1.312  -8.413
  211   1HG   MET  34          1HG       MET  34  -2.568  -0.641  -8.186
  212   2HG   MET  34          2HG       MET  34  -1.727  -0.649  -6.636
  213   1HE   MET  34          1HE       MET  34  -3.213  -2.178  -5.631
  214   2HE   MET  34          2HE       MET  34  -3.007  -0.930  -4.404
  215   3HE   MET  34          3HE       MET  34  -4.598  -1.637  -4.672
  216    H    GLN  35           H        GLN  35   0.449   3.198  -7.778
  217    HA   GLN  35           HA       GLN  35   2.570   1.475  -8.425
  218   1HB   GLN  35          1HB       GLN  35   2.209   3.669  -9.422
  219   2HB   GLN  35          2HB       GLN  35   2.499   4.459  -7.874
  220   1HG   GLN  35          2HG       GLN  35   4.659   4.624  -8.516
  221   2HG   GLN  35          1HG       GLN  35   4.767   2.887  -8.238
  222   2HE2  GLN  35          2HE2      GLN  35   4.452   5.367 -10.738
  223   1HE2  GLN  35          1HE2      GLN  35   4.697   4.325 -12.055
  224    H    HIS  36           H        HIS  36   3.036   4.083  -6.042
  225    HA   HIS  36           HA       HIS  36   5.300   3.121  -4.753
  226   1HB   HIS  36          1HB       HIS  36   2.880   4.656  -3.805
  227   2HB   HIS  36          2HB       HIS  36   4.279   4.406  -2.761
  228    HD1  HIS  36           HD1      HIS  36   3.237   7.160  -4.212
  229    HD2  HIS  36           HD2      HIS  36   6.564   4.855  -5.213
  230    HE1  HIS  36           HE1      HIS  36   4.820   8.693  -5.461
  231    H    ALA  37           H        ALA  37   1.934   2.496  -3.641
  232    HA   ALA  37           HA       ALA  37   2.449   0.778  -1.489
  233   1HB   ALA  37          1HB       ALA  37   0.189   0.019  -1.866
  234   2HB   ALA  37          3HB       ALA  37   0.251   1.702  -2.389
  235   3HB   ALA  37          2HB       ALA  37   0.285   0.407  -3.585
  236    H    GLN  38           H        GLN  38   2.208  -0.048  -4.961
  237    HA   GLN  38           HA       GLN  38   2.682  -2.876  -4.631
  238   1HB   GLN  38          1HB       GLN  38   2.771  -0.843  -6.848
  239   2HB   GLN  38          2HB       GLN  38   3.365  -2.476  -7.149
  240   1HG   GLN  38          1HG       GLN  38   1.206  -3.403  -6.391
  241   2HG   GLN  38          2HG       GLN  38   0.608  -1.770  -6.100
  242   2HE2  GLN  38          2HE2      GLN  38  -1.088  -2.348  -7.780
  243   1HE2  GLN  38          1HE2      GLN  38  -0.686  -2.198  -9.423
  244    H    ASN  39           H        ASN  39   4.752  -0.045  -5.004
  245    HA   ASN  39           HA       ASN  39   7.202  -1.694  -5.234
  246   1HB   ASN  39          2HB       ASN  39   6.762   1.306  -5.033
  247   2HB   ASN  39          1HB       ASN  39   8.254   0.507  -5.532
  248   2HD2  ASN  39          2HD2      ASN  39   7.227   2.239  -7.391
  249   1HD2  ASN  39          1HD2      ASN  39   6.481   1.400  -8.664
  250    H    LEU  40           H        LEU  40   5.296  -1.273  -2.731
  251    HA   LEU  40           HA       LEU  40   5.589  -1.242  -0.408
  252   1HB   LEU  40          1HB       LEU  40   7.953  -2.336  -1.664
  253   2HB   LEU  40          2HB       LEU  40   8.400  -1.482  -0.186
  254    HG   LEU  40           HG       LEU  40   5.994  -3.233  -0.052
  255   1HD1  LEU  40          1HD1      LEU  40   8.813  -4.203  -0.478
  256   2HD1  LEU  40          2HD1      LEU  40   7.699  -5.132   0.526
  257   3HD1  LEU  40          3HD1      LEU  40   7.312  -4.822  -1.167
  258   1HD2  LEU  40          1HD2      LEU  40   8.150  -2.170   1.704
  259   2HD2  LEU  40          2HD2      LEU  40   6.431  -2.384   2.037
  260   3HD2  LEU  40          3HD2      LEU  40   7.523  -3.766   2.116
  261    H    GLU  41           H        GLU  41   5.881   1.304  -2.016
  262    HA   GLU  41           HA       GLU  41   7.896   2.906  -0.621
  263   1HB   GLU  41          1HB       GLU  41   5.979   3.122  -2.806
  264   2HB   GLU  41          2HB       GLU  41   5.962   4.567  -1.794
  265   1HG   GLU  41          2HG       GLU  41   8.425   3.311  -3.043
  266   2HG   GLU  41          1HG       GLU  41   7.634   4.791  -3.588
  267    H    PHE  42           H        PHE  42   4.350   2.594  -0.527
  268    HA   PHE  42           HA       PHE  42   2.784   3.273   1.096
  269   1HB   PHE  42          1HB       PHE  42   5.216   2.191   2.450
  270   2HB   PHE  42          2HB       PHE  42   3.992   2.947   3.472
  271    HD1  PHE  42           HD1      PHE  42   1.465   2.303   2.185
  272    HD2  PHE  42           HD2      PHE  42   4.991  -0.145   2.648
  273    HE1  PHE  42           HE1      PHE  42   0.059   0.251   2.030
  274    HE2  PHE  42           HE2      PHE  42   3.585  -2.197   2.493
  275    HZ   PHE  42           HZ       PHE  42   1.120  -1.997   2.187
  276    H    GLU  43           H        GLU  43   2.683   4.698   3.227
  277    HA   GLU  43           HA       GLU  43   2.810   6.810   4.222
  278   1HB   GLU  43          1HB       GLU  43   5.197   6.323   4.443
  279   2HB   GLU  43          2HB       GLU  43   5.482   6.788   2.768
  280   1HG   GLU  43          1HG       GLU  43   4.519   9.066   3.367
  281   2HG   GLU  43          2HG       GLU  43   4.637   8.566   5.055
  282    H    GLU  44           H        GLU  44   4.322   7.102   1.040
  283    HA   GLU  44           HA       GLU  44   2.768   9.510   0.399
  284   1HB   GLU  44          2HB       GLU  44   4.129   9.451  -1.643
  285   2HB   GLU  44          1HB       GLU  44   5.157   9.140  -0.244
  286   1HG   GLU  44          1HG       GLU  44   5.123   6.753  -0.675
  287   2HG   GLU  44          2HG       GLU  44   3.937   6.961  -1.963
  288    H    ALA  45           H        ALA  45   2.717   6.059  -0.339
  289    HA   ALA  45           HA       ALA  45   0.754   6.302  -2.498
  290   1HB   ALA  45          1HB       ALA  45   1.173   3.744  -1.055
  291   2HB   ALA  45          3HB       ALA  45   2.622   4.484  -1.737
  292   3HB   ALA  45          2HB       ALA  45   1.258   4.087  -2.782
  293    H    ALA  46           H        ALA  46   0.662   5.084   0.874
  294    HA   ALA  46           HA       ALA  46  -2.170   4.546   0.847
  295   1HB   ALA  46          1HB       ALA  46  -0.486   5.179   3.270
  296   2HB   ALA  46          3HB       ALA  46  -0.258   3.685   2.360
  297   3HB   ALA  46          2HB       ALA  46  -1.809   4.020   3.127
  298    H    GLN  47           H        GLN  47  -0.326   7.463   1.251
  299    HA   GLN  47           HA       GLN  47  -2.377   8.934   2.727
  300   1HB   GLN  47          1HB       GLN  47   0.264   9.400   1.446
  301   2HB   GLN  47          2HB       GLN  47  -0.783  10.810   1.600
  302   1HG   GLN  47          1HG       GLN  47  -1.119  10.012   4.054
  303   2HG   GLN  47          2HG       GLN  47   0.338   9.058   3.776
  304   2HE2  GLN  47          2HE2      GLN  47   2.081  10.593   2.459
  305   1HE2  GLN  47          1HE2      GLN  47   2.343  12.091   3.214
  306    H    ILE  48           H        ILE  48  -1.209   8.966  -0.669
  307    HA   ILE  48           HA       ILE  48  -3.001  10.836  -1.763
  308    HB   ILE  48           HB       ILE  48  -1.897   8.236  -2.879
  309   1HG1  ILE  48          1HG1      ILE  48  -0.900  11.041  -3.380
  310   2HG1  ILE  48          2HG1      ILE  48  -0.346  10.113  -1.986
  311   1HG2  ILE  48          1HG2      ILE  48  -3.124  10.632  -4.273
  312   2HG2  ILE  48          2HG2      ILE  48  -2.236   9.350  -5.097
  313   3HG2  ILE  48          3HG2      ILE  48  -3.750   8.983  -4.268
  314   1HD1  ILE  48          1HD1      ILE  48   0.151   8.230  -3.701
  315   2HD1  ILE  48          2HD1      ILE  48   0.029   9.504  -4.914
  316   3HD1  ILE  48          3HD1      ILE  48   1.250   9.609  -3.646
  317    H    ARG  49           H        ARG  49  -3.525   7.467  -0.867
  318    HA   ARG  49           HA       ARG  49  -5.986   6.924  -2.137
  319   1HB   ARG  49          1HB       ARG  49  -4.846   5.182  -1.014
  320   2HB   ARG  49          2HB       ARG  49  -4.645   6.135   0.451
  321   1HG   ARG  49          1HG       ARG  49  -7.461   5.817  -0.129
  322   2HG   ARG  49          2HG       ARG  49  -6.669   4.242  -0.098
  323   1HD   ARG  49          1HD       ARG  49  -7.475   4.975   2.171
  324   2HD   ARG  49          2HD       ARG  49  -5.719   4.728   2.117
  325    HE   ARG  49           HE       ARG  49  -5.524   7.227   1.761
  326   1HH1  ARG  49          1HH1      ARG  49  -8.770   6.810   1.745
  327   2HH1  ARG  49          2HH1      ARG  49  -9.127   7.823   3.105
  328   1HH2  ARG  49          1HH2      ARG  49  -5.815   8.120   4.090
  329   2HH2  ARG  49          2HH2      ARG  49  -7.454   8.564   4.431
  330    H    ASP  50           H        ASP  50  -5.230   9.050   0.538
  331    HA   ASP  50           HA       ASP  50  -7.991   9.312   1.483
  332   1HB   ASP  50          1HB       ASP  50  -5.640   9.650   2.651
  333   2HB   ASP  50          2HB       ASP  50  -5.780  11.282   1.997
  334    H    GLN  51           H        GLN  51  -5.862  10.953  -0.797
  335    HA   GLN  51           HA       GLN  51  -7.466  13.348  -1.098
  336   1HB   GLN  51          2HB       GLN  51  -5.456  11.994  -2.929
  337   2HB   GLN  51          1HB       GLN  51  -5.984  13.673  -3.050
  338   1HG   GLN  51          1HG       GLN  51  -5.027  14.200  -0.894
  339   2HG   GLN  51          2HG       GLN  51  -4.668  12.501  -0.585
  340   2HE2  GLN  51          2HE2      GLN  51  -4.188  14.038  -3.757
  341   1HE2  GLN  51          1HE2      GLN  51  -2.494  13.933  -3.740
  342    H    LEU  52           H        LEU  52  -7.262  10.250  -2.856
  343    HA   LEU  52           HA       LEU  52  -8.938  10.799  -5.049
  344   1HB   LEU  52          1HB       LEU  52  -7.942   8.512  -3.528
  345   2HB   LEU  52          2HB       LEU  52  -9.534   8.197  -4.221
  346    HG   LEU  52           HG       LEU  52  -7.740   7.570  -5.798
  347   1HD1  LEU  52          1HD1      LEU  52  -9.810   9.586  -6.316
  348   2HD1  LEU  52          2HD1      LEU  52  -8.509   9.605  -7.507
  349   3HD1  LEU  52          3HD1      LEU  52  -9.417   8.122  -7.218
  350   1HD2  LEU  52          1HD2      LEU  52  -6.182   9.404  -4.875
  351   2HD2  LEU  52          2HD2      LEU  52  -6.160   9.146  -6.620
  352   3HD2  LEU  52          3HD2      LEU  52  -7.050  10.509  -5.942
  353    H    HIS  53           H        HIS  53  -9.780  10.194  -1.675
  354    HA   HIS  53           HA       HIS  53 -12.646   9.897  -2.194
  355   1HB   HIS  53          1HB       HIS  53 -10.724   9.746   0.011
  356   2HB   HIS  53          2HB       HIS  53 -12.246  10.496   0.495
  357    HD1  HIS  53           HD1      HIS  53 -11.172   7.431  -1.526
  358    HD2  HIS  53           HD2      HIS  53 -14.142   8.610   1.152
  359    HE1  HIS  53           HE1      HIS  53 -12.623   5.395  -1.123
  360    H    GLN  54           H        GLN  54 -10.469  12.482  -1.086
  361    HA   GLN  54           HA       GLN  54 -12.522  14.397  -0.439
  362   1HB   GLN  54          1HB       GLN  54  -9.977  14.256   0.122
  363   2HB   GLN  54          2HB       GLN  54  -9.753  15.056  -1.434
  364   1HG   GLN  54          1HG       GLN  54 -11.206  16.901  -0.722
  365   2HG   GLN  54          2HG       GLN  54 -11.496  16.095   0.820
  366   2HE2  GLN  54          2HE2      GLN  54  -9.352  18.219  -0.857
  367   1HE2  GLN  54          1HE2      GLN  54  -8.142  18.290   0.332
  368    H    LEU  55           H        LEU  55 -10.668  13.721  -3.406
  369    HA   LEU  55           HA       LEU  55 -11.525  15.936  -4.967
  370   1HB   LEU  55          1HB       LEU  55 -10.360  13.250  -5.327
  371   2HB   LEU  55          2HB       LEU  55 -11.246  13.841  -6.734
  372    HG   LEU  55           HG       LEU  55  -9.576  15.917  -5.543
  373   1HD1  LEU  55          1HD1      LEU  55  -8.451  13.254  -5.790
  374   2HD1  LEU  55          2HD1      LEU  55  -7.647  14.376  -6.887
  375   3HD1  LEU  55          3HD1      LEU  55  -7.703  14.721  -5.159
  376   1HD2  LEU  55          1HD2      LEU  55 -10.282  14.772  -8.188
  377   2HD2  LEU  55          2HD2      LEU  55 -10.157  16.459  -7.691
  378   3HD2  LEU  55          3HD2      LEU  55  -8.701  15.546  -8.089
  379    H    ARG  56           H        ARG  56 -13.248  13.095  -3.925
  380    HA   ARG  56           HA       ARG  56 -15.212  12.754  -5.908
  381   1HB   ARG  56          1HB       ARG  56 -14.894  11.351  -3.903
  382   2HB   ARG  56          2HB       ARG  56 -15.455  12.675  -2.881
  383   1HG   ARG  56          1HG       ARG  56 -17.536  12.554  -4.583
  384   2HG   ARG  56          2HG       ARG  56 -17.010  10.872  -4.669
  385   1HD   ARG  56          1HD       ARG  56 -17.264  10.577  -2.293
  386   2HD   ARG  56          2HD       ARG  56 -17.495  12.320  -2.045
  387    HE   ARG  56           HE       ARG  56 -19.676  12.148  -3.066
  388   1HH1  ARG  56          1HH1      ARG  56 -18.995  10.063  -5.127
  389   2HH1  ARG  56          2HH1      ARG  56 -19.879   8.690  -4.549
  390   1HH2  ARG  56          1HH2      ARG  56 -20.360  10.001  -1.375
  391   2HH2  ARG  56          2HH2      ARG  56 -20.652   8.655  -2.426
  392    H    GLU  57           H        GLU  57 -15.381  14.935  -3.061
  393    HA   GLU  57           HA       GLU  57 -17.873  16.146  -3.635
  394   1HB   GLU  57          2HB       GLU  57 -15.382  17.395  -2.428
  395   2HB   GLU  57          1HB       GLU  57 -17.046  17.905  -2.146
  396   1HG   GLU  57          1HG       GLU  57 -17.372  15.395  -1.404
  397   2HG   GLU  57          2HG       GLU  57 -15.626  15.453  -1.164
  398    H    LEU  58           H        LEU  58 -14.593  17.100  -4.687
  399    HA   LEU  58           HA       LEU  58 -15.198  19.483  -6.055
  400   1HB   LEU  58          1HB       LEU  58 -13.066  17.654  -5.758
  401   2HB   LEU  58          2HB       LEU  58 -13.297  17.840  -7.497
  402    HG   LEU  58           HG       LEU  58 -13.422  20.355  -5.948
  403   1HD1  LEU  58          1HD1      LEU  58 -11.582  18.958  -4.848
  404   2HD1  LEU  58          2HD1      LEU  58 -10.738  19.034  -6.394
  405   3HD1  LEU  58          3HD1      LEU  58 -11.082  20.516  -5.504
  406   1HD2  LEU  58          1HD2      LEU  58 -13.362  19.838  -8.541
  407   2HD2  LEU  58          2HD2      LEU  58 -12.506  21.241  -7.900
  408   3HD2  LEU  58          3HD2      LEU  58 -11.620  19.764  -8.275
  409    H    PHE  59           H        PHE  59 -15.987  16.190  -6.905
  410    HA   PHE  59           HA       PHE  59 -16.281  16.296  -9.697
  411   1HB   PHE  59          1HB       PHE  59 -16.582  14.309  -8.268
  412   2HB   PHE  59          2HB       PHE  59 -18.056  15.008  -7.596
  413    HD1  PHE  59           HD1      PHE  59 -16.499  13.529 -10.614
  414    HD2  PHE  59           HD2      PHE  59 -20.124  15.112  -8.886
  415    HE1  PHE  59           HE1      PHE  59 -17.813  12.593 -12.514
  416    HE2  PHE  59           HE2      PHE  59 -21.439  14.175 -10.786
  417    HZ   PHE  59           HZ       PHE  59 -20.284  12.915 -12.600
  418    H    ILE  60           H        ILE  60 -18.497  17.489  -7.176
  419    HA   ILE  60           HA       ILE  60 -20.614  18.245  -9.005
  420    HB   ILE  60           HB       ILE  60 -19.878  19.108  -6.189
  421   1HG1  ILE  60          1HG1      ILE  60 -22.113  17.241  -6.908
  422   2HG1  ILE  60          2HG1      ILE  60 -20.463  16.618  -6.889
  423   1HG2  ILE  60          1HG2      ILE  60 -21.729  20.275  -7.932
  424   2HG2  ILE  60          2HG2      ILE  60 -22.697  19.207  -6.915
  425   3HG2  ILE  60          3HG2      ILE  60 -21.690  20.454  -6.178
  426   1HD1  ILE  60          1HD1      ILE  60 -20.538  18.053  -4.552
  427   2HD1  ILE  60          2HD1      ILE  60 -22.186  17.434  -4.643
  428   3HD1  ILE  60          3HD1      ILE  60 -20.821  16.316  -4.667
  429    H    ALA  61           H        ALA  61 -17.821  19.930  -7.596
  430    HA   ALA  61           HA       ALA  61 -18.499  22.584  -8.422
  431   1HB   ALA  61          1HB       ALA  61 -16.641  21.532  -6.859
  432   2HB   ALA  61          3HB       ALA  61 -15.678  21.553  -8.337
  433   3HB   ALA  61          2HB       ALA  61 -16.331  23.057  -7.688
  434    H    ALA  62           H        ALA  62 -17.305  19.831 -10.195
  435    HA   ALA  62           HA       ALA  62 -16.523  21.536 -12.512
  436   1HB   ALA  62          1HB       ALA  62 -16.298  18.543 -12.050
  437   2HB   ALA  62          3HB       ALA  62 -15.484  19.475 -13.307
  438   3HB   ALA  62          2HB       ALA  62 -15.049  19.710 -11.614
  439    H    SER  63           H        SER  63 -18.239  18.405 -12.177
  440    HA   SER  63           HA       SER  63 -19.822  18.937 -14.584
  441   1HB   SER  63          1HB       SER  63 -20.576  16.684 -14.220
  442   2HB   SER  63          2HB       SER  63 -18.878  16.717 -13.753
  443    HG   SER  63           HG       SER  63 -19.430  16.563 -11.683
  444    H    LEU   8           H        LEU   8  10.985 -31.312  -3.036
  445    HA   LEU   8           HA       LEU   8   8.561 -31.750  -2.216
  446   1HB   LEU   8          1HB       LEU   8   9.701 -34.320  -2.729
  447   2HB   LEU   8          2HB       LEU   8   9.252 -34.262  -1.024
  448    HG   LEU   8           HG       LEU   8   7.365 -35.049  -2.405
  449   1HD1  LEU   8          1HD1      LEU   8   7.030 -33.607  -0.344
  450   2HD1  LEU   8          2HD1      LEU   8   6.838 -32.230  -1.429
  451   3HD1  LEU   8          3HD1      LEU   8   5.695 -33.572  -1.497
  452   1HD2  LEU   8          1HD2      LEU   8   8.303 -33.067  -4.181
  453   2HD2  LEU   8          2HD2      LEU   8   6.888 -34.098  -4.394
  454   3HD2  LEU   8          3HD2      LEU   8   6.717 -32.512  -3.644
  455    H    GLU   9           H        GLU   9   8.711 -30.388  -0.468
  456    HA   GLU   9           HA       GLU   9   9.391 -29.536   1.630
  457   1HB   GLU   9          1HB       GLU   9   8.566 -32.071   1.894
  458   2HB   GLU   9          2HB       GLU   9  10.246 -32.301   2.383
  459   1HG   GLU   9          2HG       GLU   9   9.662 -31.552   4.427
  460   2HG   GLU   9          1HG       GLU   9   9.427 -29.962   3.699
  461    HA   PRO  10           HA       PRO  10  13.834 -29.636   0.418
  462   1HB   PRO  10          1HB       PRO  10  14.203 -26.929   0.575
  463   2HB   PRO  10          2HB       PRO  10  13.588 -27.736  -0.880
  464   1HG   PRO  10          2HG       PRO  10  12.108 -26.248   1.226
  465   2HG   PRO  10          1HG       PRO  10  11.844 -26.289  -0.523
  466   1HD   PRO  10          1HD       PRO  10  10.334 -27.690   1.269
  467   2HD   PRO  10          2HD       PRO  10  10.580 -28.191  -0.419
  468    H    ASP  11           H        ASP  11  12.339 -27.507   2.874
  469    HA   ASP  11           HA       ASP  11  12.902 -27.129   5.132
  470   1HB   ASP  11          1HB       ASP  11  13.506 -29.868   4.461
  471   2HB   ASP  11          2HB       ASP  11  14.694 -29.277   5.622
  472    H    ASN  12           H        ASN  12  15.937 -28.744   4.227
  473    HA   ASN  12           HA       ASN  12  17.356 -26.150   4.059
  474   1HB   ASN  12          2HB       ASN  12  18.830 -26.773   5.952
  475   2HB   ASN  12          1HB       ASN  12  17.148 -26.657   6.469
  476   2HD2  ASN  12          2HD2      ASN  12  19.740 -28.975   5.686
  477   1HD2  ASN  12          1HD2      ASN  12  19.006 -30.304   6.444
  478    H    VAL  13           H        VAL  13  16.861 -28.762   2.475
  479    HA   VAL  13           HA       VAL  13  19.372 -30.162   2.308
  480    HB   VAL  13           HB       VAL  13  16.804 -29.937   0.793
  481   1HG1  VAL  13          1HG1      VAL  13  19.391 -30.895  -0.397
  482   2HG1  VAL  13          2HG1      VAL  13  17.899 -31.749  -0.791
  483   3HG1  VAL  13          3HG1      VAL  13  18.061 -30.034  -1.172
  484   1HG2  VAL  13          1HG2      VAL  13  17.573 -31.530   2.764
  485   2HG2  VAL  13          2HG2      VAL  13  16.531 -32.129   1.474
  486   3HG2  VAL  13          3HG2      VAL  13  18.262 -32.467   1.438
  487    HA   PRO  14           HA       PRO  14  20.358 -27.350  -1.410
  488   1HB   PRO  14          1HB       PRO  14  18.649 -25.314  -2.043
  489   2HB   PRO  14          2HB       PRO  14  18.461 -26.956  -2.693
  490   1HG   PRO  14          2HG       PRO  14  16.986 -25.611  -0.494
  491   2HG   PRO  14          1HG       PRO  14  16.406 -26.762  -1.708
  492   1HD   PRO  14          1HD       PRO  14  16.982 -27.419   0.898
  493   2HD   PRO  14          2HD       PRO  14  16.990 -28.560  -0.458
  494    H    MET  15           H        MET  15  18.394 -25.425   0.868
  495    HA   MET  15           HA       MET  15  20.671 -24.282   2.191
  496   1HB   MET  15          1HB       MET  15  20.344 -23.279  -0.301
  497   2HB   MET  15          2HB       MET  15  19.281 -22.191   0.593
  498   1HG   MET  15          2HG       MET  15  21.306 -21.073   0.807
  499   2HG   MET  15          1HG       MET  15  21.330 -22.070   2.262
  500   1HE   MET  15          1HE       MET  15  22.332 -21.240  -1.052
  501   2HE   MET  15          2HE       MET  15  23.929 -20.978  -0.358
  502   3HE   MET  15          3HE       MET  15  23.694 -22.254  -1.548
  503    H    ASP  16           H        ASP  16  19.878 -22.280   3.547
  504    HA   ASP  16           HA       ASP  16  17.006 -22.010   3.967
  505   1HB   ASP  16          1HB       ASP  16  17.693 -24.299   4.886
  506   2HB   ASP  16          2HB       ASP  16  18.609 -23.422   6.112
  507    H    MET  17           H        MET  17  18.153 -19.810   3.626
  508    HA   MET  17           HA       MET  17  19.947 -18.620   5.433
  509   1HB   MET  17          1HB       MET  17  18.866 -16.512   4.672
  510   2HB   MET  17          2HB       MET  17  19.130 -17.629   3.331
  511   1HG   MET  17          1HG       MET  17  16.768 -18.439   3.626
  512   2HG   MET  17          2HG       MET  17  16.533 -17.163   4.822
  513   1HE   MET  17          1HE       MET  17  16.886 -18.387   1.497
  514   2HE   MET  17          2HE       MET  17  15.267 -17.686   1.364
  515   3HE   MET  17          3HE       MET  17  16.580 -17.078   0.359
  516    H    SER  18           H        SER  18  16.422 -19.025   5.723
  517    HA   SER  18           HA       SER  18  16.542 -17.861   8.476
  518   1HB   SER  18          1HB       SER  18  14.296 -18.413   6.514
  519   2HB   SER  18          2HB       SER  18  14.042 -17.775   8.135
  520    HG   SER  18           HG       SER  18  14.222 -16.011   6.862
  521    HA   PRO  19           HA       PRO  19  16.134 -21.980  10.067
  522   1HB   PRO  19          1HB       PRO  19  15.219 -21.373  12.573
  523   2HB   PRO  19          2HB       PRO  19  16.908 -21.141  12.079
  524   1HG   PRO  19          2HG       PRO  19  14.699 -19.150  12.255
  525   2HG   PRO  19          1HG       PRO  19  16.390 -18.986  12.743
  526   1HD   PRO  19          1HD       PRO  19  15.449 -17.955  10.430
  527   2HD   PRO  19          2HD       PRO  19  17.110 -18.558  10.597
  528    H    LYS  20           H        LYS  20  14.027 -21.554   8.372
  529    HA   LYS  20           HA       LYS  20  11.789 -22.125   7.948
  530   1HB   LYS  20          1HB       LYS  20  11.756 -23.530  10.611
  531   2HB   LYS  20          2HB       LYS  20  11.057 -24.039   9.083
  532   1HG   LYS  20          2HG       LYS  20  12.882 -25.379   8.931
  533   2HG   LYS  20          1HG       LYS  20  13.734 -23.906   8.461
  534   1HD   LYS  20          1HD       LYS  20  14.966 -23.980  10.336
  535   2HD   LYS  20          2HD       LYS  20  13.502 -23.973  11.322
  536   1HE   LYS  20          2HE       LYS  20  14.501 -26.026  11.926
  537   2HE   LYS  20          1HE       LYS  20  13.385 -26.528  10.640
  538   1HZ   LYS  20          1HZ       LYS  20  15.223 -26.103   9.041
  539   2HZ   LYS  20          2HZ       LYS  20  16.272 -25.886  10.362
  540   3HZ   LYS  20          3HZ       LYS  20  15.531 -27.390  10.107
  541    H    ALA  21           H        ALA  21  11.592 -21.932  11.529
  542    HA   ALA  21           HA       ALA  21   9.106 -20.672  11.721
  543   1HB   ALA  21          1HB       ALA  21  11.625 -20.324  13.381
  544   2HB   ALA  21          3HB       ALA  21  10.013 -19.848  13.916
  545   3HB   ALA  21          2HB       ALA  21  10.376 -21.548  13.615
  546    H    LEU  22           H        LEU  22  12.298 -19.087  11.469
  547    HA   LEU  22           HA       LEU  22  11.308 -16.383  11.433
  548   1HB   LEU  22          1HB       LEU  22  13.725 -17.692  11.548
  549   2HB   LEU  22          2HB       LEU  22  13.757 -17.044   9.913
  550    HG   LEU  22           HG       LEU  22  14.745 -15.387  11.333
  551   1HD1  LEU  22          1HD1      LEU  22  12.530 -14.884   9.769
  552   2HD1  LEU  22          2HD1      LEU  22  12.099 -14.111  11.295
  553   3HD1  LEU  22          3HD1      LEU  22  13.583 -13.648  10.462
  554   1HD2  LEU  22          1HD2      LEU  22  13.879 -16.267  13.464
  555   2HD2  LEU  22          2HD2      LEU  22  13.582 -14.531  13.336
  556   3HD2  LEU  22          3HD2      LEU  22  12.266 -15.673  13.058
  557    H    GLN  23           H        GLN  23  12.381 -18.584   8.840
  558    HA   GLN  23           HA       GLN  23  11.894 -16.994   6.582
  559   1HB   GLN  23          1HB       GLN  23  12.759 -19.486   7.050
  560   2HB   GLN  23          2HB       GLN  23  11.110 -19.882   6.563
  561   1HG   GLN  23          1HG       GLN  23  11.382 -18.821   4.436
  562   2HG   GLN  23          2HG       GLN  23  12.899 -18.069   4.930
  563   2HE2  GLN  23          2HE2      GLN  23  11.589 -21.444   4.961
  564   1HE2  GLN  23          1HE2      GLN  23  12.980 -22.140   4.280
  565    H    GLN  24           H        GLN  24   9.590 -19.360   7.989
  566    HA   GLN  24           HA       GLN  24   7.361 -18.624   6.368
  567   1HB   GLN  24          1HB       GLN  24   8.023 -20.386   8.497
  568   2HB   GLN  24          2HB       GLN  24   6.580 -19.503   8.999
  569   1HG   GLN  24          1HG       GLN  24   5.972 -20.066   6.393
  570   2HG   GLN  24          2HG       GLN  24   6.915 -21.489   6.838
  571   2HE2  GLN  24          2HE2      GLN  24   3.879 -19.817   7.351
  572   1HE2  GLN  24          1HE2      GLN  24   3.196 -20.970   8.394
  573    H    LYS  25           H        LYS  25   8.341 -17.509   9.623
  574    HA   LYS  25           HA       LYS  25   6.154 -15.859  10.251
  575   1HB   LYS  25          1HB       LYS  25   9.036 -16.062  10.895
  576   2HB   LYS  25          2HB       LYS  25   8.311 -14.490  11.230
  577   1HG   LYS  25          1HG       LYS  25   6.933 -15.316  12.870
  578   2HG   LYS  25          2HG       LYS  25   6.760 -16.884  12.080
  579   1HD   LYS  25          1HD       LYS  25   8.600 -17.757  13.111
  580   2HD   LYS  25          2HD       LYS  25   9.487 -16.235  13.037
  581   1HE   LYS  25          1HE       LYS  25   8.452 -15.393  14.990
  582   2HE   LYS  25          2HE       LYS  25   7.124 -16.567  14.893
  583   1HZ   LYS  25          1HZ       LYS  25   9.950 -17.407  15.159
  584   2HZ   LYS  25          2HZ       LYS  25   8.979 -17.104  16.516
  585   3HZ   LYS  25          3HZ       LYS  25   8.549 -18.331  15.423
  586    H    ILE  26           H        ILE  26   9.134 -14.917   8.488
  587    HA   ILE  26           HA       ILE  26   8.276 -12.233   7.919
  588    HB   ILE  26           HB       ILE  26  10.245 -14.108   6.570
  589   1HG1  ILE  26          1HG1      ILE  26  10.676 -11.904   8.611
  590   2HG1  ILE  26          2HG1      ILE  26  10.620 -13.624   9.001
  591   1HG2  ILE  26          1HG2      ILE  26   9.300 -11.558   5.742
  592   2HG2  ILE  26          2HG2      ILE  26  10.926 -11.322   6.382
  593   3HG2  ILE  26          3HG2      ILE  26  10.651 -12.476   5.076
  594   1HD1  ILE  26          1HD1      ILE  26  12.571 -12.344   7.064
  595   2HD1  ILE  26          2HD1      ILE  26  12.952 -12.820   8.719
  596   3HD1  ILE  26          3HD1      ILE  26  12.530 -14.046   7.523
  597    H    HIS  27           H        HIS  27   8.501 -15.057   5.710
  598    HA   HIS  27           HA       HIS  27   7.180 -13.915   3.494
  599   1HB   HIS  27          1HB       HIS  27   8.430 -16.069   3.588
  600   2HB   HIS  27          2HB       HIS  27   7.103 -16.776   4.508
  601    HD1  HIS  27           HD1      HIS  27   6.266 -18.416   2.742
  602    HD2  HIS  27           HD2      HIS  27   6.504 -14.503   1.322
  603    HE1  HIS  27           HE1      HIS  27   5.121 -18.403   0.483
  604    H    GLU  28           H        GLU  28   5.868 -14.997   6.534
  605    HA   GLU  28           HA       GLU  28   3.130 -15.368   5.598
  606   1HB   GLU  28          1HB       GLU  28   4.652 -15.306   8.171
  607   2HB   GLU  28          2HB       GLU  28   2.902 -15.100   8.252
  608   1HG   GLU  28          1HG       GLU  28   4.199 -17.356   6.711
  609   2HG   GLU  28          2HG       GLU  28   3.742 -17.506   8.408
  610    H    LEU  29           H        LEU  29   4.869 -12.790   7.370
  611    HA   LEU  29           HA       LEU  29   2.549 -11.040   7.509
  612   1HB   LEU  29          1HB       LEU  29   5.533 -10.618   7.868
  613   2HB   LEU  29          2HB       LEU  29   4.303  -9.430   8.300
  614    HG   LEU  29           HG       LEU  29   4.054 -12.220   9.368
  615   1HD1  LEU  29          1HD1      LEU  29   6.422 -11.450   9.765
  616   2HD1  LEU  29          2HD1      LEU  29   5.766 -10.072  10.650
  617   3HD1  LEU  29          3HD1      LEU  29   5.496 -11.712  11.242
  618   1HD2  LEU  29          1HD2      LEU  29   2.457 -10.089   9.593
  619   2HD2  LEU  29          2HD2      LEU  29   2.675 -11.215  10.933
  620   3HD2  LEU  29          3HD2      LEU  29   3.572  -9.697  10.903
  621    H    GLU  30           H        GLU  30   5.435 -11.229   5.420
  622    HA   GLU  30           HA       GLU  30   5.068  -8.850   3.928
  623   1HB   GLU  30          1HB       GLU  30   6.961 -10.623   3.994
  624   2HB   GLU  30          2HB       GLU  30   6.015 -11.475   2.773
  625   1HG   GLU  30          1HG       GLU  30   6.220  -8.659   2.118
  626   2HG   GLU  30          2HG       GLU  30   7.822  -9.367   2.331
  627    H    GLY  31           H        GLY  31   3.687 -12.103   3.422
  628   1HA   GLY  31          2HA       GLY  31   1.972 -12.823   1.984
  629   2HA   GLY  31          1HA       GLY  31   2.332 -11.426   0.969
  630    H    LEU  32           H        LEU  32   1.561 -11.031   4.359
  631    HA   LEU  32           HA       LEU  32  -1.290 -10.526   3.920
  632   1HB   LEU  32          1HB       LEU  32   0.000 -11.410   6.003
  633   2HB   LEU  32          2HB       LEU  32   0.358  -9.710   6.312
  634    HG   LEU  32           HG       LEU  32  -2.193  -9.337   6.014
  635   1HD1  LEU  32          1HD1      LEU  32  -2.637 -11.598   5.090
  636   2HD1  LEU  32          2HD1      LEU  32  -2.128 -12.310   6.622
  637   3HD1  LEU  32          3HD1      LEU  32  -3.570 -11.298   6.557
  638   1HD2  LEU  32          1HD2      LEU  32  -0.735  -9.410   8.179
  639   2HD2  LEU  32          2HD2      LEU  32  -2.486  -9.540   8.341
  640   3HD2  LEU  32          3HD2      LEU  32  -1.482 -10.986   8.436
  641    H    MET  33           H        MET  33   1.665  -8.626   4.037
  642    HA   MET  33           HA       MET  33   0.390  -6.043   4.390
  643   1HB   MET  33          1HB       MET  33   2.713  -6.471   4.986
  644   2HB   MET  33          2HB       MET  33   3.086  -6.946   3.328
  645   1HG   MET  33          1HG       MET  33   1.838  -4.309   3.457
  646   2HG   MET  33          2HG       MET  33   3.334  -4.380   4.389
  647   1HE   MET  33          1HE       MET  33   5.371  -5.450   3.662
  648   2HE   MET  33          2HE       MET  33   6.100  -5.110   2.094
  649   3HE   MET  33          3HE       MET  33   5.621  -3.778   3.143
  650    H    MET  34           H        MET  34   1.961  -7.542   1.528
  651    HA   MET  34           HA       MET  34   1.209  -5.619  -0.392
  652   1HB   MET  34          1HB       MET  34   2.605  -7.942  -0.336
  653   2HB   MET  34          2HB       MET  34   1.145  -8.491  -1.161
  654   1HG   MET  34          2HG       MET  34   2.332  -7.733  -2.989
  655   2HG   MET  34          1HG       MET  34   1.526  -6.231  -2.535
  656   1HE   MET  34          1HE       MET  34   3.012  -4.855  -3.738
  657   2HE   MET  34          2HE       MET  34   2.850  -4.036  -2.187
  658   3HE   MET  34          3HE       MET  34   4.425  -4.116  -2.972
  659    H    GLN  35           H        GLN  35  -0.624  -8.394   0.864
  660    HA   GLN  35           HA       GLN  35  -2.782  -8.481  -0.932
  661   1HB   GLN  35          1HB       GLN  35  -2.413 -10.073   0.876
  662   2HB   GLN  35          2HB       GLN  35  -2.659  -8.811   2.083
  663   1HG   GLN  35          2HG       GLN  35  -4.830  -9.435   2.099
  664   2HG   GLN  35          1HG       GLN  35  -4.954  -8.669   0.516
  665   2HE2  GLN  35          2HE2      GLN  35  -4.662 -11.780   2.168
  666   1HE2  GLN  35          1HE2      GLN  35  -4.951 -12.739   0.797
  667    H    HIS  36           H        HIS  36  -3.160  -6.941   2.260
  668    HA   HIS  36           HA       HIS  36  -5.406  -5.390   1.752
  669   1HB   HIS  36          1HB       HIS  36  -2.945  -4.965   3.448
  670   2HB   HIS  36          2HB       HIS  36  -4.325  -3.869   3.535
  671    HD1  HIS  36           HD1      HIS  36  -3.279  -6.068   5.737
  672    HD2  HIS  36           HD2      HIS  36  -6.659  -6.307   3.306
  673    HE1  HIS  36           HE1      HIS  36  -4.870  -7.677   6.875
  674    H    ALA  37           H        ALA  37  -2.026  -4.205   1.408
  675    HA   ALA  37           HA       ALA  37  -2.515  -1.641   0.390
  676   1HB   ALA  37          1HB       ALA  37  -0.325  -2.807   0.975
  677   2HB   ALA  37          3HB       ALA  37  -0.403  -3.579  -0.608
  678   3HB   ALA  37          2HB       ALA  37  -0.273  -1.823  -0.488
  679    H    GLN  38           H        GLN  38  -2.364  -4.733  -1.401
  680    HA   GLN  38           HA       GLN  38  -2.868  -3.594  -4.006
  681   1HB   GLN  38          1HB       GLN  38  -2.978  -6.300  -2.694
  682   2HB   GLN  38          2HB       GLN  38  -3.602  -6.109  -4.334
  683   1HG   GLN  38          1HG       GLN  38  -1.438  -5.153  -5.046
  684   2HG   GLN  38          2HG       GLN  38  -0.813  -5.356  -3.408
  685   2HE2  GLN  38          2HE2      GLN  38   0.838  -6.828  -4.478
  686   1HE2  GLN  38          1HE2      GLN  38   0.402  -8.436  -4.798
  687    H    ASN  39           H        ASN  39  -4.908  -4.729  -1.362
  688    HA   ASN  39           HA       ASN  39  -7.384  -4.435  -2.960
  689   1HB   ASN  39          2HB       ASN  39  -6.899  -5.112  -0.039
  690   2HB   ASN  39          1HB       ASN  39  -8.412  -5.334  -0.917
  691   2HD2  ASN  39          2HD2      ASN  39  -7.404  -7.631   0.188
  692   1HD2  ASN  39          1HD2      ASN  39  -6.697  -8.621  -0.997
  693    H    LEU  40           H        LEU  40  -5.418  -2.191  -1.875
  694    HA   LEU  40           HA       LEU  40  -5.661   0.029  -1.173
  695   1HB   LEU  40          1HB       LEU  40  -8.063  -0.818  -2.538
  696   2HB   LEU  40          2HB       LEU  40  -8.470   0.355  -1.284
  697    HG   LEU  40           HG       LEU  40  -6.086   0.953  -2.966
  698   1HD1  LEU  40          1HD1      LEU  40  -8.926   0.873  -3.965
  699   2HD1  LEU  40          2HD1      LEU  40  -7.801   2.082  -4.585
  700   3HD1  LEU  40          3HD1      LEU  40  -7.449   0.365  -4.784
  701   1HD2  LEU  40          1HD2      LEU  40  -8.193   2.360  -1.403
  702   2HD2  LEU  40          2HD2      LEU  40  -6.470   2.711  -1.537
  703   3HD2  LEU  40          3HD2      LEU  40  -7.575   3.207  -2.819
  704    H    GLU  41           H        GLU  41  -5.953  -2.237   0.810
  705    HA   GLU  41           HA       GLU  41  -7.914  -1.327   2.783
  706   1HB   GLU  41          1HB       GLU  41  -6.044  -3.514   2.325
  707   2HB   GLU  41          2HB       GLU  41  -5.983  -2.962   4.000
  708   1HG   GLU  41          2HG       GLU  41  -8.490  -3.753   2.486
  709   2HG   GLU  41          1HG       GLU  41  -7.693  -4.713   3.731
  710    H    PHE  42           H        PHE  42  -4.372  -1.210   2.443
  711    HA   PHE  42           HA       PHE  42  -2.761   0.123   3.531
  712   1HB   PHE  42          1HB       PHE  42  -5.176   1.773   2.930
  713   2HB   PHE  42          2HB       PHE  42  -3.919   2.512   3.922
  714    HD1  PHE  42           HD1      PHE  42  -1.430   1.421   2.888
  715    HD2  PHE  42           HD2      PHE  42  -4.979   2.628   0.746
  716    HE1  PHE  42           HE1      PHE  42  -0.058   1.839   0.851
  717    HE2  PHE  42           HE2      PHE  42  -3.606   3.045  -1.292
  718    HZ   PHE  42           HZ       PHE  42  -1.145   2.652  -1.237
  719    H    GLU  43           H        GLU  43  -2.593   1.753   5.504
  720    HA   GLU  43           HA       GLU  43  -2.670   2.101   7.814
  721   1HB   GLU  43          1HB       GLU  43  -5.057   2.494   7.457
  722   2HB   GLU  43          2HB       GLU  43  -5.372   0.763   7.428
  723   1HG   GLU  43          1HG       GLU  43  -4.366   0.663   9.763
  724   2HG   GLU  43          2HG       GLU  43  -4.453   2.425   9.771
  725    H    GLU  44           H        GLU  44  -4.247  -1.004   7.210
  726    HA   GLU  44           HA       GLU  44  -2.676  -2.337   9.302
  727   1HB   GLU  44          2HB       GLU  44  -4.082  -4.251   8.686
  728   2HB   GLU  44          1HB       GLU  44  -5.082  -2.805   8.809
  729   1HG   GLU  44          1HG       GLU  44  -5.091  -2.532   6.398
  730   2HG   GLU  44          2HG       GLU  44  -3.931  -3.846   6.205
  731    H    ALA  45           H        ALA  45  -2.687  -2.053   5.784
  732    HA   ALA  45           HA       ALA  45  -0.771  -4.224   5.359
  733   1HB   ALA  45          1HB       ALA  45  -2.645  -2.940   3.871
  734   2HB   ALA  45          2HB       ALA  45  -1.310  -3.851   3.166
  735   3HB   ALA  45          3HB       ALA  45  -1.192  -2.099   3.332
  736    H    ALA  46           H        ALA  46  -0.619  -0.646   5.157
  737    HA   ALA  46           HA       ALA  46   2.205  -0.569   4.579
  738   1HB   ALA  46          1HB       ALA  46   1.889   1.773   4.736
  739   2HB   ALA  46          3HB       ALA  46   0.586   1.603   5.912
  740   3HB   ALA  46          2HB       ALA  46   0.315   1.162   4.225
  741    H    GLN  47           H        GLN  47   0.410  -0.987   7.525
  742    HA   GLN  47           HA       GLN  47   2.511  -0.032   9.318
  743   1HB   GLN  47          1HB       GLN  47  -0.150  -1.346   9.448
  744   2HB   GLN  47          2HB       GLN  47   0.918  -1.623  10.822
  745   1HG   GLN  47          1HG       GLN  47   1.299   0.951  10.756
  746   2HG   GLN  47          2HG       GLN  47  -0.178   0.985   9.791
  747   2HE2  GLN  47          2HE2      GLN  47  -1.928  -0.687  10.916
  748   1HE2  GLN  47          1HE2      GLN  47  -2.154  -0.390  12.572
  749    H    ILE  48           H        ILE  48   1.269  -3.272   8.397
  750    HA   ILE  48           HA       ILE  48   3.061  -4.889   9.840
  751    HB   ILE  48           HB       ILE  48   1.897  -5.190   7.049
  752   1HG1  ILE  48          1HG1      ILE  48   0.927  -6.460   9.612
  753   2HG1  ILE  48          2HG1      ILE  48   0.392  -4.848   9.134
  754   1HG2  ILE  48          1HG2      ILE  48   3.125  -7.237   8.922
  755   2HG2  ILE  48          2HG2      ILE  48   2.203  -7.641   7.474
  756   3HG2  ILE  48          3HG2      ILE  48   3.729  -6.768   7.333
  757   1HD1  ILE  48          1HD1      ILE  48  -0.168  -5.940   6.849
  758   2HD1  ILE  48          2HD1      ILE  48  -0.056  -7.471   7.718
  759   3HD1  ILE  48          3HD1      ILE  48  -1.248  -6.266   8.205
  760    H    ARG  49           H        ARG  49   3.559  -3.071   6.861
  761    HA   ARG  49           HA       ARG  49   5.985  -4.175   5.929
  762   1HB   ARG  49          1HB       ARG  49   4.846  -2.579   4.604
  763   2HB   ARG  49          2HB       ARG  49   4.690  -1.446   5.940
  764   1HG   ARG  49          1HG       ARG  49   7.489  -1.959   5.416
  765   2HG   ARG  49          2HG       ARG  49   6.677  -1.463   3.932
  766   1HD   ARG  49          1HD       ARG  49   7.543   0.485   5.270
  767   2HD   ARG  49          2HD       ARG  49   5.782   0.535   5.052
  768    HE   ARG  49           HE       ARG  49   5.613  -0.522   7.347
  769   1HH1  ARG  49          1HH1      ARG  49   8.852  -0.472   6.881
  770   2HH1  ARG  49          2HH1      ARG  49   9.253   0.532   8.233
  771   1HH2  ARG  49          1HH2      ARG  49   5.968   1.447   8.864
  772   2HH2  ARG  49          2HH2      ARG  49   7.619   1.618   9.357
  773    H    ASP  50           H        ASP  50   5.317  -2.212   8.746
  774    HA   ASP  50           HA       ASP  50   8.101  -1.430   9.217
  775   1HB   ASP  50          1HB       ASP  50   5.781  -0.368   9.920
  776   2HB   ASP  50          2HB       ASP  50   5.929  -1.466  11.293
  777    H    GLN  51           H        GLN  51   5.944  -4.047  10.174
  778    HA   GLN  51           HA       GLN  51   7.574  -5.053  12.350
  779   1HB   GLN  51          2HB       GLN  51   5.504  -6.381  10.566
  780   2HB   GLN  51          1HB       GLN  51   6.053  -6.988  12.130
  781   1HG   GLN  51          1HG       GLN  51   5.151  -5.060  13.272
  782   2HG   GLN  51          2HG       GLN  51   4.776  -4.269  11.741
  783   2HE2  GLN  51          2HE2      GLN  51   4.246  -7.739  12.309
  784   1HE2  GLN  51          1HE2      GLN  51   2.551  -7.664  12.248
  785    H    LEU  52           H        LEU  52   7.288  -5.842   8.883
  786    HA   LEU  52           HA       LEU  52   8.922  -8.128   8.746
  787   1HB   LEU  52          1HB       LEU  52   7.930  -5.996   7.011
  788   2HB   LEU  52          2HB       LEU  52   9.502  -6.597   6.480
  789    HG   LEU  52           HG       LEU  52   7.663  -7.896   5.460
  790   1HD1  LEU  52          1HD1      LEU  52   9.749  -9.008   7.202
  791   2HD1  LEU  52          2HD1      LEU  52   8.421 -10.131   6.904
  792   3HD1  LEU  52          3HD1      LEU  52   9.317  -9.444   5.549
  793   1HD2  LEU  52          1HD2      LEU  52   6.152  -7.513   7.514
  794   2HD2  LEU  52          2HD2      LEU  52   6.088  -9.108   6.765
  795   3HD2  LEU  52          3HD2      LEU  52   7.010  -8.866   8.248
  796    H    HIS  53           H        HIS  53   9.830  -4.738   9.119
  797    HA   HIS  53           HA       HIS  53  12.680  -5.200   8.630
  798   1HB   HIS  53          1HB       HIS  53  10.807  -3.012   9.157
  799   2HB   HIS  53          2HB       HIS  53  12.348  -2.790   9.985
  800    HD1  HIS  53           HD1      HIS  53  11.189  -3.826   6.490
  801    HD2  HIS  53           HD2      HIS  53  14.233  -1.652   8.330
  802    HE1  HIS  53           HE1      HIS  53  12.620  -2.879   4.627
  803    H    GLN  54           H        GLN  54  10.563  -4.844  11.467
  804    HA   GLN  54           HA       GLN  54  12.656  -4.811  13.446
  805   1HB   GLN  54          1HB       GLN  54  10.122  -4.189  13.522
  806   2HB   GLN  54          2HB       GLN  54   9.875  -5.906  13.846
  807   1HG   GLN  54          1HG       GLN  54  11.367  -5.779  15.788
  808   2HG   GLN  54          2HG       GLN  54  11.681  -4.075  15.454
  809   2HE2  GLN  54          2HE2      GLN  54   9.530  -6.255  17.048
  810   1HE2  GLN  54          1HE2      GLN  54   8.347  -5.116  17.481
  811    H    LEU  55           H        LEU  55  10.729  -7.426  11.983
  812    HA   LEU  55           HA       LEU  55  11.579  -9.573  13.639
  813   1HB   LEU  55          1HB       LEU  55  10.371  -9.125  10.987
  814   2HB   LEU  55          2HB       LEU  55  11.233 -10.656  11.132
  815    HG   LEU  55           HG       LEU  55   9.618 -10.084  13.493
  816   1HD1  LEU  55          1HD1      LEU  55   8.452  -9.535  10.894
  817   2HD1  LEU  55          2HD1      LEU  55   7.638 -10.895  11.668
  818   3HD1  LEU  55          3HD1      LEU  55   7.738  -9.340  12.494
  819   1HD2  LEU  55          1HD2      LEU  55  10.250 -12.300  11.623
  820   2HD2  LEU  55          2HD2      LEU  55  10.158 -12.307  13.384
  821   3HD2  LEU  55          3HD2      LEU  55   8.682 -12.401  12.424
  822    H    ARG  56           H        ARG  56  13.286  -7.787  11.185
  823    HA   ARG  56           HA       ARG  56  15.201  -9.622  10.251
  824   1HB   ARG  56          1HB       ARG  56  14.909  -7.295   9.490
  825   2HB   ARG  56          2HB       ARG  56  15.511  -6.706  11.040
  826   1HG   ARG  56          1HG       ARG  56  17.551  -8.337  10.396
  827   2HG   ARG  56          2HG       ARG  56  17.001  -7.927   8.769
  828   1HD   ARG  56          1HD       ARG  56  17.304  -5.572   9.164
  829   2HD   ARG  56          2HD       ARG  56  17.563  -5.839  10.901
  830    HE   ARG  56           HE       ARG  56  19.718  -6.804  10.401
  831   1HH1  ARG  56          1HH1      ARG  56  18.964  -8.166   7.825
  832   2HH1  ARG  56          2HH1      ARG  56  19.843  -7.235   6.659
  833   1HH2  ARG  56          1HH2      ARG  56  20.411  -4.580   8.817
  834   2HH2  ARG  56          2HH2      ARG  56  20.663  -5.205   7.221
  835    H    GLU  57           H        GLU  57  15.463  -7.526  13.154
  836    HA   GLU  57           HA       GLU  57  17.957  -8.467  14.100
  837   1HB   GLU  57          2HB       GLU  57  15.510  -7.628  15.692
  838   2HB   GLU  57          1HB       GLU  57  17.188  -7.533  16.230
  839   1HG   GLU  57          1HG       GLU  57  17.496  -6.106  14.032
  840   2HG   GLU  57          2HG       GLU  57  15.756  -5.862  14.190
  841    H    LEU  58           H        LEU  58  14.669  -9.691  14.776
  842    HA   LEU  58           HA       LEU  58  15.274 -11.698  16.654
  843   1HB   LEU  58          1HB       LEU  58  13.126 -10.850  15.028
  844   2HB   LEU  58          2HB       LEU  58  13.319 -12.572  14.702
  845    HG   LEU  58           HG       LEU  58  13.514 -11.815  17.553
  846   1HD1  LEU  58          1HD1      LEU  58  11.680 -10.328  16.567
  847   2HD1  LEU  58          2HD1      LEU  58  10.803 -11.816  16.211
  848   3HD1  LEU  58          3HD1      LEU  58  11.186 -11.396  17.881
  849   1HD2  LEU  58          1HD2      LEU  58  13.388 -14.149  16.314
  850   2HD2  LEU  58          2HD2      LEU  58  12.567 -13.923  17.859
  851   3HD2  LEU  58          3HD2      LEU  58  11.651 -13.843  16.354
  852    H    PHE  59           H        PHE  59  16.000 -11.579  13.240
  853    HA   PHE  59           HA       PHE  59  16.233 -14.288  12.534
  854   1HB   PHE  59          1HB       PHE  59  16.540 -12.353  11.036
  855   2HB   PHE  59          2HB       PHE  59  18.037 -11.937  11.871
  856    HD1  PHE  59           HD1      PHE  59  16.393 -14.374   9.617
  857    HD2  PHE  59           HD2      PHE  59  20.078 -13.237  11.560
  858    HE1  PHE  59           HE1      PHE  59  17.652 -15.948   8.149
  859    HE2  PHE  59           HE2      PHE  59  21.337 -14.811  10.092
  860    HZ   PHE  59           HZ       PHE  59  20.124 -16.166   8.386
  861    H    ILE  60           H        ILE  60  18.521 -12.255  14.358
  862    HA   ILE  60           HA       ILE  60  20.605 -14.262  14.516
  863    HB   ILE  60           HB       ILE  60  19.946 -11.799  16.165
  864   1HG1  ILE  60          1HG1      ILE  60  22.139 -11.991  14.127
  865   2HG1  ILE  60          2HG1      ILE  60  20.481 -11.765  13.568
  866   1HG2  ILE  60          1HG2      ILE  60  21.772 -13.837  16.747
  867   2HG2  ILE  60          2HG2      ILE  60  22.747 -12.573  15.998
  868   3HG2  ILE  60          3HG2      ILE  60  21.775 -12.208  17.423
  869   1HD1  ILE  60          1HD1      ILE  60  20.626  -9.940  15.613
  870   2HD1  ILE  60          2HD1      ILE  60  22.265  -9.878  14.962
  871   3HD1  ILE  60          3HD1      ILE  60  20.885  -9.556  13.911
  872    H    ALA  61           H        ALA  61  17.868 -13.349  16.589
  873    HA   ALA  61           HA       ALA  61  18.562 -14.914  18.881
  874   1HB   ALA  61          1HB       ALA  61  16.726 -13.082  18.357
  875   2HB   ALA  61          3HB       ALA  61  15.732 -14.487  17.972
  876   3HB   ALA  61          2HB       ALA  61  16.419 -14.309  19.586
  877    H    ALA  62           H        ALA  62  17.293 -15.798  15.757
  878    HA   ALA  62           HA       ALA  62  16.483 -18.495  16.738
  879   1HB   ALA  62          1HB       ALA  62  15.399 -18.644  14.558
  880   2HB   ALA  62          3HB       ALA  62  15.006 -17.083  15.277
  881   3HB   ALA  62          2HB       ALA  62  16.228 -17.188  14.011
  882    H    SER  63           H        SER  63  18.164 -17.303  13.803
  883    HA   SER  63           HA       SER  63  19.700 -19.789  13.592
  884   1HB   SER  63          1HB       SER  63  20.431 -18.805  11.525
  885   2HB   SER  63          2HB       SER  63  18.745 -18.337  11.723
  886    HG   SER  63           HG       SER  63  19.341 -16.322  12.159

  No H/Q in entry =         886
  Start of MODEL   20
    1    H    LEU   8           H        LEU   8 -18.338  -5.733 -29.581
    2    HA   LEU   8           HA       LEU   8 -16.961  -4.324 -27.645
    3   1HB   LEU   8          1HB       LEU   8 -16.659  -3.127 -30.406
    4   2HB   LEU   8          2HB       LEU   8 -16.456  -2.158 -28.946
    5    HG   LEU   8           HG       LEU   8 -14.998  -4.734 -28.963
    6   1HD1  LEU   8          1HD1      LEU   8 -14.908  -3.320 -31.319
    7   2HD1  LEU   8          2HD1      LEU   8 -13.557  -2.622 -30.425
    8   3HD1  LEU   8          3HD1      LEU   8 -13.613  -4.360 -30.724
    9   1HD2  LEU   8          1HD2      LEU   8 -15.000  -2.483 -27.423
   10   2HD2  LEU   8          2HD2      LEU   8 -13.635  -3.596 -27.523
   11   3HD2  LEU   8          3HD2      LEU   8 -13.653  -2.133 -28.508
   12    H    GLU   9           H        GLU   9 -18.223  -2.553 -26.751
   13    HA   GLU   9           HA       GLU   9 -20.647  -1.653 -28.161
   14   1HB   GLU   9          1HB       GLU   9 -21.276  -3.871 -27.325
   15   2HB   GLU   9          2HB       GLU   9 -20.723  -3.439 -25.707
   16   1HG   GLU   9          1HG       GLU   9 -22.573  -2.174 -25.267
   17   2HG   GLU   9          2HG       GLU   9 -22.685  -1.582 -26.925
   18    HA   PRO  10           HA       PRO  10 -18.879   1.198 -24.954
   19   1HB   PRO  10          1HB       PRO  10 -18.625   3.376 -26.593
   20   2HB   PRO  10          2HB       PRO  10 -17.358   2.147 -26.412
   21   1HG   PRO  10          2HG       PRO  10 -19.327   2.523 -28.602
   22   2HG   PRO  10          1HG       PRO  10 -17.647   1.976 -28.672
   23   1HD   PRO  10          1HD       PRO  10 -19.824   0.308 -28.830
   24   2HD   PRO  10          2HD       PRO  10 -18.205  -0.199 -28.301
   25    H    ASP  11           H        ASP  11 -20.975   2.410 -27.607
   26    HA   ASP  11           HA       ASP  11 -23.042   3.536 -27.542
   27   1HB   ASP  11          1HB       ASP  11 -22.983   1.597 -25.291
   28   2HB   ASP  11          2HB       ASP  11 -24.233   2.837 -25.200
   29    H    ASN  12           H        ASN  12 -22.598   3.559 -24.031
   30    HA   ASN  12           HA       ASN  12 -21.759   6.408 -24.085
   31   1HB   ASN  12          1HB       ASN  12 -23.708   7.005 -22.658
   32   2HB   ASN  12          2HB       ASN  12 -24.218   6.396 -24.234
   33   2HD2  ASN  12          2HD2      ASN  12 -24.050   5.607 -20.781
   34   1HD2  ASN  12          1HD2      ASN  12 -25.063   4.248 -20.864
   35    H    VAL  13           H        VAL  13 -20.510   3.890 -23.169
   36    HA   VAL  13           HA       VAL  13 -20.714   3.865 -20.255
   37    HB   VAL  13           HB       VAL  13 -20.330   1.876 -21.727
   38   1HG1  VAL  13          1HG1      VAL  13 -17.681   3.275 -22.143
   39   2HG1  VAL  13          2HG1      VAL  13 -17.885   1.543 -22.397
   40   3HG1  VAL  13          3HG1      VAL  13 -18.806   2.690 -23.369
   41   1HG2  VAL  13          1HG2      VAL  13 -19.302   2.463 -19.216
   42   2HG2  VAL  13          2HG2      VAL  13 -19.376   0.859 -19.947
   43   3HG2  VAL  13          3HG2      VAL  13 -17.907   1.824 -20.084
   44    HA   PRO  14           HA       PRO  14 -16.451   5.961 -20.635
   45   1HB   PRO  14          1HB       PRO  14 -16.074   7.708 -22.699
   46   2HB   PRO  14          2HB       PRO  14 -15.637   5.992 -22.799
   47   1HG   PRO  14          2HG       PRO  14 -17.931   7.426 -23.979
   48   2HG   PRO  14          1HG       PRO  14 -17.067   5.997 -24.559
   49   1HD   PRO  14          1HD       PRO  14 -19.541   6.013 -23.268
   50   2HD   PRO  14          2HD       PRO  14 -18.504   4.600 -23.524
   51    H    MET  15           H        MET  15 -18.718   8.147 -22.359
   52    HA   MET  15           HA       MET  15 -19.577  10.254 -21.721
   53   1HB   MET  15          1HB       MET  15 -19.918   8.269 -19.663
   54   2HB   MET  15          2HB       MET  15 -19.706   9.851 -18.911
   55   1HG   MET  15          1HG       MET  15 -21.488  10.785 -20.308
   56   2HG   MET  15          2HG       MET  15 -21.675   9.238 -21.136
   57   1HE   MET  15          1HE       MET  15 -23.738   8.789 -20.954
   58   2HE   MET  15          2HE       MET  15 -24.673   8.252 -19.551
   59   3HE   MET  15          3HE       MET  15 -24.557   9.968 -19.933
   60    H    ASP  16           H        ASP  16 -19.206  11.903 -19.598
   61    HA   ASP  16           HA       ASP  16 -16.360  12.043 -18.843
   62   1HB   ASP  16          1HB       ASP  16 -16.088  14.239 -20.010
   63   2HB   ASP  16          2HB       ASP  16 -16.377  12.911 -21.135
   64    H    MET  17           H        MET  17 -18.727  11.867 -17.266
   65    HA   MET  17           HA       MET  17 -19.899  14.267 -16.385
   66   1HB   MET  17          1HB       MET  17 -20.253  12.987 -14.288
   67   2HB   MET  17          2HB       MET  17 -20.545  11.983 -15.708
   68   1HG   MET  17          1HG       MET  17 -18.144  11.192 -15.515
   69   2HG   MET  17          2HG       MET  17 -18.075  12.016 -13.958
   70   1HE   MET  17          1HE       MET  17 -19.752  11.985 -12.411
   71   2HE   MET  17          2HE       MET  17 -21.100  10.863 -12.245
   72   3HE   MET  17          3HE       MET  17 -19.533  10.484 -11.515
   73    H    SER  18           H        SER  18 -16.677  12.989 -15.745
   74    HA   SER  18           HA       SER  18 -16.019  14.641 -13.490
   75   1HB   SER  18          1HB       SER  18 -14.054  13.750 -15.588
   76   2HB   SER  18          2HB       SER  18 -13.863  13.776 -13.837
   77    HG   SER  18           HG       SER  18 -15.383  12.079 -13.728
   78    HA   PRO  19           HA       PRO  19 -15.397  18.451 -15.650
   79   1HB   PRO  19          1HB       PRO  19 -14.168  19.843 -13.649
   80   2HB   PRO  19          2HB       PRO  19 -15.898  19.456 -13.639
   81   1HG   PRO  19          1HG       PRO  19 -13.720  18.317 -12.044
   82   2HG   PRO  19          2HG       PRO  19 -15.455  18.359 -11.719
   83   1HD   PRO  19          1HD       PRO  19 -13.919  16.170 -12.699
   84   2HD   PRO  19          2HD       PRO  19 -15.676  16.244 -12.455
   85    H    LYS  20           H        LYS  20 -13.240  16.335 -15.927
   86    HA   LYS  20           HA       LYS  20 -11.089  16.217 -16.873
   87   1HB   LYS  20          1HB       LYS  20 -12.161  18.192 -18.104
   88   2HB   LYS  20          2HB       LYS  20 -11.254  19.235 -17.009
   89   1HG   LYS  20          1HG       LYS  20  -9.761  17.050 -18.392
   90   2HG   LYS  20          2HG       LYS  20 -10.232  18.456 -19.349
   91   1HD   LYS  20          1HD       LYS  20  -9.255  19.828 -17.347
   92   2HD   LYS  20          2HD       LYS  20  -8.417  18.327 -16.953
   93   1HE   LYS  20          1HE       LYS  20  -7.325  18.283 -19.115
   94   2HE   LYS  20          2HE       LYS  20  -8.302  19.651 -19.686
   95   1HZ   LYS  20          1HZ       LYS  20  -6.675  19.837 -17.225
   96   2HZ   LYS  20          2HZ       LYS  20  -6.001  20.175 -18.748
   97   3HZ   LYS  20          3HZ       LYS  20  -7.307  21.096 -18.170
   98    H    ALA  21           H        ALA  21 -10.911  19.341 -15.110
   99    HA   ALA  21           HA       ALA  21  -8.320  19.154 -14.130
  100   1HB   ALA  21          1HB       ALA  21 -10.086  20.998 -13.936
  101   2HB   ALA  21          3HB       ALA  21 -10.674  20.143 -12.509
  102   3HB   ALA  21          2HB       ALA  21  -9.033  20.789 -12.536
  103    H    LEU  22           H        LEU  22 -11.246  17.896 -12.495
  104    HA   LEU  22           HA       LEU  22  -9.675  16.628 -10.365
  105   1HB   LEU  22          1HB       LEU  22 -12.568  16.749 -11.223
  106   2HB   LEU  22          2HB       LEU  22 -12.058  15.665  -9.929
  107    HG   LEU  22           HG       LEU  22 -11.025  17.631  -8.766
  108   1HD1  LEU  22          1HD1      LEU  22 -12.122  18.960 -11.211
  109   2HD1  LEU  22          2HD1      LEU  22 -12.135  19.859  -9.693
  110   3HD1  LEU  22          3HD1      LEU  22 -10.612  19.266 -10.357
  111   1HD2  LEU  22          1HD2      LEU  22 -13.963  17.465  -9.388
  112   2HD2  LEU  22          2HD2      LEU  22 -13.124  17.085  -7.884
  113   3HD2  LEU  22          3HD2      LEU  22 -13.364  18.766  -8.358
  114    H    GLN  23           H        GLN  23 -11.387  15.667 -13.293
  115    HA   GLN  23           HA       GLN  23 -11.364  12.869 -13.113
  116   1HB   GLN  23          1HB       GLN  23 -12.270  14.436 -14.918
  117   2HB   GLN  23          2HB       GLN  23 -10.637  14.461 -15.584
  118   1HG   GLN  23          1HG       GLN  23 -11.156  11.751 -15.149
  119   2HG   GLN  23          2HG       GLN  23 -12.674  12.387 -15.782
  120   2HE2  GLN  23          2HE2      GLN  23 -10.591  10.651 -17.147
  121   1HE2  GLN  23          1HE2      GLN  23 -10.165  11.504 -18.551
  122    H    GLN  24           H        GLN  24  -8.754  14.895 -14.522
  123    HA   GLN  24           HA       GLN  24  -6.916  12.717 -14.909
  124   1HB   GLN  24          1HB       GLN  24  -6.868  14.922 -16.053
  125   2HB   GLN  24          2HB       GLN  24  -6.442  15.691 -14.523
  126   1HG   GLN  24          1HG       GLN  24  -4.766  13.399 -15.469
  127   2HG   GLN  24          2HG       GLN  24  -4.557  14.966 -16.251
  128   2HE2  GLN  24          2HE2      GLN  24  -2.578  13.664 -14.496
  129   1HE2  GLN  24          1HE2      GLN  24  -2.361  14.692 -13.163
  130    H    LYS  25           H        LYS  25  -7.309  15.093 -12.272
  131    HA   LYS  25           HA       LYS  25  -5.028  14.331 -10.732
  132   1HB   LYS  25          1HB       LYS  25  -7.546  15.838 -10.439
  133   2HB   LYS  25          2HB       LYS  25  -6.925  15.179  -8.925
  134   1HG   LYS  25          1HG       LYS  25  -5.278  16.712  -8.858
  135   2HG   LYS  25          2HG       LYS  25  -4.769  16.306 -10.499
  136   1HD   LYS  25          1HD       LYS  25  -6.199  17.890 -11.473
  137   2HD   LYS  25          2HD       LYS  25  -7.234  17.973 -10.048
  138   1HE   LYS  25          1HE       LYS  25  -5.261  18.984  -8.797
  139   2HE   LYS  25          2HE       LYS  25  -4.446  19.124 -10.367
  140   1HZ   LYS  25          1HZ       LYS  25  -6.614  20.175 -11.146
  141   2HZ   LYS  25          2HZ       LYS  25  -6.987  20.366  -9.499
  142   3HZ   LYS  25          3HZ       LYS  25  -5.613  21.120 -10.155
  143    H    ILE  26           H        ILE  26  -8.362  13.077 -10.777
  144    HA   ILE  26           HA       ILE  26  -7.897  11.234  -8.553
  145    HB   ILE  26           HB       ILE  26 -10.090  11.524 -10.631
  146   1HG1  ILE  26          1HG1      ILE  26 -10.076  12.347  -7.715
  147   2HG1  ILE  26          2HG1      ILE  26  -9.637  13.449  -9.022
  148   1HG2  ILE  26          1HG2      ILE  26  -9.579   9.466  -8.671
  149   2HG2  ILE  26          2HG2      ILE  26 -11.051  10.343  -8.249
  150   3HG2  ILE  26          3HG2      ILE  26 -10.901   9.582  -9.833
  151   1HD1  ILE  26          1HD1      ILE  26 -12.267  11.951  -8.878
  152   2HD1  ILE  26          2HD1      ILE  26 -12.049  13.618  -8.347
  153   3HD1  ILE  26          3HD1      ILE  26 -11.824  13.196 -10.044
  154    H    HIS  27           H        HIS  27  -8.212  10.930 -12.102
  155    HA   HIS  27           HA       HIS  27  -7.924   8.077 -12.209
  156   1HB   HIS  27          1HB       HIS  27  -8.840   9.469 -14.011
  157   2HB   HIS  27          2HB       HIS  27  -7.283  10.279 -14.199
  158    HD1  HIS  27           HD1      HIS  27  -8.896   6.874 -14.631
  159    HD2  HIS  27           HD2      HIS  27  -5.428   8.888 -15.767
  160    HE1  HIS  27           HE1      HIS  27  -7.712   5.378 -16.297
  161    H    GLU  28           H        GLU  28  -5.572  10.717 -12.110
  162    HA   GLU  28           HA       GLU  28  -3.291   9.011 -12.775
  163   1HB   GLU  28          1HB       GLU  28  -3.655  11.543 -13.143
  164   2HB   GLU  28          2HB       GLU  28  -3.257  11.717 -11.432
  165   1HG   GLU  28          1HG       GLU  28  -1.231  12.009 -12.758
  166   2HG   GLU  28          2HG       GLU  28  -1.116  10.502 -11.848
  167    H    LEU  29           H        LEU  29  -4.718  10.353  -9.802
  168    HA   LEU  29           HA       LEU  29  -2.608   9.413  -8.047
  169   1HB   LEU  29          1HB       LEU  29  -5.426  10.449  -7.768
  170   2HB   LEU  29          2HB       LEU  29  -4.539   9.874  -6.356
  171    HG   LEU  29           HG       LEU  29  -3.482  11.970  -8.273
  172   1HD1  LEU  29          1HD1      LEU  29  -5.171  12.154  -5.809
  173   2HD1  LEU  29          2HD1      LEU  29  -3.923  13.374  -6.057
  174   3HD1  LEU  29          3HD1      LEU  29  -5.195  13.156  -7.260
  175   1HD2  LEU  29          1HD2      LEU  29  -2.394  10.462  -6.019
  176   2HD2  LEU  29          2HD2      LEU  29  -1.554  11.470  -7.198
  177   3HD2  LEU  29          3HD2      LEU  29  -2.281  12.204  -5.768
  178    H    GLU  30           H        GLU  30  -5.697   8.079  -9.167
  179    HA   GLU  30           HA       GLU  30  -5.941   5.919  -7.325
  180   1HB   GLU  30          1HB       GLU  30  -7.692   6.702  -8.868
  181   2HB   GLU  30          2HB       GLU  30  -6.728   6.171 -10.246
  182   1HG   GLU  30          1HG       GLU  30  -7.337   4.175  -8.102
  183   2HG   GLU  30          2HG       GLU  30  -8.627   4.611  -9.224
  184    H    GLY  31           H        GLY  31  -4.455   5.964 -10.591
  185   1HA   GLY  31          2HA       GLY  31  -2.958   4.452 -11.590
  186   2HA   GLY  31          1HA       GLY  31  -3.515   3.245 -10.431
  187    H    LEU  32           H        LEU  32  -2.191   6.330  -9.401
  188    HA   LEU  32           HA       LEU  32   0.551   5.565  -9.107
  189   1HB   LEU  32          1HB       LEU  32  -0.843   7.837  -8.900
  190   2HB   LEU  32          2HB       LEU  32  -0.785   7.427  -7.184
  191    HG   LEU  32           HG       LEU  32   1.710   7.144  -7.420
  192   1HD1  LEU  32          1HD1      LEU  32   1.029   8.162 -10.179
  193   2HD1  LEU  32          2HD1      LEU  32   2.626   8.420  -9.478
  194   3HD1  LEU  32          3HD1      LEU  32   2.031   6.780  -9.736
  195   1HD2  LEU  32          1HD2      LEU  32   0.198   9.423  -7.036
  196   2HD2  LEU  32          2HD2      LEU  32   1.939   9.312  -6.784
  197   3HD2  LEU  32          3HD2      LEU  32   1.307   9.917  -8.315
  198    H    MET  33           H        MET  33  -2.286   5.034  -7.073
  199    HA   MET  33           HA       MET  33  -0.968   4.328  -4.638
  200   1HB   MET  33          1HB       MET  33  -3.603   3.856  -5.972
  201   2HB   MET  33          2HB       MET  33  -3.222   2.889  -4.547
  202   1HG   MET  33          1HG       MET  33  -3.390   4.667  -3.138
  203   2HG   MET  33          2HG       MET  33  -2.605   5.763  -4.276
  204   1HE   MET  33          1HE       MET  33  -5.590   3.383  -4.223
  205   2HE   MET  33          2HE       MET  33  -5.957   4.422  -2.840
  206   3HE   MET  33          3HE       MET  33  -7.000   4.439  -4.260
  207    H    MET  34           H        MET  34  -2.338   2.131  -7.128
  208    HA   MET  34           HA       MET  34  -1.274  -0.282  -6.087
  209   1HB   MET  34          1HB       MET  34  -2.988   0.279  -7.982
  210   2HB   MET  34          2HB       MET  34  -1.571   0.284  -9.032
  211   1HG   MET  34          1HG       MET  34  -1.259  -1.976  -8.849
  212   2HG   MET  34          2HG       MET  34  -1.803  -2.019  -7.172
  213   1HE   MET  34          1HE       MET  34  -3.813  -1.608  -6.381
  214   2HE   MET  34          2HE       MET  34  -5.177  -0.984  -7.306
  215   3HE   MET  34          3HE       MET  34  -5.117  -2.694  -6.883
  216    H    GLN  35           H        GLN  35   0.126   1.976  -8.480
  217    HA   GLN  35           HA       GLN  35   2.417   0.559  -9.250
  218   1HB   GLN  35          1HB       GLN  35   1.715   2.693 -10.197
  219   2HB   GLN  35          2HB       GLN  35   2.001   3.507  -8.660
  220   1HG   GLN  35          2HG       GLN  35   4.089   3.932  -9.403
  221   2HG   GLN  35          1HG       GLN  35   4.415   2.211  -9.205
  222   2HE2  GLN  35          2HE2      GLN  35   3.865   4.744 -11.556
  223   1HE2  GLN  35          1HE2      GLN  35   4.050   3.773 -12.936
  224    H    HIS  36           H        HIS  36   2.736   3.213  -6.891
  225    HA   HIS  36           HA       HIS  36   5.164   2.417  -5.751
  226   1HB   HIS  36          1HB       HIS  36   2.741   3.847  -4.641
  227   2HB   HIS  36          2HB       HIS  36   4.271   3.758  -3.768
  228    HD1  HIS  36           HD1      HIS  36   6.078   4.004  -6.387
  229    HD2  HIS  36           HD2      HIS  36   2.984   6.583  -5.314
  230    HE1  HIS  36           HE1      HIS  36   6.529   6.195  -7.573
  231    H    ALA  37           H        ALA  37   1.908   1.704  -4.398
  232    HA   ALA  37           HA       ALA  37   2.595   0.102  -2.220
  233   1HB   ALA  37          1HB       ALA  37   0.361  -0.014  -4.256
  234   2HB   ALA  37          2HB       ALA  37   0.380  -1.067  -2.842
  235   3HB   ALA  37          3HB       ALA  37   0.323   0.683  -2.637
  236    H    GLN  38           H        GLN  38   2.351  -0.884  -5.651
  237    HA   GLN  38           HA       GLN  38   2.826  -3.680  -5.277
  238   1HB   GLN  38          1HB       GLN  38   2.886  -1.657  -7.437
  239   2HB   GLN  38          2HB       GLN  38   3.887  -3.078  -7.732
  240   1HG   GLN  38          1HG       GLN  38   1.895  -4.508  -7.146
  241   2HG   GLN  38          2HG       GLN  38   0.926  -3.035  -7.096
  242   2HE2  GLN  38          2HE2      GLN  38   1.633  -5.539  -9.128
  243   1HE2  GLN  38          1HE2      GLN  38   1.469  -4.756 -10.625
  244    H    ASN  39           H        ASN  39   4.984  -0.894  -5.518
  245    HA   ASN  39           HA       ASN  39   7.397  -2.616  -5.450
  246   1HB   ASN  39          1HB       ASN  39   6.758   0.312  -5.782
  247   2HB   ASN  39          2HB       ASN  39   8.410  -0.197  -5.431
  248   2HD2  ASN  39          2HD2      ASN  39   5.721  -0.971  -7.714
  249   1HD2  ASN  39          1HD2      ASN  39   6.741  -1.304  -9.029
  250    H    LEU  40           H        LEU  40   5.305  -2.121  -3.168
  251    HA   LEU  40           HA       LEU  40   5.356  -1.918  -0.837
  252   1HB   LEU  40          1HB       LEU  40   8.138  -2.740  -1.648
  253   2HB   LEU  40          2HB       LEU  40   7.762  -2.458   0.052
  254    HG   LEU  40           HG       LEU  40   5.699  -4.006  -0.430
  255   1HD1  LEU  40          1HD1      LEU  40   7.546  -4.491  -2.757
  256   2HD1  LEU  40          2HD1      LEU  40   6.552  -5.804  -2.124
  257   3HD1  LEU  40          3HD1      LEU  40   5.788  -4.342  -2.750
  258   1HD2  LEU  40          1HD2      LEU  40   7.736  -4.470   1.023
  259   2HD2  LEU  40          2HD2      LEU  40   6.979  -5.899   0.322
  260   3HD2  LEU  40          3HD2      LEU  40   8.461  -5.252  -0.380
  261    H    GLU  41           H        GLU  41   6.029   0.487  -2.621
  262    HA   GLU  41           HA       GLU  41   7.932   2.136  -1.206
  263   1HB   GLU  41          1HB       GLU  41   5.655   2.546  -3.141
  264   2HB   GLU  41          2HB       GLU  41   6.490   3.937  -2.448
  265   1HG   GLU  41          1HG       GLU  41   8.266   1.812  -3.479
  266   2HG   GLU  41          2HG       GLU  41   7.310   2.640  -4.709
  267    H    PHE  42           H        PHE  42   4.379   1.902  -1.135
  268    HA   PHE  42           HA       PHE  42   2.812   2.674   0.448
  269   1HB   PHE  42          1HB       PHE  42   5.178   1.531   1.877
  270   2HB   PHE  42          2HB       PHE  42   3.921   2.299   2.846
  271    HD1  PHE  42           HD1      PHE  42   1.450   1.674   1.387
  272    HD2  PHE  42           HD2      PHE  42   4.913  -0.797   2.132
  273    HE1  PHE  42           HE1      PHE  42   0.038  -0.369   1.180
  274    HE2  PHE  42           HE2      PHE  42   3.499  -2.839   1.923
  275    HZ   PHE  42           HZ       PHE  42   1.062  -2.623   1.450
  276    H    GLU  43           H        GLU  43   2.778   4.078   2.617
  277    HA   GLU  43           HA       GLU  43   2.979   6.179   3.620
  278   1HB   GLU  43          1HB       GLU  43   5.351   5.602   3.811
  279   2HB   GLU  43          2HB       GLU  43   5.635   6.084   2.141
  280   1HG   GLU  43          1HG       GLU  43   4.741   8.382   2.792
  281   2HG   GLU  43          2HG       GLU  43   4.879   7.848   4.469
  282    H    GLU  44           H        GLU  44   4.496   6.462   0.442
  283    HA   GLU  44           HA       GLU  44   2.992   8.912  -0.171
  284   1HB   GLU  44          1HB       GLU  44   4.370   8.865  -2.200
  285   2HB   GLU  44          2HB       GLU  44   5.379   8.518  -0.796
  286   1HG   GLU  44          1HG       GLU  44   5.340   6.148  -1.268
  287   2HG   GLU  44          2HG       GLU  44   4.142   6.373  -2.543
  288    H    ALA  45           H        ALA  45   2.878   5.476  -0.956
  289    HA   ALA  45           HA       ALA  45   0.965   5.785  -3.149
  290   1HB   ALA  45          1HB       ALA  45   1.440   3.241  -1.639
  291   2HB   ALA  45          3HB       ALA  45   2.781   3.953  -2.535
  292   3HB   ALA  45          2HB       ALA  45   1.302   3.496  -3.379
  293    H    ALA  46           H        ALA  46   0.769   4.565   0.216
  294    HA   ALA  46           HA       ALA  46  -2.086   4.087   0.069
  295   1HB   ALA  46          1HB       ALA  46  -0.270   3.055   1.575
  296   2HB   ALA  46          3HB       ALA  46  -0.426   4.514   2.556
  297   3HB   ALA  46          2HB       ALA  46  -1.811   3.444   2.338
  298    H    GLN  47           H        GLN  47  -0.095   6.787   1.292
  299    HA   GLN  47           HA       GLN  47  -2.061   8.286   2.640
  300   1HB   GLN  47          1HB       GLN  47   0.413   8.868   1.057
  301   2HB   GLN  47          2HB       GLN  47  -0.593  10.228   1.554
  302   1HG   GLN  47          1HG       GLN  47   0.295   8.094   3.502
  303   2HG   GLN  47          2HG       GLN  47   1.260   9.536   3.185
  304   2HE2  GLN  47          2HE2      GLN  47   0.900  10.463   5.310
  305   1HE2  GLN  47          1HE2      GLN  47  -0.622  11.045   5.788
  306    H    ILE  48           H        ILE  48  -1.717   7.665  -0.782
  307    HA   ILE  48           HA       ILE  48  -3.201   9.888  -1.818
  308    HB   ILE  48           HB       ILE  48  -2.821   7.034  -2.780
  309   1HG1  ILE  48          1HG1      ILE  48  -1.383   9.552  -3.650
  310   2HG1  ILE  48          2HG1      ILE  48  -0.779   8.519  -2.354
  311   1HG2  ILE  48          1HG2      ILE  48  -4.730   8.197  -3.882
  312   2HG2  ILE  48          2HG2      ILE  48  -3.640   9.508  -4.332
  313   3HG2  ILE  48          3HG2      ILE  48  -3.397   7.893  -4.998
  314   1HD1  ILE  48          1HD1      ILE  48  -1.399   7.548  -5.158
  315   2HD1  ILE  48          2HD1      ILE  48   0.215   7.972  -4.588
  316   3HD1  ILE  48          3HD1      ILE  48  -0.648   6.616  -3.862
  317    H    ARG  49           H        ARG  49  -4.209   6.862  -0.315
  318    HA   ARG  49           HA       ARG  49  -6.872   6.651  -1.224
  319   1HB   ARG  49          2HB       ARG  49  -7.211   5.421   0.873
  320   2HB   ARG  49          1HB       ARG  49  -5.614   5.050   0.225
  321   1HG   ARG  49          2HG       ARG  49  -4.948   5.544   2.357
  322   2HG   ARG  49          1HG       ARG  49  -5.000   7.200   1.753
  323   1HD   ARG  49          1HD       ARG  49  -7.510   7.142   2.483
  324   2HD   ARG  49          2HD       ARG  49  -7.007   5.766   3.484
  325    HE   ARG  49           HE       ARG  49  -5.431   8.293   3.610
  326   1HH1  ARG  49          1HH1      ARG  49  -4.346   6.989   5.650
  327   2HH1  ARG  49          2HH1      ARG  49  -5.432   7.038   6.999
  328   1HH2  ARG  49          1HH2      ARG  49  -8.193   7.895   5.083
  329   2HH2  ARG  49          2HH2      ARG  49  -7.610   7.551   6.678
  330    H    ASP  50           H        ASP  50  -5.427   8.963   0.973
  331    HA   ASP  50           HA       ASP  50  -7.963   9.915   2.080
  332   1HB   ASP  50          1HB       ASP  50  -5.099  10.268   2.418
  333   2HB   ASP  50          2HB       ASP  50  -5.925  11.827   2.421
  334    H    GLN  51           H        GLN  51  -5.686  10.968  -0.450
  335    HA   GLN  51           HA       GLN  51  -7.133  13.425  -1.050
  336   1HB   GLN  51          2HB       GLN  51  -5.080  11.807  -2.596
  337   2HB   GLN  51          1HB       GLN  51  -5.537  13.474  -2.946
  338   1HG   GLN  51          1HG       GLN  51  -4.698  14.223  -0.805
  339   2HG   GLN  51          2HG       GLN  51  -4.411  12.562  -0.285
  340   2HE2  GLN  51          2HE2      GLN  51  -3.698  13.718  -3.572
  341   1HE2  GLN  51          1HE2      GLN  51  -2.012  13.573  -3.440
  342    H    LEU  52           H        LEU  52  -6.873  10.219  -2.625
  343    HA   LEU  52           HA       LEU  52  -8.565  10.727  -4.847
  344   1HB   LEU  52          1HB       LEU  52  -7.105   8.636  -3.775
  345   2HB   LEU  52          2HB       LEU  52  -8.765   8.055  -3.635
  346    HG   LEU  52           HG       LEU  52  -7.785   7.419  -5.812
  347   1HD1  LEU  52          1HD1      LEU  52 -10.261   8.286  -5.410
  348   2HD1  LEU  52          2HD1      LEU  52  -9.738   9.594  -6.471
  349   3HD1  LEU  52          3HD1      LEU  52  -9.689   7.925  -7.039
  350   1HD2  LEU  52          1HD2      LEU  52  -6.610   9.944  -5.671
  351   2HD2  LEU  52          2HD2      LEU  52  -6.577   8.864  -7.065
  352   3HD2  LEU  52          3HD2      LEU  52  -7.817  10.113  -6.946
  353    H    HIS  53           H        HIS  53  -9.345   9.754  -1.516
  354    HA   HIS  53           HA       HIS  53 -12.165   9.299  -2.000
  355   1HB   HIS  53          1HB       HIS  53 -10.444   8.667  -0.054
  356   2HB   HIS  53          2HB       HIS  53 -11.080  10.151   0.656
  357    HD1  HIS  53           HD1      HIS  53 -14.008  10.012  -0.169
  358    HD2  HIS  53           HD2      HIS  53 -11.907   6.703   1.249
  359    HE1  HIS  53           HE1      HIS  53 -15.740   8.388   0.712
  360    H    GLN  54           H        GLN  54 -10.255  12.089  -0.874
  361    HA   GLN  54           HA       GLN  54 -12.538  13.781  -0.316
  362   1HB   GLN  54          1HB       GLN  54  -9.570  14.089  -0.690
  363   2HB   GLN  54          2HB       GLN  54 -10.582  15.528  -0.565
  364   1HG   GLN  54          1HG       GLN  54 -11.316  13.600   1.466
  365   2HG   GLN  54          2HG       GLN  54  -9.594  13.968   1.561
  366   2HE2  GLN  54          2HE2      GLN  54 -12.774  15.207   2.199
  367   1HE2  GLN  54          1HE2      GLN  54 -12.297  16.755   2.706
  368    H    LEU  55           H        LEU  55 -10.412  13.323  -3.134
  369    HA   LEU  55           HA       LEU  55 -11.350  15.482  -4.735
  370   1HB   LEU  55          1HB       LEU  55 -10.216  12.734  -5.292
  371   2HB   LEU  55          2HB       LEU  55 -10.564  13.875  -6.592
  372    HG   LEU  55           HG       LEU  55  -8.886  14.664  -4.209
  373   1HD1  LEU  55          1HD1      LEU  55  -7.850  12.684  -5.281
  374   2HD1  LEU  55          2HD1      LEU  55  -7.921  13.502  -6.842
  375   3HD1  LEU  55          3HD1      LEU  55  -6.896  14.142  -5.557
  376   1HD2  LEU  55          1HD2      LEU  55 -10.003  16.155  -6.195
  377   2HD2  LEU  55          2HD2      LEU  55  -8.495  16.586  -5.387
  378   3HD2  LEU  55          3HD2      LEU  55  -8.456  15.746  -6.937
  379    H    ARG  56           H        ARG  56 -12.742  12.335  -4.020
  380    HA   ARG  56           HA       ARG  56 -14.617  12.149  -6.169
  381   1HB   ARG  56          1HB       ARG  56 -14.199  10.231  -4.841
  382   2HB   ARG  56          2HB       ARG  56 -14.405  11.120  -3.336
  383   1HG   ARG  56          1HG       ARG  56 -16.318   9.560  -3.929
  384   2HG   ARG  56          2HG       ARG  56 -16.791  11.231  -3.634
  385   1HD   ARG  56          1HD       ARG  56 -17.449  11.552  -5.797
  386   2HD   ARG  56          2HD       ARG  56 -16.091  10.614  -6.449
  387    HE   ARG  56           HE       ARG  56 -17.468   8.608  -5.368
  388   1HH1  ARG  56          1HH1      ARG  56 -20.011   9.360  -4.842
  389   2HH1  ARG  56          2HH1      ARG  56 -20.852   9.495  -6.350
  390   1HH2  ARG  56          1HH2      ARG  56 -17.959   9.665  -8.253
  391   2HH2  ARG  56          2HH2      ARG  56 -19.690   9.668  -8.281
  392    H    GLU  57           H        GLU  57 -15.465  12.925  -2.792
  393    HA   GLU  57           HA       GLU  57 -17.973  14.096  -3.256
  394   1HB   GLU  57          2HB       GLU  57 -15.882  14.924  -1.215
  395   2HB   GLU  57          1HB       GLU  57 -17.626  15.121  -1.058
  396   1HG   GLU  57          1HG       GLU  57 -17.688  12.529  -1.441
  397   2HG   GLU  57          2HG       GLU  57 -15.994  12.602  -0.952
  398    H    LEU  58           H        LEU  58 -14.758  15.603  -3.393
  399    HA   LEU  58           HA       LEU  58 -15.486  18.319  -3.658
  400   1HB   LEU  58          1HB       LEU  58 -13.239  16.532  -4.407
  401   2HB   LEU  58          2HB       LEU  58 -13.311  18.063  -5.280
  402    HG   LEU  58           HG       LEU  58 -13.529  17.906  -2.268
  403   1HD1  LEU  58          1HD1      LEU  58 -11.222  17.425  -3.918
  404   2HD1  LEU  58          2HD1      LEU  58 -11.011  18.954  -3.063
  405   3HD1  LEU  58          3HD1      LEU  58 -11.324  17.473  -2.157
  406   1HD2  LEU  58          1HD2      LEU  58 -14.059  19.945  -4.046
  407   2HD2  LEU  58          2HD2      LEU  58 -13.617  20.177  -2.354
  408   3HD2  LEU  58          3HD2      LEU  58 -12.381  20.264  -3.608
  409    H    PHE  59           H        PHE  59 -15.900  15.676  -5.890
  410    HA   PHE  59           HA       PHE  59 -15.940  16.884  -8.411
  411   1HB   PHE  59          1HB       PHE  59 -16.284  14.508  -8.021
  412   2HB   PHE  59          2HB       PHE  59 -17.779  14.829  -7.144
  413    HD1  PHE  59           HD1      PHE  59 -16.288  15.889 -10.446
  414    HD2  PHE  59           HD2      PHE  59 -19.715  14.317  -8.339
  415    HE1  PHE  59           HE1      PHE  59 -17.567  15.804 -12.585
  416    HE2  PHE  59           HE2      PHE  59 -20.992  14.234 -10.478
  417    HZ   PHE  59           HZ       PHE  59 -19.918  14.977 -12.601
  418    H    ILE  60           H        ILE  60 -18.571  16.846  -5.985
  419    HA   ILE  60           HA       ILE  60 -20.458  18.333  -7.571
  420    HB   ILE  60           HB       ILE  60 -20.142  18.078  -4.560
  421   1HG1  ILE  60          2HG1      ILE  60 -22.138  16.348  -5.615
  422   2HG1  ILE  60          1HG1      ILE  60 -20.690  16.119  -6.595
  423   1HG2  ILE  60          1HG2      ILE  60 -21.821  19.757  -5.788
  424   2HG2  ILE  60          2HG2      ILE  60 -22.774  18.283  -5.957
  425   3HG2  ILE  60          3HG2      ILE  60 -22.307  18.852  -4.354
  426   1HD1  ILE  60          1HD1      ILE  60 -20.497  16.204  -3.591
  427   2HD1  ILE  60          2HD1      ILE  60 -20.944  14.711  -4.417
  428   3HD1  ILE  60          3HD1      ILE  60 -19.388  15.470  -4.750
  429    H    ALA  61           H        ALA  61 -17.978  19.293  -5.204
  430    HA   ALA  61           HA       ALA  61 -18.673  22.056  -4.993
  431   1HB   ALA  61          1HB       ALA  61 -16.466  22.245  -4.034
  432   2HB   ALA  61          2HB       ALA  61 -17.084  20.654  -3.589
  433   3HB   ALA  61          3HB       ALA  61 -15.911  20.810  -4.896
  434    H    ALA  62           H        ALA  62 -17.111  20.244  -7.529
  435    HA   ALA  62           HA       ALA  62 -16.163  22.745  -8.854
  436   1HB   ALA  62          1HB       ALA  62 -15.289  20.016  -8.614
  437   2HB   ALA  62          3HB       ALA  62 -14.445  21.372  -9.362
  438   3HB   ALA  62          2HB       ALA  62 -15.547  20.382 -10.319
  439    H    SER  63           H        SER  63 -17.601  19.689 -10.055
  440    HA   SER  63           HA       SER  63 -19.367  21.349 -11.829
  441   1HB   SER  63          1HB       SER  63 -17.639  20.117 -13.032
  442   2HB   SER  63          2HB       SER  63 -18.072  18.628 -12.196
  443    HG   SER  63           HG       SER  63 -19.504  20.082 -14.145
  444    H    LEU   8           H        LEU   8  17.516 -27.018 -14.348
  445    HA   LEU   8           HA       LEU   8  16.206 -25.547 -12.410
  446   1HB   LEU   8          1HB       LEU   8  15.869 -28.531 -12.047
  447   2HB   LEU   8          2HB       LEU   8  15.714 -27.407 -10.696
  448    HG   LEU   8           HG       LEU   8  14.208 -26.664 -13.134
  449   1HD1  LEU   8          1HD1      LEU   8  14.095 -29.325 -12.451
  450   2HD1  LEU   8          2HD1      LEU   8  12.776 -28.650 -11.495
  451   3HD1  LEU   8          3HD1      LEU   8  12.794 -28.439 -13.245
  452   1HD2  LEU   8          1HD2      LEU   8  14.283 -25.834 -10.537
  453   2HD2  LEU   8          2HD2      LEU   8  12.896 -25.592 -11.600
  454   3HD2  LEU   8          3HD2      LEU   8  12.922 -26.954 -10.481
  455    H    GLU   9           H        GLU   9  17.517 -25.215 -10.489
  456    HA   GLU   9           HA       GLU   9  19.928 -26.859 -10.088
  457   1HB   GLU   9          1HB       GLU   9  20.533 -25.432 -11.989
  458   2HB   GLU   9          2HB       GLU   9  20.021 -23.998 -11.100
  459   1HG   GLU   9          1HG       GLU   9  21.903 -23.964  -9.805
  460   2HG   GLU   9          2HG       GLU   9  21.992 -25.724  -9.714
  461    HA   PRO  10           HA       PRO  10  18.280 -24.577  -6.398
  462   1HB   PRO  10          1HB       PRO  10  18.034 -26.766  -4.774
  463   2HB   PRO  10          2HB       PRO  10  16.748 -26.223  -5.869
  464   1HG   PRO  10          2HG       PRO  10  18.679 -28.457  -6.182
  465   2HG   PRO  10          1HG       PRO  10  16.987 -28.345  -6.685
  466   1HD   PRO  10          1HD       PRO  10  19.129 -28.049  -8.380
  467   2HD   PRO  10          2HD       PRO  10  17.512 -27.374  -8.677
  468    H    ASP  11           H        ASP  11  20.343 -27.496  -6.044
  469    HA   ASP  11           HA       ASP  11  22.433 -27.784  -4.998
  470   1HB   ASP  11          1HB       ASP  11  22.384 -25.073  -6.210
  471   2HB   ASP  11          2HB       ASP  11  23.659 -25.359  -5.025
  472    H    ASN  12           H        ASN  12  22.062 -24.423  -3.961
  473    HA   ASN  12           HA       ASN  12  21.275 -25.277  -1.227
  474   1HB   ASN  12          1HB       ASN  12  23.264 -24.109  -0.295
  475   2HB   ASN  12          2HB       ASN  12  23.731 -25.451  -1.340
  476   2HD2  ASN  12          2HD2      ASN  12  23.618 -21.916  -1.105
  477   1HD2  ASN  12          1HD2      ASN  12  24.604 -21.619  -2.453
  478    H    VAL  13           H        VAL  13  19.999 -23.661  -3.347
  479    HA   VAL  13           HA       VAL  13  20.262 -20.865  -2.543
  480    HB   VAL  13           HB       VAL  13  19.810 -21.700  -4.860
  481   1HG1  VAL  13          1HG1      VAL  13  17.180 -22.462  -3.576
  482   2HG1  VAL  13          2HG1      VAL  13  17.346 -22.212  -5.312
  483   3HG1  VAL  13          3HG1      VAL  13  18.268 -23.485  -4.514
  484   1HG2  VAL  13          1HG2      VAL  13  18.846 -19.449  -3.556
  485   2HG2  VAL  13          2HG2      VAL  13  18.874 -19.689  -5.303
  486   3HG2  VAL  13          3HG2      VAL  13  17.420 -20.077  -4.383
  487    HA   PRO  14           HA       PRO  14  16.032 -21.768  -0.542
  488   1HB   PRO  14          1HB       PRO  14  15.645 -24.241   0.551
  489   2HB   PRO  14          2HB       PRO  14  15.174 -23.838  -1.111
  490   1HG   PRO  14          2HG       PRO  14  17.469 -25.413  -0.130
  491   2HG   PRO  14          1HG       PRO  14  16.568 -25.546  -1.644
  492   1HD   PRO  14          1HD       PRO  14  19.068 -24.350  -1.320
  493   2HD   PRO  14          2HD       PRO  14  17.999 -24.176  -2.721
  494    H    MET  15           H        MET  15  18.304 -24.076   1.005
  495    HA   MET  15           HA       MET  15  19.215 -24.082   3.185
  496   1HB   MET  15          1HB       MET  15  19.561 -21.547   1.863
  497   2HB   MET  15          2HB       MET  15  19.393 -21.276   3.598
  498   1HG   MET  15          1HG       MET  15  21.164 -22.907   4.052
  499   2HG   MET  15          2HG       MET  15  21.305 -23.260   2.330
  500   1HE   MET  15          1HE       MET  15  23.362 -22.987   1.902
  501   2HE   MET  15          2HE       MET  15  24.315 -21.503   1.767
  502   3HE   MET  15          3HE       MET  15  24.224 -22.358   3.303
  503    H    ASP  16           H        ASP  16  18.917 -22.514   5.381
  504    HA   ASP  16           HA       ASP  16  16.091 -21.790   5.799
  505   1HB   ASP  16          1HB       ASP  16  15.837 -23.534   7.575
  506   2HB   ASP  16          2HB       ASP  16  16.077 -24.236   5.975
  507    H    MET  17           H        MET  17  18.485 -20.263   6.024
  508    HA   MET  17           HA       MET  17  19.722 -20.123   8.547
  509   1HB   MET  17          2HB       MET  17  20.094 -17.753   7.913
  510   2HB   MET  17          1HB       MET  17  20.337 -18.830   6.537
  511   1HG   MET  17          1HG       MET  17  17.927 -18.385   5.891
  512   2HG   MET  17          2HG       MET  17  17.906 -17.127   7.128
  513   1HE   MET  17          1HE       MET  17  19.612 -15.661   7.501
  514   2HE   MET  17          2HE       MET  17  20.942 -15.199   6.441
  515   3HE   MET  17          3HE       MET  17  19.385 -14.370   6.324
  516    H    SER  18           H        SER  18  16.490 -19.098   7.584
  517    HA   SER  18           HA       SER  18  15.908 -17.401   9.826
  518   1HB   SER  18          1HB       SER  18  13.885 -19.128   8.420
  519   2HB   SER  18          2HB       SER  18  13.731 -17.455   8.949
  520    HG   SER  18           HG       SER  18  15.221 -16.887   7.319
  521    HA   PRO  19           HA       PRO  19  15.315 -20.553  12.874
  522   1HB   PRO  19          1HB       PRO  19  14.153 -19.017  14.808
  523   2HB   PRO  19          2HB       PRO  19  15.875 -18.921  14.399
  524   1HG   PRO  19          1HG       PRO  19  13.709 -17.035  13.815
  525   2HG   PRO  19          2HG       PRO  19  15.451 -16.760  13.907
  526   1HD   PRO  19          1HD       PRO  19  13.854 -17.051  11.566
  527   2HD   PRO  19          2HD       PRO  19  15.618 -16.863  11.665
  528    H    LYS  20           H        LYS  20  13.113 -20.182  10.818
  529    HA   LYS  20           HA       LYS  20  10.941 -21.023  10.486
  530   1HB   LYS  20          1HB       LYS  20  12.025 -22.784  12.000
  531   2HB   LYS  20          2HB       LYS  20  11.160 -22.019  13.334
  532   1HG   LYS  20          1HG       LYS  20   9.597 -22.699  10.882
  533   2HG   LYS  20          2HG       LYS  20  10.076 -24.024  11.944
  534   1HD   LYS  20          1HD       LYS  20   9.166 -22.484  13.853
  535   2HD   LYS  20          2HD       LYS  20   8.308 -21.666  12.547
  536   1HE   LYS  20          1HE       LYS  20   7.172 -23.708  11.913
  537   2HE   LYS  20          2HE       LYS  20   8.162 -24.660  13.037
  538   1HZ   LYS  20          1HZ       LYS  20   6.589 -22.333  13.959
  539   2HZ   LYS  20          2HZ       LYS  20   5.891 -23.880  13.863
  540   3HZ   LYS  20          3HZ       LYS  20   7.226 -23.608  14.879
  541    H    ALA  21           H        ALA  21  10.858 -20.225  13.986
  542    HA   ALA  21           HA       ALA  21   8.283 -19.196  14.149
  543   1HB   ALA  21          1HB       ALA  21  10.690 -17.960  15.505
  544   2HB   ALA  21          3HB       ALA  21   9.061 -18.148  16.154
  545   3HB   ALA  21          2HB       ALA  21  10.089 -19.563  15.929
  546    H    LEU  22           H        LEU  22  11.220 -17.311  13.342
  547    HA   LEU  22           HA       LEU  22   9.668 -14.886  12.773
  548   1HB   LEU  22          1HB       LEU  22  12.546 -15.783  12.576
  549   2HB   LEU  22          2HB       LEU  22  12.042 -14.226  11.919
  550    HG   LEU  22           HG       LEU  22  11.070 -13.660  14.160
  551   1HD1  LEU  22          1HD1      LEU  22  12.141 -16.398  14.708
  552   2HD1  LEU  22          2HD1      LEU  22  12.203 -15.202  16.001
  553   3HD1  LEU  22          3HD1      LEU  22  10.656 -15.646  15.280
  554   1HD2  LEU  22          1HD2      LEU  22  13.990 -14.251  13.753
  555   2HD2  LEU  22          2HD2      LEU  22  13.176 -12.689  13.838
  556   3HD2  LEU  22          3HD2      LEU  22  13.437 -13.628  15.308
  557    H    GLN  23           H        GLN  23  11.302 -17.440  10.975
  558    HA   GLN  23           HA       GLN  23  11.230 -16.467   8.347
  559   1HB   GLN  23          1HB       GLN  23  12.128 -18.657   9.311
  560   2HB   GLN  23          2HB       GLN  23  10.483 -19.279   9.182
  561   1HG   GLN  23          1HG       GLN  23  10.960 -18.094   6.699
  562   2HG   GLN  23          2HG       GLN  23  12.476 -18.905   7.091
  563   2HE2  GLN  23          2HE2      GLN  23  10.333 -19.685   5.087
  564   1HE2  GLN  23          1HE2      GLN  23   9.894 -21.269   5.514
  565    H    GLN  24           H        GLN  24   8.630 -18.359   9.947
  566    HA   GLN  24           HA       GLN  24   6.746 -18.080   7.793
  567   1HB   GLN  24          1HB       GLN  24   6.715 -19.807   9.582
  568   2HB   GLN  24          2HB       GLN  24   6.334 -18.554  10.765
  569   1HG   GLN  24          1HG       GLN  24   4.597 -18.782   8.339
  570   2HG   GLN  24          2HG       GLN  24   4.401 -19.977   9.621
  571   2HE2  GLN  24          2HE2      GLN  24   2.435 -17.894   8.923
  572   1HE2  GLN  24          1HE2      GLN  24   2.264 -16.908  10.294
  573    H    LYS  25           H        LYS  25   7.235 -16.239  10.814
  574    HA   LYS  25           HA       LYS  25   4.974 -14.514  10.579
  575   1HB   LYS  25          1HB       LYS  25   7.524 -14.700  12.047
  576   2HB   LYS  25          2HB       LYS  25   6.922 -13.052  11.863
  577   1HG   LYS  25          1HG       LYS  25   5.306 -13.404  13.391
  578   2HG   LYS  25          2HG       LYS  25   4.756 -14.851  12.545
  579   1HD   LYS  25          1HD       LYS  25   6.196 -16.259  13.749
  580   2HD   LYS  25          2HD       LYS  25   7.261 -14.931  14.212
  581   1HE   LYS  25          1HE       LYS  25   5.333 -13.995  15.584
  582   2HE   LYS  25          2HE       LYS  25   4.489 -15.528  15.288
  583   1HZ   LYS  25          1HZ       LYS  25   6.660 -16.606  16.022
  584   2HZ   LYS  25          2HZ       LYS  25   7.070 -15.088  16.666
  585   3HZ   LYS  25          3HZ       LYS  25   5.698 -15.912  17.235
  586    H    ILE  26           H        ILE  26   8.281 -14.246   9.286
  587    HA   ILE  26           HA       ILE  26   7.827 -11.580   8.167
  588    HB   ILE  26           HB       ILE  26   9.981 -13.686   7.799
  589   1HG1  ILE  26          1HG1      ILE  26  10.044 -11.128   9.421
  590   2HG1  ILE  26          2HG1      ILE  26   9.599 -12.688  10.113
  591   1HG2  ILE  26          1HG2      ILE  26   9.473 -11.212   6.400
  592   2HG2  ILE  26          2HG2      ILE  26  10.969 -11.079   7.324
  593   3HG2  ILE  26          3HG2      ILE  26  10.773 -12.377   6.147
  594   1HD1  ILE  26          1HD1      ILE  26  12.204 -12.159   8.656
  595   2HD1  ILE  26          2HD1      ILE  26  12.027 -12.124  10.410
  596   3HD1  ILE  26          3HD1      ILE  26  11.759 -13.627   9.527
  597    H    HIS  27           H        HIS  27   8.065 -14.899   6.854
  598    HA   HIS  27           HA       HIS  27   7.721 -14.180   4.097
  599   1HB   HIS  27          1HB       HIS  27   8.625 -16.318   4.894
  600   2HB   HIS  27          2HB       HIS  27   7.081 -16.707   5.653
  601    HD1  HIS  27           HD1      HIS  27   8.620 -16.170   2.229
  602    HD2  HIS  27           HD2      HIS  27   5.167 -17.785   3.916
  603    HE1  HIS  27           HE1      HIS  27   7.374 -17.320   0.348
  604    H    GLU  28           H        GLU  28   5.421 -14.807   6.711
  605    HA   GLU  28           HA       GLU  28   3.095 -14.924   4.940
  606   1HB   GLU  28          1HB       GLU  28   3.500 -16.005   7.252
  607   2HB   GLU  28          2HB       GLU  28   3.139 -14.412   7.917
  608   1HG   GLU  28          2HG       GLU  28   1.092 -15.736   7.866
  609   2HG   GLU  28          1HG       GLU  28   0.967 -14.430   6.686
  610    H    LEU  29           H        LEU  29   4.607 -12.480   7.043
  611    HA   LEU  29           HA       LEU  29   2.517 -10.499   6.694
  612   1HB   LEU  29          1HB       LEU  29   5.359 -10.569   7.698
  613   2HB   LEU  29          2HB       LEU  29   4.491  -9.039   7.572
  614    HG   LEU  29           HG       LEU  29   3.434 -11.460   9.057
  615   1HD1  LEU  29          1HD1      LEU  29   5.176  -9.175   9.897
  616   2HD1  LEU  29          2HD1      LEU  29   3.946  -9.745  11.025
  617   3HD1  LEU  29          3HD1      LEU  29   5.189 -10.852  10.442
  618   1HD2  LEU  29          1HD2      LEU  29   2.364  -8.853   8.283
  619   2HD2  LEU  29          2HD2      LEU  29   1.520 -10.259   8.931
  620   3HD2  LEU  29          3HD2      LEU  29   2.288  -9.109  10.026
  621    H    GLU  30           H        GLU  30   5.557 -11.234   5.021
  622    HA   GLU  30           HA       GLU  30   5.797  -8.855   3.474
  623   1HB   GLU  30          1HB       GLU  30   7.531 -10.581   3.740
  624   2HB   GLU  30          2HB       GLU  30   6.530 -11.737   2.861
  625   1HG   GLU  30          1HG       GLU  30   7.145  -9.120   1.547
  626   2HG   GLU  30          2HG       GLU  30   8.419 -10.338   1.613
  627    H    GLY  31           H        GLY  31   4.245 -11.975   2.618
  628   1HA   GLY  31          2HA       GLY  31   2.701 -12.479   0.920
  629   2HA   GLY  31          1HA       GLY  31   3.258 -11.031   0.082
  630    H    LEU  32           H        LEU  32   2.014 -10.908   3.362
  631    HA   LEU  32           HA       LEU  32  -0.735 -10.368   2.779
  632   1HB   LEU  32          1HB       LEU  32   0.706 -10.839   4.981
  633   2HB   LEU  32          2HB       LEU  32   0.675  -9.079   5.081
  634    HG   LEU  32           HG       LEU  32  -1.830  -9.187   4.802
  635   1HD1  LEU  32          1HD1      LEU  32  -1.186 -12.131   4.972
  636   2HD1  LEU  32          2HD1      LEU  32  -2.763 -11.510   5.458
  637   3HD1  LEU  32          3HD1      LEU  32  -2.205 -11.297   3.799
  638   1HD2  LEU  32          1HD2      LEU  32  -0.267  -9.493   7.059
  639   2HD2  LEU  32          2HD2      LEU  32  -2.006  -9.195   7.066
  640   3HD2  LEU  32          3HD2      LEU  32  -1.392 -10.844   7.192
  641    H    MET  33           H        MET  33   2.132  -8.308   2.784
  642    HA   MET  33           HA       MET  33   0.852  -5.755   2.835
  643   1HB   MET  33          1HB       MET  33   3.449  -6.934   1.939
  644   2HB   MET  33          2HB       MET  33   3.079  -5.287   1.428
  645   1HG   MET  33          1HG       MET  33   3.311  -4.449   3.530
  646   2HG   MET  33          2HG       MET  33   2.524  -5.841   4.273
  647   1HE   MET  33          1HE       MET  33   5.464  -5.150   1.937
  648   2HE   MET  33          2HE       MET  33   5.877  -4.129   3.321
  649   3HE   MET  33          3HE       MET  33   6.892  -5.509   2.905
  650    H    MET  34           H        MET  34   2.128  -7.529  -0.013
  651    HA   MET  34           HA       MET  34   1.042  -5.828  -2.001
  652   1HB   MET  34          1HB       MET  34   2.726  -7.828  -2.047
  653   2HB   MET  34          2HB       MET  34   1.288  -8.815  -2.308
  654   1HG   MET  34          1HG       MET  34   0.936  -7.988  -4.413
  655   2HG   MET  34          2HG       MET  34   1.516  -6.378  -3.989
  656   1HE   MET  34          1HE       MET  34   3.550  -5.766  -3.419
  657   2HE   MET  34          2HE       MET  34   4.903  -6.852  -3.114
  658   3HE   MET  34          3HE       MET  34   4.824  -5.959  -4.631
  659    H    GLN  35           H        GLN  35  -0.365  -8.746  -0.491
  660    HA   GLN  35           HA       GLN  35  -2.697  -9.045  -2.012
  661   1HB   GLN  35          1HB       GLN  35  -1.975 -10.573  -0.257
  662   2HB   GLN  35          2HB       GLN  35  -2.214  -9.330   0.970
  663   1HG   GLN  35          2HG       GLN  35  -4.308 -10.133   1.215
  664   2HG   GLN  35          1HG       GLN  35  -4.662  -9.446  -0.370
  665   2HE2  GLN  35          2HE2      GLN  35  -4.113 -12.432   1.371
  666   1HE2  GLN  35          1HE2      GLN  35  -4.344 -13.473   0.051
  667    H    HIS  36           H        HIS  36  -2.918  -7.539   1.211
  668    HA   HIS  36           HA       HIS  36  -5.336  -6.186   0.832
  669   1HB   HIS  36          1HB       HIS  36  -2.865  -5.565   2.462
  670   2HB   HIS  36          2HB       HIS  36  -4.378  -4.682   2.663
  671    HD1  HIS  36           HD1      HIS  36  -6.235  -7.235   2.193
  672    HD2  HIS  36           HD2      HIS  36  -3.069  -6.991   4.897
  673    HE1  HIS  36           HE1      HIS  36  -6.667  -8.993   3.963
  674    H    ALA  37           H        ALA  37  -2.067  -4.731   0.459
  675    HA   ALA  37           HA       ALA  37  -2.739  -2.175  -0.437
  676   1HB   ALA  37          1HB       ALA  37  -0.466  -2.775  -0.053
  677   2HB   ALA  37          3HB       ALA  37  -0.550  -4.126  -1.183
  678   3HB   ALA  37          2HB       ALA  37  -0.559  -2.470  -1.787
  679    H    GLN  38           H        GLN  38  -2.583  -5.183  -2.368
  680    HA   GLN  38           HA       GLN  38  -3.102  -4.018  -4.929
  681   1HB   GLN  38          1HB       GLN  38  -3.170  -6.666  -3.606
  682   2HB   GLN  38          2HB       GLN  38  -4.203  -6.528  -5.027
  683   1HG   GLN  38          1HG       GLN  38  -2.228  -5.587  -6.278
  684   2HG   GLN  38          2HG       GLN  38  -1.229  -5.973  -4.875
  685   2HE2  GLN  38          2HE2      GLN  38  -2.025  -7.194  -7.838
  686   1HE2  GLN  38          1HE2      GLN  38  -1.878  -8.855  -7.520
  687    H    ASN  39           H        ASN  39  -5.214  -5.017  -2.278
  688    HA   ASN  39           HA       ASN  39  -7.658  -4.424  -3.850
  689   1HB   ASN  39          1HB       ASN  39  -6.969  -5.590  -1.156
  690   2HB   ASN  39          2HB       ASN  39  -8.623  -5.084  -1.503
  691   2HD2  ASN  39          2HD2      ASN  39  -5.997  -7.088  -2.961
  692   1HD2  ASN  39          1HD2      ASN  39  -7.049  -8.239  -3.631
  693    H    LEU  40           H        LEU  40  -5.509  -2.409  -2.773
  694    HA   LEU  40           HA       LEU  40  -5.510  -0.234  -1.911
  695   1HB   LEU  40          1HB       LEU  40  -8.322  -0.735  -2.864
  696   2HB   LEU  40          2HB       LEU  40  -7.906   0.807  -2.117
  697    HG   LEU  40           HG       LEU  40  -5.883   0.760  -3.786
  698   1HD1  LEU  40          1HD1      LEU  40  -7.785  -1.306  -4.872
  699   2HD1  LEU  40          2HD1      LEU  40  -6.804  -0.338  -5.972
  700   3HD1  LEU  40          3HD1      LEU  40  -6.026  -1.366  -4.770
  701   1HD2  LEU  40          1HD2      LEU  40  -7.898   2.313  -3.767
  702   2HD2  LEU  40          2HD2      LEU  40  -7.182   2.040  -5.355
  703   3HD2  LEU  40          3HD2      LEU  40  -8.666   1.202  -4.901
  704    H    GLU  41           H        GLU  41  -6.173  -2.621  -0.100
  705    HA   GLU  41           HA       GLU  41  -8.014  -1.710   1.929
  706   1HB   GLU  41          1HB       GLU  41  -5.771  -3.716   1.715
  707   2HB   GLU  41          2HB       GLU  41  -6.566  -3.437   3.264
  708   1HG   GLU  41          1HG       GLU  41  -8.402  -3.792   0.977
  709   2HG   GLU  41          2HG       GLU  41  -7.454  -5.220   1.396
  710    H    PHE  42           H        PHE  42  -4.466  -1.625   1.640
  711    HA   PHE  42           HA       PHE  42  -2.853  -0.353   2.795
  712   1HB   PHE  42          1HB       PHE  42  -5.211   1.377   2.165
  713   2HB   PHE  42          2HB       PHE  42  -3.921   2.068   3.148
  714    HD1  PHE  42           HD1      PHE  42  -1.491   0.818   2.075
  715    HD2  PHE  42           HD2      PHE  42  -4.985   2.281   0.001
  716    HE1  PHE  42           HE1      PHE  42  -0.121   1.185   0.026
  717    HE2  PHE  42           HE2      PHE  42  -3.613   2.647  -2.048
  718    HZ   PHE  42           HZ       PHE  42  -1.181   2.100  -2.032
  719    H    GLU  43           H        GLU  43  -2.748   1.324   4.760
  720    HA   GLU  43           HA       GLU  43  -2.889   1.685   7.064
  721   1HB   GLU  43          1HB       GLU  43  -5.268   2.066   6.622
  722   2HB   GLU  43          2HB       GLU  43  -5.575   0.333   6.613
  723   1HG   GLU  43          1HG       GLU  43  -4.627   0.286   8.979
  724   2HG   GLU  43          2HG       GLU  43  -4.741   2.047   8.951
  725    H    GLU  44           H        GLU  44  -4.466  -1.419   6.463
  726    HA   GLU  44           HA       GLU  44  -2.929  -2.730   8.597
  727   1HB   GLU  44          2HB       GLU  44  -4.350  -4.641   8.006
  728   2HB   GLU  44          1HB       GLU  44  -5.335  -3.182   8.099
  729   1HG   GLU  44          1HG       GLU  44  -5.351  -2.957   5.692
  730   2HG   GLU  44          2HG       GLU  44  -4.175  -4.258   5.515
  731    H    ALA  45           H        ALA  45  -2.896  -2.500   5.079
  732    HA   ALA  45           HA       ALA  45  -1.023  -4.717   4.703
  733   1HB   ALA  45          1HB       ALA  45  -2.859  -3.578   3.167
  734   2HB   ALA  45          3HB       ALA  45  -1.406  -4.277   2.453
  735   3HB   ALA  45          2HB       ALA  45  -1.513  -2.536   2.708
  736    H    ALA  46           H        ALA  46  -0.781  -1.146   4.494
  737    HA   ALA  46           HA       ALA  46   2.060  -1.187   3.925
  738   1HB   ALA  46          1HB       ALA  46   1.817   1.173   3.969
  739   2HB   ALA  46          3HB       ALA  46   0.254   0.575   3.416
  740   3HB   ALA  46          2HB       ALA  46   0.458   1.093   5.091
  741    H    GLN  47           H        GLN  47   0.147  -0.761   6.910
  742    HA   GLN  47           HA       GLN  47   2.169   0.069   8.683
  743   1HB   GLN  47          1HB       GLN  47  -0.326  -1.579   8.846
  744   2HB   GLN  47          2HB       GLN  47   0.715  -1.505  10.268
  745   1HG   GLN  47          1HG       GLN  47  -0.173   0.984   8.801
  746   2HG   GLN  47          2HG       GLN  47  -1.117   0.281  10.115
  747   2HE2  GLN  47          2HE2      GLN  47  -0.696   2.047  11.601
  748   1HE2  GLN  47          1HE2      GLN  47   0.845   2.316  12.260
  749    H    ILE  48           H        ILE  48   1.743  -3.025   7.117
  750    HA   ILE  48           HA       ILE  48   3.246  -4.675   8.916
  751    HB   ILE  48           HB       ILE  48   2.793  -4.776   5.915
  752   1HG1  ILE  48          1HG1      ILE  48   1.383  -6.309   8.113
  753   2HG1  ILE  48          2HG1      ILE  48   0.787  -4.762   7.508
  754   1HG2  ILE  48          1HG2      ILE  48   4.700  -6.191   6.670
  755   2HG2  ILE  48          2HG2      ILE  48   3.626  -6.981   7.824
  756   3HG2  ILE  48          3HG2      ILE  48   3.339  -7.154   6.093
  757   1HD1  ILE  48          1HD1      ILE  48   1.332  -7.180   5.761
  758   2HD1  ILE  48          2HD1      ILE  48  -0.262  -6.731   6.369
  759   3HD1  ILE  48          3HD1      ILE  48   0.591  -5.661   5.257
  760    H    ARG  49           H        ARG  49   4.228  -2.384   6.422
  761    HA   ARG  49           HA       ARG  49   6.867  -3.232   5.896
  762   1HB   ARG  49          2HB       ARG  49   7.225  -0.876   5.310
  763   2HB   ARG  49          1HB       ARG  49   5.609  -1.368   4.807
  764   1HG   ARG  49          1HG       ARG  49   4.996   0.542   5.906
  765   2HG   ARG  49          2HG       ARG  49   5.068  -0.512   7.318
  766   1HD   ARG  49          1HD       ARG  49   7.590   0.170   7.411
  767   2HD   ARG  49          2HD       ARG  49   7.082   1.530   6.391
  768    HE   ARG  49           HE       ARG  49   5.556   0.950   8.885
  769   1HH1  ARG  49          1HH1      ARG  49   4.489   3.293   8.245
  770   2HH1  ARG  49          2HH1      ARG  49   5.603   4.555   8.652
  771   1HH2  ARG  49          1HH2      ARG  49   8.340   2.435   8.860
  772   2HH2  ARG  49          2HH2      ARG  49   7.784   4.070   9.000
  773    H    ASP  50           H        ASP  50   5.510  -1.770   8.774
  774    HA   ASP  50           HA       ASP  50   8.087  -1.017   9.942
  775   1HB   ASP  50          1HB       ASP  50   5.238  -0.754  10.445
  776   2HB   ASP  50          2HB       ASP  50   6.093  -1.208  11.920
  777    H    GLN  51           H        GLN  51   5.779  -3.710  10.281
  778    HA   GLN  51           HA       GLN  51   7.259  -5.008  12.428
  779   1HB   GLN  51          2HB       GLN  51   5.144  -5.996  10.485
  780   2HB   GLN  51          1HB       GLN  51   5.625  -6.816  11.972
  781   1HG   GLN  51          1HG       GLN  51   4.844  -4.967  13.322
  782   2HG   GLN  51          2HG       GLN  51   4.537  -3.989  11.886
  783   2HE2  GLN  51          2HE2      GLN  51   3.779  -7.460  12.071
  784   1HE2  GLN  51          1HE2      GLN  51   2.094  -7.268  12.009
  785    H    LEU  52           H        LEU  52   6.906  -5.597   8.913
  786    HA   LEU  52           HA       LEU  52   8.562  -7.895   8.725
  787   1HB   LEU  52          1HB       LEU  52   7.086  -6.248   7.062
  788   2HB   LEU  52          2HB       LEU  52   8.737  -5.971   6.507
  789    HG   LEU  52           HG       LEU  52   7.701  -7.860   5.299
  790   1HD1  LEU  52          1HD1      LEU  52  10.199  -7.759   6.185
  791   2HD1  LEU  52          2HD1      LEU  52   9.680  -9.143   7.148
  792   3HD1  LEU  52          3HD1      LEU  52   9.587  -9.209   5.387
  793   1HD2  LEU  52          1HD2      LEU  52   6.577  -8.431   7.786
  794   2HD2  LEU  52          2HD2      LEU  52   6.494  -9.457   6.354
  795   3HD2  LEU  52          3HD2      LEU  52   7.760  -9.718   7.554
  796    H    HIS  53           H        HIS  53   9.391  -4.437   8.726
  797    HA   HIS  53           HA       HIS  53  12.191  -4.811   8.085
  798   1HB   HIS  53          1HB       HIS  53  10.500  -2.740   8.076
  799   2HB   HIS  53          2HB       HIS  53  11.178  -2.493   9.686
  800    HD1  HIS  53           HD1      HIS  53  14.085  -3.285   9.248
  801    HD2  HIS  53           HD2      HIS  53  11.952  -0.949   6.533
  802    HE1  HIS  53           HE1      HIS  53  15.804  -2.000   7.902
  803    H    GLN  54           H        GLN  54  10.358  -4.501  11.125
  804    HA   GLN  54           HA       GLN  54  12.684  -4.484  12.851
  805   1HB   GLN  54          1HB       GLN  54   9.715  -4.889  13.109
  806   2HB   GLN  54          2HB       GLN  54  10.756  -5.195  14.499
  807   1HG   GLN  54          1HG       GLN  54  11.496  -2.708  13.216
  808   2HG   GLN  54          2HG       GLN  54   9.783  -2.698  13.636
  809   2HE2  GLN  54          2HE2      GLN  54  12.997  -2.486  14.930
  810   1HE2  GLN  54          1HE2      GLN  54  12.561  -2.437  16.570
  811    H    LEU  55           H        LEU  55  10.492  -7.022  11.656
  812    HA   LEU  55           HA       LEU  55  11.438  -9.187  13.245
  813   1HB   LEU  55          1HB       LEU  55  10.241  -8.919  10.482
  814   2HB   LEU  55          2HB       LEU  55  10.583 -10.496  11.194
  815    HG   LEU  55           HG       LEU  55   8.969  -8.415  12.671
  816   1HD1  LEU  55          1HD1      LEU  55   7.875  -8.860  10.492
  817   2HD1  LEU  55          2HD1      LEU  55   7.930 -10.591  10.828
  818   3HD1  LEU  55          3HD1      LEU  55   6.942  -9.528  11.833
  819   1HD2  LEU  55          1HD2      LEU  55  10.074 -10.760  13.505
  820   2HD2  LEU  55          2HD2      LEU  55   8.591 -10.087  14.184
  821   3HD2  LEU  55          3HD2      LEU  55   8.505 -11.332  12.938
  822    H    ARG  56           H        ARG  56  12.784  -7.622  10.401
  823    HA   ARG  56           HA       ARG  56  14.611  -9.654   9.565
  824   1HB   ARG  56          1HB       ARG  56  14.183  -7.827   8.117
  825   2HB   ARG  56          2HB       ARG  56  14.438  -6.643   9.394
  826   1HG   ARG  56          1HG       ARG  56  16.308  -6.792   7.684
  827   2HG   ARG  56          2HG       ARG  56  16.818  -6.993   9.359
  828   1HD   ARG  56          1HD       ARG  56  17.439  -9.168   9.031
  829   2HD   ARG  56          2HD       ARG  56  16.050  -9.504   7.978
  830    HE   ARG  56           HE       ARG  56  17.411  -7.914   6.334
  831   1HH1  ARG  56          1HH1      ARG  56  19.978  -7.661   7.143
  832   2HH1  ARG  56          2HH1      ARG  56  20.791  -9.156   6.822
  833   1HH2  ARG  56          1HH2      ARG  56  17.863 -10.987   6.510
  834   2HH2  ARG  56          2HH2      ARG  56  19.593 -11.040   6.463
  835    H    GLU  57           H        GLU  57  15.543  -6.654  11.253
  836    HA   GLU  57           HA       GLU  57  18.063  -7.468  12.183
  837   1HB   GLU  57          2HB       GLU  57  16.029  -5.720  13.609
  838   2HB   GLU  57          1HB       GLU  57  17.780  -5.651  13.802
  839   1HG   GLU  57          1HG       GLU  57  17.785  -5.278  11.207
  840   2HG   GLU  57          2HG       GLU  57  16.103  -4.806  11.457
  841    H    LEU  58           H        LEU  58  14.873  -7.985  13.664
  842    HA   LEU  58           HA       LEU  58  15.647  -9.027  16.173
  843   1HB   LEU  58          1HB       LEU  58  13.352  -9.201  14.301
  844   2HB   LEU  58          2HB       LEU  58  13.434 -10.476  15.515
  845    HG   LEU  58           HG       LEU  58  13.711  -7.549  16.221
  846   1HD1  LEU  58          1HD1      LEU  58  11.363  -8.959  15.344
  847   2HD1  LEU  58          2HD1      LEU  58  11.199  -8.576  17.058
  848   3HD1  LEU  58          3HD1      LEU  58  11.501  -7.288  15.890
  849   1HD2  LEU  58          1HD2      LEU  58  14.243  -9.843  17.653
  850   2HD2  LEU  58          2HD2      LEU  58  13.840  -8.283  18.369
  851   3HD2  LEU  58          3HD2      LEU  58  12.581  -9.492  18.124
  852    H    PHE  59           H        PHE  59  15.966 -10.414  12.992
  853    HA   PHE  59           HA       PHE  59  15.976 -13.177  13.429
  854   1HB   PHE  59          1HB       PHE  59  16.284 -12.127  11.256
  855   2HB   PHE  59          2HB       PHE  59  17.803 -11.401  11.778
  856    HD1  PHE  59           HD1      PHE  59  16.264 -14.846  11.884
  857    HD2  PHE  59           HD2      PHE  59  19.703 -12.427  10.900
  858    HE1  PHE  59           HE1      PHE  59  17.497 -16.890  11.162
  859    HE2  PHE  59           HE2      PHE  59  20.934 -14.470  10.178
  860    HZ   PHE  59           HZ       PHE  59  19.831 -16.702  10.309
  861    H    ILE  60           H        ILE  60  18.655 -10.878  14.022
  862    HA   ILE  60           HA       ILE  60  20.536 -12.850  14.949
  863    HB   ILE  60           HB       ILE  60  20.278  -9.889  15.573
  864   1HG1  ILE  60          2HG1      ILE  60  22.219 -10.432  13.566
  865   2HG1  ILE  60          1HG1      ILE  60  20.747 -11.286  13.102
  866   1HG2  ILE  60          1HG2      ILE  60  21.962 -11.570  16.790
  867   2HG2  ILE  60          2HG2      ILE  60  22.885 -11.323  15.308
  868   3HG2  ILE  60          3HG2      ILE  60  22.461  -9.945  16.322
  869   1HD1  ILE  60          1HD1      ILE  60  20.618  -8.429  14.046
  870   2HD1  ILE  60          2HD1      ILE  60  21.021  -8.800  12.369
  871   3HD1  ILE  60          3HD1      ILE  60  19.471  -9.314  13.038
  872    H    ALA  61           H        ALA  61  18.124 -10.823  16.605
  873    HA   ALA  61           HA       ALA  61  18.876 -11.422  19.295
  874   1HB   ALA  61          1HB       ALA  61  17.289  -9.651  18.391
  875   2HB   ALA  61          3HB       ALA  61  16.093 -10.932  18.194
  876   3HB   ALA  61          2HB       ALA  61  16.692 -10.524  19.802
  877    H    ALA  62           H        ALA  62  17.227 -13.309  16.871
  878    HA   ALA  62           HA       ALA  62  16.300 -15.282  18.911
  879   1HB   ALA  62          1HB       ALA  62  15.610 -16.000  16.242
  880   2HB   ALA  62          3HB       ALA  62  15.380 -14.257  16.386
  881   3HB   ALA  62          2HB       ALA  62  14.546 -15.351  17.491
  882    H    SER  63           H        SER  63  17.657 -15.578  15.606
  883    HA   SER  63           HA       SER  63  19.416 -17.777  16.647
  884   1HB   SER  63          1HB       SER  63  17.641 -18.554  15.164
  885   2HB   SER  63          2HB       SER  63  18.063 -17.332  13.966
  886    HG   SER  63           HG       SER  63  19.482 -19.636  14.768

  No H/Q in entry =         886