*HEADER    SIGNALING PROTEIN                       02-NOV-05   2EW3              
*TITLE     SOLUTION STRUCTURE OF THE SH3 DOMAIN OF HUMAN SH3GL3                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: SH3-CONTAINING GRB2-LIKE PROTEIN 3;                        
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SH3 DOMAIN;                                                
*COMPND   5 SYNONYM: SH3GL3, SH3 DOMAIN PROTEIN 2C, EEN-B2;                      
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: PET-22B                                   
*KEYWDS    SH3, SH3GL3, SOLUTION STRUCTURE, NMR                                  
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    Y.G.GAO, X.Z.YAN, H.Y.HU                                              
*REVDAT   1   14-NOV-06 2EW3    0                                                


!unambig NOE
assign (segid "    " and resid    8 and name  HA2) (segid "    " and resid   55 and name   HA) 2.779 0.927 0.927 ! spec=cnoe, no=7, id=7
assign (segid "    " and resid    8 and name  HA1) (segid "    " and resid   55 and name   HA) 2.448 0.719 0.719 ! spec=cnoe, no=10, id=10
assign (segid "    " and resid   57 and name HG12) (segid "    " and resid    6 and name  HB2) 3.567 1.527 1.527 ! spec=cnoe, no=12, id=12
    or (segid "    " and resid   57 and name HG11) (segid "    " and resid    6 and name  HB2)
    or (segid "    " and resid   57 and name HG13) (segid "    " and resid    6 and name  HB2)
assign (segid "    " and resid   31 and name HG21) (segid "    " and resid   30 and name  HB1) 5.078 3.094 3.094 ! spec=cnoe, no=32, id=32
    or (segid "    " and resid   31 and name HG22) (segid "    " and resid   30 and name  HB1)
    or (segid "    " and resid   31 and name HG23) (segid "    " and resid   30 and name  HB1)
assign (segid "    " and resid    9 and name HD12) (segid "    " and resid    9 and name   HA) 1.818 0.397 0.397 ! spec=cnoe, no=34, id=34
    or (segid "    " and resid    9 and name HD11) (segid "    " and resid    9 and name   HA)
    or (segid "    " and resid    9 and name HD13) (segid "    " and resid    9 and name   HA)
assign (segid "    " and resid   31 and name   HB) (segid "    " and resid   30 and name  HB2) 3.549 1.511 1.511 ! spec=cnoe, no=54, id=54
assign (segid "    " and resid   30 and name  HB1) (segid "    " and resid   30 and name  HB2) 1.608 0.310 0.310 ! spec=cnoe, no=71, id=70
assign (segid "    " and resid    9 and name  HB1) (segid "    " and resid    9 and name HD22) 2.201 0.581 0.581 ! spec=cnoe, no=79, id=78
    or (segid "    " and resid    9 and name  HB1) (segid "    " and resid    9 and name HD21)
    or (segid "    " and resid    9 and name  HB1) (segid "    " and resid    9 and name HD23)
assign (segid "    " and resid    9 and name  HB2) (segid "    " and resid    9 and name   HA) 2.132 0.546 0.546 ! spec=cnoe, no=81, id=80
assign (segid "    " and resid   28 and name HG22) (segid "    " and resid   28 and name HD12) 2.274 0.621 0.621 ! spec=cnoe, no=92, id=91
    or (segid "    " and resid   28 and name HG22) (segid "    " and resid   28 and name HD11)
    or (segid "    " and resid   28 and name HG22) (segid "    " and resid   28 and name HD13)
    or (segid "    " and resid   28 and name HG21) (segid "    " and resid   28 and name HD12)
    or (segid "    " and resid   28 and name HG21) (segid "    " and resid   28 and name HD11)
    or (segid "    " and resid   28 and name HG21) (segid "    " and resid   28 and name HD13)
    or (segid "    " and resid   28 and name HG23) (segid "    " and resid   28 and name HD12)
    or (segid "    " and resid   28 and name HG23) (segid "    " and resid   28 and name HD11)
    or (segid "    " and resid   28 and name HG23) (segid "    " and resid   28 and name HD13)
assign (segid "    " and resid   39 and name  HB1) (segid "    " and resid   39 and name   HA) 2.424 0.705 0.705 ! spec=cnoe, no=94, id=93
assign (segid "    " and resid   39 and name  HB2) (segid "    " and resid   39 and name   HA) 3.222 1.245 1.245 ! spec=cnoe, no=96, id=95
assign (segid "    " and resid   39 and name  HB1) (segid "    " and resid   39 and name  HB2) 1.596 0.306 0.306 ! spec=cnoe, no=97, id=96
assign (segid "    " and resid   10 and name  HB1) (segid "    " and resid   10 and name  HB2) 1.602 0.308 0.308 ! spec=cnoe, no=102, id=101
assign (segid "    " and resid   49 and name  HB2) (segid "    " and resid   49 and name   HA) 2.078 0.518 0.518 ! spec=cnoe, no=103, id=102
assign (segid "    " and resid   32 and name  HB1) (segid "    " and resid   32 and name  HB2) 1.678 0.338 0.338 ! spec=cnoe, no=113, id=112
assign (segid "    " and resid   57 and name   HA) (segid "    " and resid    6 and name  HB2) 1.847 0.409 0.409 ! spec=cnoe, no=120, id=119
assign (segid "    " and resid   57 and name   HA) (segid "    " and resid    6 and name   HA) 1.932 0.448 0.448 ! spec=cnoe, no=122, id=121
assign (segid "    " and resid   34 and name HG22) (segid "    " and resid   34 and name   HA) 2.170 0.565 0.565 ! spec=cnoe, no=141, id=140
    or (segid "    " and resid   34 and name HG21) (segid "    " and resid   34 and name   HA)
    or (segid "    " and resid   34 and name HG23) (segid "    " and resid   34 and name   HA)
assign (segid "    " and resid   52 and name   HA) (segid "    " and resid   52 and name HG12) 2.191 0.576 0.576 ! spec=cnoe, no=159, id=158
    or (segid "    " and resid   52 and name   HA) (segid "    " and resid   52 and name HG11)
assign (segid "    " and resid   52 and name   HA) (segid "    " and resid   52 and name HG22) 2.106 0.532 0.532 ! spec=cnoe, no=161, id=160
    or (segid "    " and resid   52 and name   HA) (segid "    " and resid   52 and name HG21)
    or (segid "    " and resid   52 and name   HA) (segid "    " and resid   52 and name HG23)
assign (segid "    " and resid   52 and name   HB) (segid "    " and resid   52 and name HD12) 2.184 0.572 0.572 ! spec=cnoe, no=183, id=182
    or (segid "    " and resid   52 and name   HB) (segid "    " and resid   52 and name HD11)
    or (segid "    " and resid   52 and name   HB) (segid "    " and resid   52 and name HD13)
assign (segid "    " and resid   52 and name   HB) (segid "    " and resid   52 and name HG12) 3.420 1.404 1.404 ! spec=cnoe, no=184, id=183
    or (segid "    " and resid   52 and name   HB) (segid "    " and resid   52 and name HG11)
assign (segid "    " and resid   34 and name   HA) (segid "    " and resid   34 and name   HB) 2.416 0.700 0.700 ! spec=cnoe, no=186, id=185
assign (segid "    " and resid   51 and name   HA) (segid "    " and resid   51 and name  HB2) 1.875 0.422 0.422 ! spec=cnoe, no=198, id=197
assign (segid "    " and resid   52 and name HD12) (segid "    " and resid   52 and name HG12) 1.961 0.461 0.461 ! spec=cnoe, no=205, id=204
    or (segid "    " and resid   52 and name HD11) (segid "    " and resid   52 and name HG12)
    or (segid "    " and resid   52 and name HD13) (segid "    " and resid   52 and name HG12)
assign (segid "    " and resid   53 and name  HB1) (segid "    " and resid   53 and name  HB2) 1.538 0.284 0.284 ! spec=cnoe, no=213, id=212
assign (segid "    " and resid   55 and name   HB) (segid "    " and resid   55 and name   HA) 2.073 0.516 0.516 ! spec=cnoe, no=215, id=214
assign (segid "    " and resid   55 and name   HB) (segid "    " and resid    6 and name  HB2) 2.110 0.534 0.534 ! spec=cnoe, no=217, id=216
assign (segid "    " and resid   27 and name   HB) (segid "    " and resid   27 and name HG12) 1.998 0.479 0.479 ! spec=cnoe, no=221, id=220
    or (segid "    " and resid   27 and name   HB) (segid "    " and resid   27 and name HG11)
assign (segid "    " and resid   34 and name   HA) (segid "    " and resid   34 and name HD12) 2.405 0.694 0.694 ! spec=cnoe, no=224, id=223
    or (segid "    " and resid   34 and name   HA) (segid "    " and resid   34 and name HD11)
    or (segid "    " and resid   34 and name   HA) (segid "    " and resid   34 and name HD13)
assign (segid "    " and resid   27 and name   HA) (segid "    " and resid    7 and name   HA) 2.064 0.511 0.511 ! spec=cnoe, no=237, id=236
assign (segid "    " and resid   27 and name   HA) (segid "    " and resid   27 and name HG12) 3.778 1.713 1.713 ! spec=cnoe, no=238, id=237
    or (segid "    " and resid   27 and name   HA) (segid "    " and resid   27 and name HG11)
assign (segid "    " and resid    7 and name  HB2) (segid "    " and resid    7 and name   HA) 2.642 0.838 0.838 ! spec=cnoe, no=242, id=241
assign (segid "    " and resid   32 and name  HB2) (segid "    " and resid   40 and name  HB2) 2.387 0.684 0.684 ! spec=cnoe, no=243, id=242
assign (segid "    " and resid   40 and name  HB2) (segid "    " and resid   39 and name   HA) 3.568 1.528 1.528 ! spec=cnoe, no=244, id=243
assign (segid "    " and resid    6 and name  HB1) (segid "    " and resid    6 and name   HA) 2.079 0.519 0.519 ! spec=cnoe, no=252, id=251
assign (segid "    " and resid    6 and name  HB1) (segid "    " and resid    6 and name  HB2) 1.717 0.354 0.354 ! spec=cnoe, no=254, id=253
assign (segid "    " and resid   14 and name   HA) (segid "    " and resid   14 and name  HB2) 2.309 0.640 0.640 ! spec=cnoe, no=267, id=266
assign (segid "    " and resid   33 and name  HG1) (segid "    " and resid   33 and name   HA) 2.124 0.541 0.541 ! spec=cnoe, no=273, id=272
assign (segid "    " and resid   33 and name   HA) (segid "    " and resid   39 and name   HA) 1.844 0.408 0.408 ! spec=cnoe, no=284, id=283
assign (segid "    " and resid    9 and name   HA) (segid "    " and resid    9 and name HD22) 2.548 0.779 0.779 ! spec=cnoe, no=290, id=289
    or (segid "    " and resid    9 and name   HA) (segid "    " and resid    9 and name HD21)
    or (segid "    " and resid    9 and name   HA) (segid "    " and resid    9 and name HD23)
assign (segid "    " and resid    6 and name  HB2) (segid "    " and resid    6 and name   HA) 2.007 0.484 0.484 ! spec=cnoe, no=295, id=294
assign (segid "    " and resid   30 and name  HB1) (segid "    " and resid   30 and name   HA) 2.663 0.851 0.851 ! spec=cnoe, no=313, id=312
assign (segid "    " and resid   10 and name  HB1) (segid "    " and resid   10 and name   HA) 1.908 0.437 0.437 ! spec=cnoe, no=323, id=322
assign (segid "    " and resid   20 and name  HB2) (segid "    " and resid   20 and name   HA) 2.255 0.610 0.610 ! spec=cnoe, no=326, id=325
assign (segid "    " and resid   11 and name   HA) (segid "    " and resid   23 and name   HA) 1.798 0.388 0.388 ! spec=cnoe, no=330, id=329
assign (segid "    " and resid   23 and name   HA) (segid "    " and resid   23 and name  HB2) 2.000 0.480 0.480 ! spec=cnoe, no=332, id=331
assign (segid "    " and resid   28 and name HD12) (segid "    " and resid   28 and name HG12) 2.286 0.627 0.627 ! spec=cnoe, no=338, id=337
    or (segid "    " and resid   28 and name HD12) (segid "    " and resid   28 and name HG11)
    or (segid "    " and resid   28 and name HD11) (segid "    " and resid   28 and name HG12)
    or (segid "    " and resid   28 and name HD11) (segid "    " and resid   28 and name HG11)
    or (segid "    " and resid   28 and name HD13) (segid "    " and resid   28 and name HG12)
    or (segid "    " and resid   28 and name HD13) (segid "    " and resid   28 and name HG11)
assign (segid "    " and resid    4 and name  HG2) (segid "    " and resid    4 and name  HD2) 2.409 0.696 0.696 ! spec=cnoe, no=355, id=354
assign (segid "    " and resid    4 and name  HG1) (segid "    " and resid    4 and name  HD2) 2.776 0.924 0.924 ! spec=cnoe, no=358, id=357
assign (segid "    " and resid   52 and name HG22) (segid "    " and resid   52 and name HG12) 2.371 0.675 0.675 ! spec=cnoe, no=361, id=360
    or (segid "    " and resid   52 and name HG22) (segid "    " and resid   52 and name HG11)
    or (segid "    " and resid   52 and name HG21) (segid "    " and resid   52 and name HG12)
    or (segid "    " and resid   52 and name HG21) (segid "    " and resid   52 and name HG11)
    or (segid "    " and resid   52 and name HG23) (segid "    " and resid   52 and name HG12)
    or (segid "    " and resid   52 and name HG23) (segid "    " and resid   52 and name HG11)
assign (segid "    " and resid   52 and name HD12) (segid "    " and resid   52 and name HG12) 2.194 0.578 0.578 ! spec=cnoe, no=362, id=361
    or (segid "    " and resid   52 and name HD11) (segid "    " and resid   52 and name HG12)
    or (segid "    " and resid   52 and name HD13) (segid "    " and resid   52 and name HG12)
    or (segid "    " and resid   52 and name HG11) (segid "    " and resid   52 and name HD12)
    or (segid "    " and resid   52 and name HG11) (segid "    " and resid   52 and name HD11)
    or (segid "    " and resid   52 and name HG11) (segid "    " and resid   52 and name HD13)
assign (segid "    " and resid   51 and name  HD2) (segid "    " and resid   38 and name  HB2) 1.806 0.391 0.391 ! spec=cnoe, no=376, id=375
assign (segid "    " and resid   55 and name   HA) (segid "    " and resid    9 and name HD22) 2.154 0.557 0.557 ! spec=cnoe, no=383, id=382
    or (segid "    " and resid   55 and name   HA) (segid "    " and resid    9 and name HD21)
    or (segid "    " and resid   55 and name   HA) (segid "    " and resid    9 and name HD23)
assign (segid "    " and resid   14 and name  HG2) (segid "    " and resid   14 and name  HD2) 1.896 0.431 0.431 ! spec=cnoe, no=386, id=385
assign (segid "    " and resid   20 and name   HA) (segid "    " and resid   20 and name   HG) 3.499 1.469 1.469 ! spec=cnoe, no=389, id=388
assign (segid "    " and resid   20 and name  HB2) (segid "    " and resid   20 and name HD22) 2.081 0.520 0.520 ! spec=cnoe, no=392, id=390
    or (segid "    " and resid   20 and name  HB2) (segid "    " and resid   20 and name HD21)
    or (segid "    " and resid   20 and name  HB2) (segid "    " and resid   20 and name HD23)
assign (segid "    " and resid    9 and name   HG) (segid "    " and resid    9 and name HD22) 2.112 0.535 0.535 ! spec=cnoe, no=396, id=394
    or (segid "    " and resid    9 and name   HG) (segid "    " and resid    9 and name HD21)
    or (segid "    " and resid    9 and name   HG) (segid "    " and resid    9 and name HD23)
assign (segid "    " and resid   30 and name  HB1) (segid "    " and resid   30 and name HD12) 2.077 0.518 0.518 ! spec=cnoe, no=398, id=396
    or (segid "    " and resid   30 and name  HB1) (segid "    " and resid   30 and name HD11)
    or (segid "    " and resid   30 and name  HB1) (segid "    " and resid   30 and name HD13)
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid    6 and name   HN) 2.483 0.740 0.740 ! spec=nnoe, no=1, id=402
assign (segid "    " and resid    9 and name   HN) (segid "    " and resid   55 and name   HA) 2.290 0.629 0.629 ! spec=nnoe, no=8, id=409
assign (segid "    " and resid    9 and name   HN) (segid "    " and resid    9 and name   HA) 2.362 0.670 0.670 ! spec=nnoe, no=9, id=410
assign (segid "    " and resid   58 and name   HN) (segid "    " and resid    6 and name   HA) 2.160 0.560 0.560 ! spec=nnoe, no=17, id=418
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   30 and name   HA) 2.817 0.952 0.952 ! spec=nnoe, no=34, id=435
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   30 and name  HB1) 2.053 0.506 0.506 ! spec=nnoe, no=36, id=437
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid    6 and name   HN) 3.345 1.343 1.343 ! spec=nnoe, no=40, id=440
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   34 and name   HA) 2.616 0.821 0.821 ! spec=nnoe, no=47, id=447
assign (segid "    " and resid   52 and name   HN) (segid "    " and resid   52 and name HG12) 2.539 0.774 0.774 ! spec=nnoe, no=82, id=476
    or (segid "    " and resid   52 and name   HN) (segid "    " and resid   52 and name HG11)
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   32 and name  HB2) 2.566 0.790 0.790 ! spec=nnoe, no=86, id=480
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   33 and name   HN) 3.607 1.561 1.561 ! spec=nnoe, no=88, id=482
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   32 and name  HB1) 2.841 0.969 0.969 ! spec=nnoe, no=90, id=484
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   25 and name   HN) 2.339 0.657 0.657 ! spec=nnoe, no=95, id=489
assign (segid "    " and resid   46 and name   HN) (segid "    " and resid   46 and name   HA) 2.340 0.657 0.657 ! spec=nnoe, no=103, id=497
assign (segid "    " and resid   52 and name   HN) (segid "    " and resid   39 and name   HN) 3.341 1.339 1.339 ! spec=nnoe, no=111, id=505
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   38 and name  HB2) 2.559 0.786 0.786 ! spec=nnoe, no=113, id=507
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   52 and name HD12) 4.653 2.598 2.598 ! spec=nnoe, no=115, id=509
    or (segid "    " and resid   39 and name   HN) (segid "    " and resid   52 and name HD11)
    or (segid "    " and resid   39 and name   HN) (segid "    " and resid   52 and name HD13)
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   16 and name   HN) 1.966 0.464 0.464 ! spec=nnoe, no=136, id=530
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   46 and name   HN) 2.383 0.682 0.682 ! spec=nnoe, no=140, id=533
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   42 and name   HA) 1.817 0.396 0.396 ! spec=nnoe, no=141, id=534
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   43 and name   HA) 2.513 0.758 0.758 ! spec=nnoe, no=142, id=535
assign (segid "    " and resid   59 and name   HN) (segid "    " and resid    5 and name   HN) 2.276 0.622 0.622 ! spec=nnoe, no=148, id=541
assign (segid "    " and resid   58 and name   HN) (segid "    " and resid   59 and name   HN) 2.108 0.533 0.533 ! spec=nnoe, no=149, id=542
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   46 and name   HA) 5.693 3.889 3.889 ! spec=nnoe, no=151, id=544
assign (segid "    " and resid   58 and name   HN) (segid "    " and resid    7 and name   HN) 3.048 1.115 1.115 ! spec=nnoe, no=154, id=547
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid    6 and name   HA) 2.108 0.533 0.533 ! spec=nnoe, no=155, id=548
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid   55 and name   HB) 2.219 0.591 0.591 ! spec=nnoe, no=158, id=551
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   11 and name   HA) 3.393 1.382 1.382 ! spec=nnoe, no=165, id=558
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   27 and name HG12) 2.381 0.680 0.680 ! spec=nnoe, no=173, id=566
    or (segid "    " and resid   27 and name   HN) (segid "    " and resid   27 and name HG11)
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid   56 and name   HN) 2.416 0.701 0.701 ! spec=nnoe, no=174, id=567
assign (segid "    " and resid   56 and name   HN) (segid "    " and resid   55 and name   HA) 1.998 0.479 0.479 ! spec=nnoe, no=177, id=570
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   35 and name   HN) 2.122 0.540 0.540 ! spec=nnoe, no=184, id=577
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   34 and name   HA) 2.606 0.815 0.815 ! spec=nnoe, no=186, id=579
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   10 and name   HN) 3.313 1.317 1.317 ! spec=nnoe, no=195, id=588
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   10 and name  HB1) 2.230 0.596 0.596 ! spec=nnoe, no=198, id=591
assign (segid "    " and resid   54 and name   HN) (segid "    " and resid   53 and name  HB2) 4.142 2.059 2.059 ! spec=nnoe, no=207, id=600
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   32 and name  HB2) 3.467 1.442 1.442 ! spec=nnoe, no=209, id=602
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   31 and name   HN) 3.876 1.803 1.803 ! spec=nnoe, no=210, id=603
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   39 and name   HA) 1.980 0.471 0.471 ! spec=nnoe, no=213, id=606
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   39 and name  HB1) 2.222 0.593 0.593 ! spec=nnoe, no=218, id=611
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   39 and name   HA) 4.124 2.041 2.041 ! spec=nnoe, no=219, id=612
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   31 and name   HN) 1.945 0.454 0.454 ! spec=nnoe, no=220, id=613
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   32 and name  HB1) 2.756 0.912 0.912 ! spec=nnoe, no=225, id=618
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   32 and name  HB2) 2.757 0.912 0.912 ! spec=nnoe, no=226, id=619
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   42 and name   HA) 2.516 0.759 0.759 ! spec=nnoe, no=230, id=623
assign (segid "    " and resid   58 and name   HN) (segid "    " and resid    5 and name   HN) 3.636 1.586 1.586 ! spec=nnoe, no=239, id=632
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   49 and name   HN) 2.480 0.738 0.738 ! spec=nnoe, no=241, id=634
assign (segid "    " and resid   49 and name   HN) (segid "    " and resid   48 and name   HN) 3.432 1.413 1.413 ! spec=nnoe, no=242, id=635
assign (segid "    " and resid   49 and name   HN) (segid "    " and resid   49 and name   HA) 2.756 0.912 0.912 ! spec=nnoe, no=244, id=637
assign (segid "    " and resid    6 and name   HN) (segid "    " and resid   58 and name   HN) 5.812 4.053 4.053 ! spec=nnoe, no=247, id=640
assign (segid "    " and resid    6 and name   HN) (segid "    " and resid    6 and name   HA) 2.781 0.928 0.928 ! spec=nnoe, no=249, id=642
assign (segid "    " and resid   50 and name   HN) (segid "    " and resid   49 and name   HA) 2.035 0.497 0.497 ! spec=nnoe, no=257, id=650
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid    8 and name  HA1) 3.853 1.781 1.781 ! spec=nnoe, no=266, id=659
assign (segid "    " and resid   38 and name   HN) (segid "    " and resid   37 and name   HN) 1.923 0.444 0.444 ! spec=nnoe, no=272, id=665
assign (segid "    " and resid   46 and name   HN) (segid "    " and resid   47 and name   HN) 3.551 1.513 1.513 ! spec=nnoe, no=278, id=671
assign (segid "    " and resid   47 and name   HN) (segid "    " and resid   46 and name   HA) 1.809 0.393 0.393 ! spec=nnoe, no=279, id=672
assign (segid "    " and resid   36 and name   HN) (segid "    " and resid   37 and name   HA) 4.168 2.085 2.085 ! spec=nnoe, no=285, id=678
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid   55 and name   HA) 3.346 1.343 1.343 ! spec=nnoe, no=290, id=683
assign (segid "    " and resid    9 and name   HN) (segid "    " and resid   10 and name   HN) 2.045 0.502 0.502 ! spec=nnoe, no=292, id=685
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid    9 and name   HA) 2.609 0.817 0.817 ! spec=nnoe, no=295, id=688
assign (segid "    " and resid   19 and name   HN) (segid "    " and resid   18 and name   HN) 2.303 0.636 0.636 ! spec=nnoe, no=302, id=695
assign (segid "    " and resid   53 and name   HN) (segid "    " and resid   53 and name  HB2) 2.303 0.636 0.636 ! spec=nnoe, no=309, id=702
assign (segid "    " and resid   53 and name   HN) (segid "    " and resid   52 and name HG12) 4.056 1.974 1.974 ! spec=nnoe, no=313, id=706
    or (segid "    " and resid   53 and name   HN) (segid "    " and resid   52 and name HG11)
assign (segid "    " and resid   41 and name   HN) (segid "    " and resid   48 and name   HN) 2.374 0.676 0.676 ! spec=nnoe, no=321, id=714
assign (segid "    " and resid   41 and name   HN) (segid "    " and resid   49 and name   HA) 2.796 0.938 0.938 ! spec=nnoe, no=322, id=715
assign (segid "    " and resid   41 and name   HN) (segid "    " and resid   31 and name   HB) 5.180 3.219 3.219 ! spec=nnoe, no=327, id=720
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid    7 and name   HA) 1.910 0.438 0.438 ! spec=nnoe, no=336, id=729
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid    8 and name  HA1) 2.339 0.657 0.657 ! spec=nnoe, no=338, id=731
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid    7 and name  HB2) 3.144 1.186 1.186 ! spec=nnoe, no=340, id=733
assign (segid "    " and resid   55 and name   HN) (segid "    " and resid    9 and name   HN) 5.822 4.067 4.067 ! spec=nnoe, no=342, id=735
assign (segid "    " and resid   55 and name   HN) (segid "    " and resid   55 and name   HA) 2.729 0.894 0.894 ! spec=nnoe, no=343, id=736
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   20 and name   HN) 3.404 1.390 1.390 ! spec=nnoe, no=359, id=752
assign (segid "    " and resid   46 and name   HN) (segid "    " and resid   45 and name   HN) 2.330 0.652 0.652 ! spec=nnoe, no=366, id=758
assign (segid "    " and resid   20 and name HD12) (segid "    " and resid   20 and name   HG) 2.030 0.494 0.494 ! spec=cnoe, no=2, id=2
    or (segid "    " and resid   20 and name HD11) (segid "    " and resid   20 and name   HG)
    or (segid "    " and resid   20 and name HD13) (segid "    " and resid   20 and name   HG)
assign (segid "    " and resid   20 and name HD12) (segid "    " and resid   20 and name   HA) 1.890 0.429 0.429 ! spec=cnoe, no=3, id=3
    or (segid "    " and resid   20 and name HD11) (segid "    " and resid   20 and name   HA)
    or (segid "    " and resid   20 and name HD13) (segid "    " and resid   20 and name   HA)
assign (segid "    " and resid    8 and name  HA1) (segid "    " and resid    8 and name  HA2) 1.585 0.302 0.302 ! spec=cnoe, no=5, id=5
assign (segid "    " and resid    8 and name  HA1) (segid "    " and resid   55 and name HG12) 2.051 0.505 0.505 ! spec=cnoe, no=6, id=6
    or (segid "    " and resid    8 and name  HA1) (segid "    " and resid   55 and name HG11)
    or (segid "    " and resid    8 and name  HA1) (segid "    " and resid   55 and name HG13)
assign (segid "    " and resid    8 and name  HA1) (segid "    " and resid    8 and name  HA2) 1.641 0.323 0.323 ! spec=cnoe, no=8, id=8
assign (segid "    " and resid    8 and name  HA2) (segid "    " and resid   55 and name HG12) 2.163 0.561 0.561 ! spec=cnoe, no=9, id=9
    or (segid "    " and resid    8 and name  HA2) (segid "    " and resid   55 and name HG11)
    or (segid "    " and resid    8 and name  HA2) (segid "    " and resid   55 and name HG13)
assign (segid "    " and resid   57 and name HG12) (segid "    " and resid   57 and name   HB) 1.774 0.378 0.378 ! spec=cnoe, no=14, id=14
    or (segid "    " and resid   57 and name HG11) (segid "    " and resid   57 and name   HB)
    or (segid "    " and resid   57 and name HG13) (segid "    " and resid   57 and name   HB)
assign (segid "    " and resid   41 and name  HA1) (segid "    " and resid   30 and name   HA) 2.266 0.616 0.616 ! spec=cnoe, no=17, id=17
assign (segid "    " and resid   41 and name  HA1) (segid "    " and resid   31 and name HG21) 2.268 0.617 0.617 ! spec=cnoe, no=19, id=19
    or (segid "    " and resid   41 and name  HA1) (segid "    " and resid   31 and name HG22)
    or (segid "    " and resid   41 and name  HA1) (segid "    " and resid   31 and name HG23)
assign (segid "    " and resid   41 and name  HA1) (segid "    " and resid   41 and name  HA2) 1.563 0.293 0.293 ! spec=cnoe, no=21, id=21
assign (segid "    " and resid   41 and name  HA2) (segid "    " and resid   30 and name   HA) 2.316 0.644 0.644 ! spec=cnoe, no=22, id=22
assign (segid "    " and resid    8 and name  HA1) (segid "    " and resid   55 and name HG12) 2.206 0.584 0.584 ! spec=cnoe, no=25, id=25
assign (segid "    " and resid   55 and name HG12) (segid "    " and resid   55 and name   HB) 1.910 0.438 0.438 ! spec=cnoe, no=27, id=27
    or (segid "    " and resid   55 and name HG11) (segid "    " and resid   55 and name   HB)
    or (segid "    " and resid   55 and name HG13) (segid "    " and resid   55 and name   HB)
assign (segid "    " and resid   55 and name HG12) (segid "    " and resid   55 and name HG22) 2.030 0.495 0.495 ! spec=cnoe, no=31, id=31
    or (segid "    " and resid   55 and name HG12) (segid "    " and resid   55 and name HG21)
    or (segid "    " and resid   55 and name HG12) (segid "    " and resid   55 and name HG23)
    or (segid "    " and resid   55 and name HG11) (segid "    " and resid   55 and name HG22)
    or (segid "    " and resid   55 and name HG11) (segid "    " and resid   55 and name HG21)
    or (segid "    " and resid   55 and name HG11) (segid "    " and resid   55 and name HG23)
    or (segid "    " and resid   55 and name HG13) (segid "    " and resid   55 and name HG22)
    or (segid "    " and resid   55 and name HG13) (segid "    " and resid   55 and name HG21)
    or (segid "    " and resid   55 and name HG13) (segid "    " and resid   55 and name HG23)
assign (segid "    " and resid   31 and name HG21) (segid "    " and resid   42 and name  HB1) 3.708 1.650 1.650 ! spec=cnoe, no=33, id=33
    or (segid "    " and resid   31 and name HG22) (segid "    " and resid   42 and name  HB1)
    or (segid "    " and resid   31 and name HG23) (segid "    " and resid   42 and name  HB1)
assign (segid "    " and resid   20 and name  HB2) (segid "    " and resid   19 and name  HB2) 4.024 1.943 1.943 ! spec=cnoe, no=41, id=41
assign (segid "    " and resid   20 and name  HB2) (segid "    " and resid   20 and name   HG) 3.171 1.207 1.207 ! spec=cnoe, no=42, id=42
assign (segid "    " and resid   20 and name  HB2) (segid "    " and resid   20 and name HD22) 2.039 0.499 0.499 ! spec=cnoe, no=44, id=44
    or (segid "    " and resid   20 and name  HB2) (segid "    " and resid   20 and name HD21)
    or (segid "    " and resid   20 and name  HB2) (segid "    " and resid   20 and name HD23)
assign (segid "    " and resid   45 and name  HA1) (segid "    " and resid   45 and name  HA2) 1.517 0.276 0.276 ! spec=cnoe, no=45, id=45
assign (segid "    " and resid   20 and name  HB2) (segid "    " and resid   20 and name   HA) 2.919 1.022 1.022 ! spec=cnoe, no=47, id=47
assign (segid "    " and resid   31 and name   HB) (segid "    " and resid   31 and name   HA) 1.824 0.399 0.399 ! spec=cnoe, no=48, id=48
assign (segid "    " and resid   31 and name HG21) (segid "    " and resid   31 and name   HB) 1.737 0.362 0.362 ! spec=cnoe, no=49, id=49
    or (segid "    " and resid   31 and name HG22) (segid "    " and resid   31 and name   HB)
    or (segid "    " and resid   31 and name HG23) (segid "    " and resid   31 and name   HB)
assign (segid "    " and resid   29 and name HG21) (segid "    " and resid   28 and name   HA) 2.607 0.816 0.816 ! spec=cnoe, no=53, id=53
    or (segid "    " and resid   29 and name HG22) (segid "    " and resid   28 and name   HA)
    or (segid "    " and resid   29 and name HG23) (segid "    " and resid   28 and name   HA)
assign (segid "    " and resid   21 and name  HA1) (segid "    " and resid   14 and name  HG1) 4.504 2.435 2.435 ! spec=cnoe, no=56, id=56
assign (segid "    " and resid   57 and name HG22) (segid "    " and resid   57 and name   HB) 1.746 0.366 0.366 ! spec=cnoe, no=58, id=58
    or (segid "    " and resid   57 and name HG21) (segid "    " and resid   57 and name   HB)
    or (segid "    " and resid   57 and name HG23) (segid "    " and resid   57 and name   HB)
assign (segid "    " and resid   21 and name  HA1) (segid "    " and resid   21 and name  HA2) 1.442 0.250 0.250 ! spec=cnoe, no=61, id=60
assign (segid "    " and resid   21 and name  HA1) (segid "    " and resid   14 and name  HG2) 2.709 0.881 0.881 ! spec=cnoe, no=62, id=61
assign (segid "    " and resid   21 and name  HA1) (segid "    " and resid   21 and name  HA2) 1.531 0.281 0.281 ! spec=cnoe, no=63, id=62
assign (segid "    " and resid   21 and name  HA2) (segid "    " and resid   14 and name  HG2) 2.576 0.796 0.796 ! spec=cnoe, no=64, id=63
assign (segid "    " and resid   21 and name  HA2) (segid "    " and resid   14 and name  HG1) 4.215 2.132 2.132 ! spec=cnoe, no=65, id=64
assign (segid "    " and resid   30 and name  HB1) (segid "    " and resid   30 and name   HA) 2.372 0.675 0.675 ! spec=cnoe, no=66, id=65
assign (segid "    " and resid   30 and name  HB1) (segid "    " and resid   30 and name   HG) 2.019 0.489 0.489 ! spec=cnoe, no=67, id=66
assign (segid "    " and resid   30 and name  HB1) (segid "    " and resid   30 and name  HB2) 1.725 0.357 0.357 ! spec=cnoe, no=68, id=67
assign (segid "    " and resid   30 and name  HB2) (segid "    " and resid   30 and name   HA) 2.481 0.739 0.739 ! spec=cnoe, no=69, id=68
assign (segid "    " and resid   25 and name  HA1) (segid "    " and resid   25 and name  HA2) 1.352 0.219 0.219 ! spec=cnoe, no=73, id=72
assign (segid "    " and resid   25 and name  HA1) (segid "    " and resid   23 and name  HG2) 3.984 1.905 1.905 ! spec=cnoe, no=74, id=73
assign (segid "    " and resid   30 and name  HB1) (segid "    " and resid   30 and name HD12) 2.197 0.579 0.579 ! spec=cnoe, no=75, id=74
    or (segid "    " and resid   30 and name  HB1) (segid "    " and resid   30 and name HD11)
    or (segid "    " and resid   30 and name  HB1) (segid "    " and resid   30 and name HD13)
assign (segid "    " and resid   18 and name  HA1) (segid "    " and resid   18 and name  HA2) 1.516 0.276 0.276 ! spec=cnoe, no=76, id=75
assign (segid "    " and resid    9 and name  HB1) (segid "    " and resid    9 and name   HA) 2.258 0.612 0.612 ! spec=cnoe, no=78, id=77
assign (segid "    " and resid    9 and name  HB1) (segid "    " and resid    9 and name  HB2) 1.560 0.292 0.292 ! spec=cnoe, no=80, id=79
assign (segid "    " and resid    9 and name  HB1) (segid "    " and resid    9 and name  HB2) 1.669 0.334 0.334 ! spec=cnoe, no=82, id=81
assign (segid "    " and resid    7 and name  HD1) (segid "    " and resid    7 and name  HB2) 5.077 3.094 3.094 ! spec=cnoe, no=84, id=83
assign (segid "    " and resid   28 and name HG22) (segid "    " and resid   43 and name HG12) 3.749 1.687 1.687 ! spec=cnoe, no=85, id=84
    or (segid "    " and resid   28 and name HG22) (segid "    " and resid   43 and name HG11)
    or (segid "    " and resid   28 and name HG21) (segid "    " and resid   43 and name HG12)
    or (segid "    " and resid   28 and name HG21) (segid "    " and resid   43 and name HG11)
    or (segid "    " and resid   28 and name HG23) (segid "    " and resid   43 and name HG12)
    or (segid "    " and resid   28 and name HG23) (segid "    " and resid   43 and name HG11)
assign (segid "    " and resid   41 and name  HA2) (segid "    " and resid   28 and name HG22) 2.706 0.879 0.879 ! spec=cnoe, no=86, id=85
    or (segid "    " and resid   41 and name  HA2) (segid "    " and resid   28 and name HG21)
    or (segid "    " and resid   41 and name  HA2) (segid "    " and resid   28 and name HG23)
assign (segid "    " and resid   28 and name HG22) (segid "    " and resid   28 and name HG12) 2.096 0.527 0.527 ! spec=cnoe, no=88, id=87
    or (segid "    " and resid   28 and name HG22) (segid "    " and resid   28 and name HG11)
    or (segid "    " and resid   28 and name HG21) (segid "    " and resid   28 and name HG12)
    or (segid "    " and resid   28 and name HG21) (segid "    " and resid   28 and name HG11)
    or (segid "    " and resid   28 and name HG23) (segid "    " and resid   28 and name HG12)
    or (segid "    " and resid   28 and name HG23) (segid "    " and resid   28 and name HG11)
assign (segid "    " and resid   28 and name HG22) (segid "    " and resid   20 and name HD22) 2.062 0.510 0.510 ! spec=cnoe, no=89, id=88
    or (segid "    " and resid   28 and name HG22) (segid "    " and resid   20 and name HD21)
    or (segid "    " and resid   28 and name HG22) (segid "    " and resid   20 and name HD23)
    or (segid "    " and resid   28 and name HG21) (segid "    " and resid   20 and name HD22)
    or (segid "    " and resid   28 and name HG21) (segid "    " and resid   20 and name HD21)
    or (segid "    " and resid   28 and name HG21) (segid "    " and resid   20 and name HD23)
    or (segid "    " and resid   28 and name HG23) (segid "    " and resid   20 and name HD22)
    or (segid "    " and resid   28 and name HG23) (segid "    " and resid   20 and name HD21)
    or (segid "    " and resid   28 and name HG23) (segid "    " and resid   20 and name HD23)
assign (segid "    " and resid   28 and name HG22) (segid "    " and resid   43 and name   HB) 3.104 1.156 1.156 ! spec=cnoe, no=91, id=90
    or (segid "    " and resid   28 and name HG21) (segid "    " and resid   43 and name   HB)
    or (segid "    " and resid   28 and name HG23) (segid "    " and resid   43 and name   HB)
assign (segid "    " and resid   39 and name  HB1) (segid "    " and resid   39 and name  HB2) 1.636 0.321 0.321 ! spec=cnoe, no=95, id=94
assign (segid "    " and resid   10 and name  HB1) (segid "    " and resid   10 and name   HA) 1.988 0.474 0.474 ! spec=cnoe, no=99, id=98
assign (segid "    " and resid   10 and name  HB1) (segid "    " and resid   10 and name  HB2) 1.549 0.288 0.288 ! spec=cnoe, no=100, id=99
assign (segid "    " and resid   10 and name  HB2) (segid "    " and resid   10 and name   HA) 2.241 0.603 0.603 ! spec=cnoe, no=101, id=100
assign (segid "    " and resid   37 and name  HB2) (segid "    " and resid   37 and name   HA) 2.058 0.508 0.508 ! spec=cnoe, no=105, id=104
assign (segid "    " and resid   47 and name  HB2) (segid "    " and resid   42 and name  HB1) 3.385 1.375 1.375 ! spec=cnoe, no=107, id=106
assign (segid "    " and resid   23 and name  HE2) (segid "    " and resid   23 and name  HG2) 2.720 0.888 0.888 ! spec=cnoe, no=108, id=107
assign (segid "    " and resid   32 and name  HB1) (segid "    " and resid   40 and name  HB2) 3.343 1.341 1.341 ! spec=cnoe, no=111, id=110
assign (segid "    " and resid   32 and name  HB1) (segid "    " and resid   41 and name  HA1) 1.992 0.476 0.476 ! spec=cnoe, no=112, id=111
assign (segid "    " and resid   32 and name  HB1) (segid "    " and resid   33 and name  HG2) 2.756 0.911 0.911 ! spec=cnoe, no=114, id=113
assign (segid "    " and resid   32 and name  HB2) (segid "    " and resid   40 and name  HB2) 2.574 0.795 0.795 ! spec=cnoe, no=117, id=116
assign (segid "    " and resid   32 and name  HB1) (segid "    " and resid   32 and name  HB2) 1.657 0.329 0.329 ! spec=cnoe, no=118, id=117
assign (segid "    " and resid   57 and name   HA) (segid "    " and resid    6 and name  HB1) 1.829 0.401 0.401 ! spec=cnoe, no=121, id=120
assign (segid "    " and resid   57 and name   HA) (segid "    " and resid   57 and name   HB) 2.667 0.854 0.854 ! spec=cnoe, no=123, id=122
assign (segid "    " and resid   55 and name HG22) (segid "    " and resid   52 and name   HA) 2.304 0.637 0.637 ! spec=cnoe, no=126, id=125
    or (segid "    " and resid   55 and name HG21) (segid "    " and resid   52 and name   HA)
    or (segid "    " and resid   55 and name HG23) (segid "    " and resid   52 and name   HA)
assign (segid "    " and resid   55 and name HG22) (segid "    " and resid   55 and name   HB) 1.980 0.470 0.470 ! spec=cnoe, no=128, id=127
    or (segid "    " and resid   55 and name HG21) (segid "    " and resid   55 and name   HB)
    or (segid "    " and resid   55 and name HG23) (segid "    " and resid   55 and name   HB)
assign (segid "    " and resid   55 and name HG12) (segid "    " and resid   55 and name HG22) 1.875 0.422 0.422 ! spec=cnoe, no=130, id=129
assign (segid "    " and resid   26 and name  HB1) (segid "    " and resid   26 and name  HB2) 1.638 0.322 0.322 ! spec=cnoe, no=132, id=131
assign (segid "    " and resid   58 and name HG22) (segid "    " and resid   58 and name   HB) 1.815 0.395 0.395 ! spec=cnoe, no=137, id=136
    or (segid "    " and resid   58 and name HG21) (segid "    " and resid   58 and name   HB)
    or (segid "    " and resid   58 and name HG23) (segid "    " and resid   58 and name   HB)
assign (segid "    " and resid   34 and name HG22) (segid "    " and resid   35 and name  HB2) 2.662 0.850 0.850 ! spec=cnoe, no=140, id=139
    or (segid "    " and resid   34 and name HG21) (segid "    " and resid   35 and name  HB2)
    or (segid "    " and resid   34 and name HG23) (segid "    " and resid   35 and name  HB2)
assign (segid "    " and resid   34 and name HG22) (segid "    " and resid   34 and name   HB) 1.954 0.458 0.458 ! spec=cnoe, no=142, id=141
    or (segid "    " and resid   34 and name HG21) (segid "    " and resid   34 and name   HB)
    or (segid "    " and resid   34 and name HG23) (segid "    " and resid   34 and name   HB)
assign (segid "    " and resid   12 and name  HB1) (segid "    " and resid   12 and name   HA) 2.177 0.568 0.568 ! spec=cnoe, no=143, id=142
assign (segid "    " and resid   12 and name  HB1) (segid "    " and resid   12 and name  HB2) 1.689 0.342 0.342 ! spec=cnoe, no=144, id=143
assign (segid "    " and resid   12 and name  HB2) (segid "    " and resid   12 and name   HA) 2.394 0.688 0.688 ! spec=cnoe, no=145, id=144
assign (segid "    " and resid   12 and name  HB1) (segid "    " and resid   12 and name  HB2) 1.719 0.354 0.354 ! spec=cnoe, no=146, id=145
assign (segid "    " and resid   27 and name HG22) (segid "    " and resid   27 and name   HA) 2.003 0.481 0.481 ! spec=cnoe, no=148, id=147
    or (segid "    " and resid   27 and name HG21) (segid "    " and resid   27 and name   HA)
    or (segid "    " and resid   27 and name HG23) (segid "    " and resid   27 and name   HA)
assign (segid "    " and resid   27 and name HG22) (segid "    " and resid   27 and name   HB) 1.761 0.372 0.372 ! spec=cnoe, no=149, id=148
    or (segid "    " and resid   27 and name HG21) (segid "    " and resid   27 and name   HB)
    or (segid "    " and resid   27 and name HG23) (segid "    " and resid   27 and name   HB)
assign (segid "    " and resid   11 and name  HB2) (segid "    " and resid   23 and name   HA) 2.168 0.564 0.564 ! spec=cnoe, no=150, id=149
assign (segid "    " and resid   43 and name   HB) (segid "    " and resid   43 and name HG12) 2.318 0.645 0.645 ! spec=cnoe, no=157, id=156
    or (segid "    " and resid   43 and name   HB) (segid "    " and resid   43 and name HG11)
assign (segid "    " and resid   43 and name   HB) (segid "    " and resid   43 and name   HA) 1.974 0.467 0.467 ! spec=cnoe, no=158, id=157
assign (segid "    " and resid   52 and name HG22) (segid "    " and resid   52 and name   HB) 1.804 0.391 0.391 ! spec=cnoe, no=162, id=161
    or (segid "    " and resid   52 and name HG21) (segid "    " and resid   52 and name   HB)
    or (segid "    " and resid   52 and name HG23) (segid "    " and resid   52 and name   HB)
assign (segid "    " and resid   54 and name  HB2) (segid "    " and resid   54 and name   HA) 2.694 0.871 0.871 ! spec=cnoe, no=165, id=164
assign (segid "    " and resid   34 and name HG22) (segid "    " and resid   35 and name  HB2) 2.319 0.645 0.645 ! spec=cnoe, no=166, id=165
assign (segid "    " and resid   29 and name HG21) (segid "    " and resid   29 and name   HA) 1.918 0.441 0.441 ! spec=cnoe, no=169, id=168
    or (segid "    " and resid   29 and name HG22) (segid "    " and resid   29 and name   HA)
    or (segid "    " and resid   29 and name HG23) (segid "    " and resid   29 and name   HA)
assign (segid "    " and resid   43 and name   HB) (segid "    " and resid   43 and name HD12) 1.946 0.455 0.455 ! spec=cnoe, no=170, id=169
    or (segid "    " and resid   43 and name   HB) (segid "    " and resid   43 and name HD11)
    or (segid "    " and resid   43 and name   HB) (segid "    " and resid   43 and name HD13)
assign (segid "    " and resid   43 and name HD12) (segid "    " and resid   43 and name   HA) 2.700 0.875 0.875 ! spec=cnoe, no=171, id=170
    or (segid "    " and resid   43 and name HD11) (segid "    " and resid   43 and name   HA)
    or (segid "    " and resid   43 and name HD13) (segid "    " and resid   43 and name   HA)
assign (segid "    " and resid   43 and name HD12) (segid "    " and resid   43 and name HG12) 1.932 0.448 0.448 ! spec=cnoe, no=174, id=173
    or (segid "    " and resid   43 and name HD12) (segid "    " and resid   43 and name HG11)
    or (segid "    " and resid   43 and name HD11) (segid "    " and resid   43 and name HG12)
    or (segid "    " and resid   43 and name HD11) (segid "    " and resid   43 and name HG11)
    or (segid "    " and resid   43 and name HD13) (segid "    " and resid   43 and name HG12)
    or (segid "    " and resid   43 and name HD13) (segid "    " and resid   43 and name HG11)
assign (segid "    " and resid   52 and name   HA) (segid "    " and resid   52 and name   HB) 2.536 0.772 0.772 ! spec=cnoe, no=175, id=174
assign (segid "    " and resid   14 and name   HA) (segid "    " and resid   12 and name  HB1) 3.205 1.232 1.232 ! spec=cnoe, no=176, id=175
assign (segid "    " and resid   14 and name   HA) (segid "    " and resid   19 and name  HB2) 2.954 1.047 1.047 ! spec=cnoe, no=177, id=176
assign (segid "    " and resid   14 and name   HA) (segid "    " and resid   14 and name  HG2) 4.215 2.132 2.132 ! spec=cnoe, no=178, id=177
assign (segid "    " and resid   34 and name HG22) (segid "    " and resid   34 and name   HA) 2.046 0.502 0.502 ! spec=cnoe, no=179, id=178
    or (segid "    " and resid   34 and name HG21) (segid "    " and resid   34 and name   HA)
    or (segid "    " and resid   34 and name HG23) (segid "    " and resid   34 and name   HA)
assign (segid "    " and resid   34 and name   HA) (segid "    " and resid   34 and name HD12) 2.380 0.680 0.680 ! spec=cnoe, no=180, id=179
    or (segid "    " and resid   34 and name   HA) (segid "    " and resid   34 and name HD11)
    or (segid "    " and resid   34 and name   HA) (segid "    " and resid   34 and name HD13)
assign (segid "    " and resid   34 and name   HA) (segid "    " and resid   33 and name  HG1) 3.068 1.130 1.130 ! spec=cnoe, no=181, id=180
assign (segid "    " and resid   14 and name   HA) (segid "    " and resid   14 and name  HB2) 2.210 0.586 0.586 ! spec=cnoe, no=185, id=184
assign (segid "    " and resid   58 and name HG22) (segid "    " and resid   58 and name   HB) 1.847 0.409 0.409 ! spec=cnoe, no=187, id=186
assign (segid "    " and resid   34 and name   HB) (segid "    " and resid   34 and name HD12) 2.738 0.900 0.900 ! spec=cnoe, no=189, id=188
    or (segid "    " and resid   34 and name   HB) (segid "    " and resid   34 and name HD11)
    or (segid "    " and resid   34 and name   HB) (segid "    " and resid   34 and name HD13)
assign (segid "    " and resid   28 and name HD12) (segid "    " and resid   28 and name HG12) 1.930 0.447 0.447 ! spec=cnoe, no=195, id=194
    or (segid "    " and resid   28 and name HD12) (segid "    " and resid   28 and name HG11)
    or (segid "    " and resid   28 and name HD11) (segid "    " and resid   28 and name HG12)
    or (segid "    " and resid   28 and name HD11) (segid "    " and resid   28 and name HG11)
    or (segid "    " and resid   28 and name HD13) (segid "    " and resid   28 and name HG12)
    or (segid "    " and resid   28 and name HD13) (segid "    " and resid   28 and name HG11)
assign (segid "    " and resid   28 and name HD12) (segid "    " and resid   20 and name HD22) 1.884 0.426 0.426 ! spec=cnoe, no=196, id=195
    or (segid "    " and resid   28 and name HD12) (segid "    " and resid   20 and name HD21)
    or (segid "    " and resid   28 and name HD12) (segid "    " and resid   20 and name HD23)
    or (segid "    " and resid   28 and name HD11) (segid "    " and resid   20 and name HD22)
    or (segid "    " and resid   28 and name HD11) (segid "    " and resid   20 and name HD21)
    or (segid "    " and resid   28 and name HD11) (segid "    " and resid   20 and name HD23)
    or (segid "    " and resid   28 and name HD13) (segid "    " and resid   20 and name HD22)
    or (segid "    " and resid   28 and name HD13) (segid "    " and resid   20 and name HD21)
    or (segid "    " and resid   28 and name HD13) (segid "    " and resid   20 and name HD23)
assign (segid "    " and resid   28 and name HG22) (segid "    " and resid   28 and name HD12) 2.110 0.534 0.534 ! spec=cnoe, no=197, id=196
    or (segid "    " and resid   28 and name HG22) (segid "    " and resid   28 and name HD11)
    or (segid "    " and resid   28 and name HG22) (segid "    " and resid   28 and name HD13)
    or (segid "    " and resid   28 and name HG21) (segid "    " and resid   28 and name HD12)
    or (segid "    " and resid   28 and name HG21) (segid "    " and resid   28 and name HD11)
    or (segid "    " and resid   28 and name HG21) (segid "    " and resid   28 and name HD13)
    or (segid "    " and resid   28 and name HG23) (segid "    " and resid   28 and name HD12)
    or (segid "    " and resid   28 and name HG23) (segid "    " and resid   28 and name HD11)
    or (segid "    " and resid   28 and name HG23) (segid "    " and resid   28 and name HD13)
assign (segid "    " and resid   52 and name HD12) (segid "    " and resid   37 and name   HA) 2.528 0.767 0.767 ! spec=cnoe, no=201, id=200
    or (segid "    " and resid   52 and name HD11) (segid "    " and resid   37 and name   HA)
    or (segid "    " and resid   52 and name HD13) (segid "    " and resid   37 and name   HA)
assign (segid "    " and resid   52 and name   HB) (segid "    " and resid   52 and name HD12) 2.050 0.504 0.504 ! spec=cnoe, no=203, id=202
    or (segid "    " and resid   52 and name   HB) (segid "    " and resid   52 and name HD11)
    or (segid "    " and resid   52 and name   HB) (segid "    " and resid   52 and name HD13)
assign (segid "    " and resid   43 and name   HB) (segid "    " and resid   43 and name   HA) 1.865 0.418 0.418 ! spec=cnoe, no=206, id=205
assign (segid "    " and resid   43 and name   HA) (segid "    " and resid   43 and name HG12) 2.051 0.505 0.505 ! spec=cnoe, no=209, id=208
    or (segid "    " and resid   43 and name   HA) (segid "    " and resid   43 and name HG11)
assign (segid "    " and resid   42 and name  HB1) (segid "    " and resid   42 and name  HB2) 1.670 0.335 0.335 ! spec=cnoe, no=210, id=209
assign (segid "    " and resid   42 and name  HB1) (segid "    " and resid   42 and name  HB2) 1.538 0.284 0.284 ! spec=cnoe, no=211, id=210
assign (segid "    " and resid   53 and name  HB1) (segid "    " and resid   53 and name  HB2) 1.531 0.281 0.281 ! spec=cnoe, no=214, id=213
assign (segid "    " and resid   55 and name   HB) (segid "    " and resid    6 and name  HB1) 3.027 1.100 1.100 ! spec=cnoe, no=216, id=215
assign (segid "    " and resid   55 and name HG22) (segid "    " and resid   55 and name   HB) 1.906 0.436 0.436 ! spec=cnoe, no=218, id=217
assign (segid "    " and resid   55 and name HG12) (segid "    " and resid   55 and name   HB) 1.970 0.466 0.466 ! spec=cnoe, no=219, id=218
assign (segid "    " and resid   27 and name   HB) (segid "    " and resid   27 and name   HA) 3.335 1.335 1.335 ! spec=cnoe, no=220, id=219
assign (segid "    " and resid   27 and name HG22) (segid "    " and resid   27 and name   HB) 1.736 0.361 0.361 ! spec=cnoe, no=222, id=221
assign (segid "    " and resid   27 and name   HB) (segid "    " and resid   27 and name   HA) 2.898 1.008 1.008 ! spec=cnoe, no=223, id=222
assign (segid "    " and resid   34 and name   HB) (segid "    " and resid   34 and name HD12) 2.918 1.022 1.022 ! spec=cnoe, no=225, id=224
assign (segid "    " and resid   24 and name  HG2) (segid "    " and resid   23 and name  HB2) 1.879 0.424 0.424 ! spec=cnoe, no=227, id=226
assign (segid "    " and resid   23 and name  HB2) (segid "    " and resid   23 and name  HD2) 2.357 0.667 0.667 ! spec=cnoe, no=228, id=227
assign (segid "    " and resid    8 and name  HA1) (segid "    " and resid   55 and name   HA) 2.420 0.703 0.703 ! spec=cnoe, no=229, id=228
assign (segid "    " and resid   55 and name   HB) (segid "    " and resid   55 and name   HA) 1.910 0.438 0.438 ! spec=cnoe, no=230, id=229
assign (segid "    " and resid   55 and name HG12) (segid "    " and resid   55 and name   HA) 1.871 0.420 0.420 ! spec=cnoe, no=231, id=230
    or (segid "    " and resid   55 and name HG11) (segid "    " and resid   55 and name   HA)
    or (segid "    " and resid   55 and name HG13) (segid "    " and resid   55 and name   HA)
assign (segid "    " and resid   55 and name   HA) (segid "    " and resid    9 and name HD22) 1.988 0.474 0.474 ! spec=cnoe, no=232, id=231
    or (segid "    " and resid   55 and name   HA) (segid "    " and resid    9 and name HD21)
    or (segid "    " and resid   55 and name   HA) (segid "    " and resid    9 and name HD23)
assign (segid "    " and resid   27 and name   HB) (segid "    " and resid   27 and name   HA) 2.707 0.879 0.879 ! spec=cnoe, no=235, id=234
assign (segid "    " and resid   27 and name HG22) (segid "    " and resid   27 and name   HA) 1.724 0.356 0.356 ! spec=cnoe, no=236, id=235
assign (segid "    " and resid   54 and name  HB2) (segid "    " and resid   54 and name   HA) 2.249 0.607 0.607 ! spec=cnoe, no=239, id=238
assign (segid "    " and resid   24 and name  HG2) (segid "    " and resid   24 and name   HA) 2.314 0.643 0.643 ! spec=cnoe, no=246, id=245
assign (segid "    " and resid   17 and name  HG2) (segid "    " and resid   17 and name   HA) 2.492 0.745 0.745 ! spec=cnoe, no=250, id=249
assign (segid "    " and resid   57 and name   HA) (segid "    " and resid    6 and name  HB1) 2.071 0.515 0.515 ! spec=cnoe, no=253, id=252
assign (segid "    " and resid   55 and name   HB) (segid "    " and resid    6 and name  HB1) 2.742 0.902 0.902 ! spec=cnoe, no=255, id=254
assign (segid "    " and resid    6 and name  HB1) (segid "    " and resid   57 and name HG22) 2.660 0.849 0.849 ! spec=cnoe, no=257, id=256
    or (segid "    " and resid    6 and name  HB1) (segid "    " and resid   57 and name HG21)
    or (segid "    " and resid    6 and name  HB1) (segid "    " and resid   57 and name HG23)
assign (segid "    " and resid   57 and name   HA) (segid "    " and resid    6 and name  HB2) 2.075 0.517 0.517 ! spec=cnoe, no=261, id=260
assign (segid "    " and resid    6 and name  HB1) (segid "    " and resid    6 and name  HB2) 1.647 0.326 0.326 ! spec=cnoe, no=262, id=261
assign (segid "    " and resid   55 and name   HB) (segid "    " and resid    6 and name  HB2) 2.232 0.598 0.598 ! spec=cnoe, no=263, id=262
assign (segid "    " and resid   33 and name  HG2) (segid "    " and resid   40 and name   HA) 2.837 0.966 0.966 ! spec=cnoe, no=266, id=265
assign (segid "    " and resid   14 and name  HB2) (segid "    " and resid   14 and name  HG2) 2.373 0.676 0.676 ! spec=cnoe, no=269, id=268
assign (segid "    " and resid   33 and name  HG2) (segid "    " and resid   33 and name  HG1) 1.559 0.292 0.292 ! spec=cnoe, no=271, id=270
assign (segid "    " and resid   38 and name  HB2) (segid "    " and resid   34 and name   HB) 2.417 0.701 0.701 ! spec=cnoe, no=276, id=275
assign (segid "    " and resid   47 and name  HB2) (segid "    " and resid   47 and name   HA) 1.795 0.387 0.387 ! spec=cnoe, no=277, id=276
assign (segid "    " and resid   47 and name   HA) (segid "    " and resid   42 and name  HB1) 2.474 0.735 0.735 ! spec=cnoe, no=278, id=277
assign (segid "    " and resid   47 and name   HA) (segid "    " and resid   20 and name HD22) 4.199 2.115 2.115 ! spec=cnoe, no=279, id=278
    or (segid "    " and resid   47 and name   HA) (segid "    " and resid   20 and name HD21)
    or (segid "    " and resid   47 and name   HA) (segid "    " and resid   20 and name HD23)
assign (segid "    " and resid   38 and name  HB2) (segid "    " and resid   38 and name   HA) 2.394 0.688 0.688 ! spec=cnoe, no=280, id=279
assign (segid "    " and resid   20 and name HD12) (segid "    " and resid   47 and name   HA) 2.591 0.806 0.806 ! spec=cnoe, no=282, id=281
    or (segid "    " and resid   20 and name HD11) (segid "    " and resid   47 and name   HA)
    or (segid "    " and resid   20 and name HD13) (segid "    " and resid   47 and name   HA)
assign (segid "    " and resid   33 and name   HA) (segid "    " and resid   33 and name  HG2) 1.952 0.457 0.457 ! spec=cnoe, no=283, id=282
assign (segid "    " and resid   12 and name  HB1) (segid "    " and resid   12 and name   HA) 1.831 0.402 0.402 ! spec=cnoe, no=285, id=284
assign (segid "    " and resid   12 and name  HB2) (segid "    " and resid   12 and name   HA) 2.390 0.685 0.685 ! spec=cnoe, no=286, id=285
assign (segid "    " and resid    9 and name   HA) (segid "    " and resid    8 and name  HA1) 3.022 1.096 1.096 ! spec=cnoe, no=287, id=286
assign (segid "    " and resid    9 and name  HB1) (segid "    " and resid    9 and name   HA) 2.122 0.540 0.540 ! spec=cnoe, no=288, id=287
assign (segid "    " and resid    9 and name HD12) (segid "    " and resid    9 and name   HA) 1.622 0.316 0.316 ! spec=cnoe, no=289, id=288
    or (segid "    " and resid    9 and name HD11) (segid "    " and resid    9 and name   HA)
    or (segid "    " and resid    9 and name HD13) (segid "    " and resid    9 and name   HA)
assign (segid "    " and resid   51 and name   HA) (segid "    " and resid   51 and name  HB2) 1.770 0.376 0.376 ! spec=cnoe, no=291, id=290
assign (segid "    " and resid   57 and name   HA) (segid "    " and resid    6 and name   HA) 2.082 0.520 0.520 ! spec=cnoe, no=293, id=292
assign (segid "    " and resid    6 and name  HB1) (segid "    " and resid    6 and name   HA) 1.948 0.455 0.455 ! spec=cnoe, no=294, id=293
assign (segid "    " and resid   11 and name  HB2) (segid "    " and resid   11 and name   HA) 1.839 0.406 0.406 ! spec=cnoe, no=299, id=298
assign (segid "    " and resid   33 and name   HA) (segid "    " and resid   39 and name   HA) 1.989 0.475 0.475 ! spec=cnoe, no=301, id=300
assign (segid "    " and resid   39 and name  HB2) (segid "    " and resid   39 and name   HA) 2.948 1.043 1.043 ! spec=cnoe, no=302, id=301
assign (segid "    " and resid   11 and name   HA) (segid "    " and resid   23 and name   HA) 1.684 0.340 0.340 ! spec=cnoe, no=303, id=302
assign (segid "    " and resid   46 and name   HA) (segid "    " and resid   42 and name  HB1) 2.677 0.860 0.860 ! spec=cnoe, no=306, id=305
assign (segid "    " and resid   42 and name   HA) (segid "    " and resid   47 and name  HB2) 3.568 1.528 1.528 ! spec=cnoe, no=307, id=306
assign (segid "    " and resid   42 and name   HA) (segid "    " and resid   20 and name HD12) 2.525 0.765 0.765 ! spec=cnoe, no=308, id=307
    or (segid "    " and resid   42 and name   HA) (segid "    " and resid   20 and name HD11)
    or (segid "    " and resid   42 and name   HA) (segid "    " and resid   20 and name HD13)
assign (segid "    " and resid   49 and name  HB2) (segid "    " and resid   49 and name   HA) 2.099 0.529 0.529 ! spec=cnoe, no=310, id=309
assign (segid "    " and resid   42 and name   HA) (segid "    " and resid   42 and name  HB1) 2.461 0.727 0.727 ! spec=cnoe, no=311, id=310
assign (segid "    " and resid   42 and name   HA) (segid "    " and resid   20 and name HD22) 2.450 0.720 0.720 ! spec=cnoe, no=312, id=311
    or (segid "    " and resid   42 and name   HA) (segid "    " and resid   20 and name HD21)
    or (segid "    " and resid   42 and name   HA) (segid "    " and resid   20 and name HD23)
assign (segid "    " and resid   30 and name   HA) (segid "    " and resid   30 and name   HG) 2.676 0.859 0.859 ! spec=cnoe, no=315, id=314
assign (segid "    " and resid   30 and name  HB2) (segid "    " and resid   30 and name   HA) 2.219 0.591 0.591 ! spec=cnoe, no=316, id=315
assign (segid "    " and resid   37 and name   HA) (segid "    " and resid   52 and name   HB) 3.489 1.461 1.461 ! spec=cnoe, no=319, id=318
assign (segid "    " and resid   10 and name  HB2) (segid "    " and resid   10 and name   HA) 2.458 0.725 0.725 ! spec=cnoe, no=321, id=320
assign (segid "    " and resid   20 and name   HA) (segid "    " and resid   20 and name   HG) 3.036 1.106 1.106 ! spec=cnoe, no=324, id=323
assign (segid "    " and resid   20 and name HD12) (segid "    " and resid   20 and name   HA) 1.713 0.352 0.352 ! spec=cnoe, no=325, id=324
assign (segid "    " and resid   35 and name  HB2) (segid "    " and resid   35 and name   HA) 1.624 0.316 0.316 ! spec=cnoe, no=327, id=326
assign (segid "    " and resid   11 and name  HB2) (segid "    " and resid   23 and name   HA) 3.410 1.396 1.396 ! spec=cnoe, no=331, id=330
assign (segid "    " and resid   23 and name   HA) (segid "    " and resid   23 and name  HD2) 2.236 0.600 0.600 ! spec=cnoe, no=333, id=332
assign (segid "    " and resid   23 and name   HA) (segid "    " and resid   23 and name  HG2) 2.414 0.699 0.699 ! spec=cnoe, no=334, id=333
assign (segid "    " and resid   28 and name HG22) (segid "    " and resid   28 and name HG12) 2.564 0.789 0.789 ! spec=cnoe, no=335, id=334
assign (segid "    " and resid    7 and name  HB2) (segid "    " and resid    7 and name   HA) 2.536 0.772 0.772 ! spec=cnoe, no=336, id=335
assign (segid "    " and resid   27 and name   HA) (segid "    " and resid    7 and name   HA) 2.000 0.480 0.480 ! spec=cnoe, no=339, id=338
assign (segid "    " and resid   43 and name   HB) (segid "    " and resid   43 and name HG12) 2.519 0.762 0.762 ! spec=cnoe, no=342, id=341
assign (segid "    " and resid   43 and name   HA) (segid "    " and resid   43 and name HG12) 2.253 0.609 0.609 ! spec=cnoe, no=345, id=344
assign (segid "    " and resid   43 and name HG12) (segid "    " and resid   43 and name HG11) 1.696 0.345 0.345 ! spec=cnoe, no=348, id=347
assign (segid "    " and resid   43 and name HD12) (segid "    " and resid   43 and name HG12) 2.605 0.814 0.814 ! spec=cnoe, no=350, id=349
assign (segid "    " and resid   23 and name  HD2) (segid "    " and resid   23 and name  HE2) 2.579 0.798 0.798 ! spec=cnoe, no=351, id=350
assign (segid "    " and resid    4 and name  HG2) (segid "    " and resid    4 and name  HG1) 1.436 0.248 0.248 ! spec=cnoe, no=356, id=355
assign (segid "    " and resid    4 and name  HG2) (segid "    " and resid    4 and name  HG1) 1.532 0.282 0.282 ! spec=cnoe, no=357, id=356
assign (segid "    " and resid   52 and name   HA) (segid "    " and resid   52 and name HG12) 2.630 0.830 0.830 ! spec=cnoe, no=359, id=358
    or (segid "    " and resid   52 and name   HA) (segid "    " and resid   52 and name HG11)
assign (segid "    " and resid   52 and name   HB) (segid "    " and resid   52 and name HG12) 2.646 0.840 0.840 ! spec=cnoe, no=360, id=359
    or (segid "    " and resid   52 and name   HB) (segid "    " and resid   52 and name HG11)
assign (segid "    " and resid   30 and name   HA) (segid "    " and resid   30 and name   HG) 4.510 2.441 2.441 ! spec=cnoe, no=363, id=362
assign (segid "    " and resid   30 and name   HG) (segid "    " and resid   30 and name HD12) 2.099 0.529 0.529 ! spec=cnoe, no=364, id=363
    or (segid "    " and resid   30 and name   HG) (segid "    " and resid   30 and name HD11)
    or (segid "    " and resid   30 and name   HG) (segid "    " and resid   30 and name HD13)
assign (segid "    " and resid   16 and name  HB2) (segid "    " and resid   16 and name   HA) 2.089 0.524 0.524 ! spec=cnoe, no=365, id=364
assign (segid "    " and resid   14 and name  HG1) (segid "    " and resid   14 and name  HD2) 1.969 0.465 0.465 ! spec=cnoe, no=368, id=367
assign (segid "    " and resid   14 and name  HG1) (segid "    " and resid   14 and name  HG2) 1.481 0.263 0.263 ! spec=cnoe, no=371, id=370
assign (segid "    " and resid   14 and name  HG2) (segid "    " and resid   14 and name  HD2) 1.997 0.479 0.479 ! spec=cnoe, no=372, id=371
assign (segid "    " and resid   30 and name  HB2) (segid "    " and resid   30 and name   HG) 2.006 0.483 0.483 ! spec=cnoe, no=373, id=372
assign (segid "    " and resid    4 and name  HG1) (segid "    " and resid    4 and name  HD2) 1.712 0.352 0.352 ! spec=cnoe, no=374, id=373
assign (segid "    " and resid    4 and name  HG1) (segid "    " and resid    4 and name  HD2) 1.925 0.445 0.445 ! spec=cnoe, no=375, id=374
assign (segid "    " and resid    9 and name  HB1) (segid "    " and resid    9 and name HD22) 2.083 0.521 0.521 ! spec=cnoe, no=379, id=378
    or (segid "    " and resid    9 and name  HB1) (segid "    " and resid    9 and name HD21)
    or (segid "    " and resid    9 and name  HB1) (segid "    " and resid    9 and name HD23)
assign (segid "    " and resid    4 and name  HG2) (segid "    " and resid    4 and name  HD2) 2.316 0.643 0.643 ! spec=cnoe, no=380, id=379
assign (segid "    " and resid   21 and name  HA1) (segid "    " and resid   14 and name  HD2) 2.080 0.519 0.519 ! spec=cnoe, no=384, id=383
assign (segid "    " and resid   20 and name HD12) (segid "    " and resid   20 and name   HG) 1.858 0.414 0.414 ! spec=cnoe, no=388, id=387
assign (segid "    " and resid   28 and name HG22) (segid "    " and resid   20 and name HD22) 2.154 0.557 0.557 ! spec=cnoe, no=393, id=391
assign (segid "    " and resid    9 and name  HB1) (segid "    " and resid    9 and name   HG) 2.278 0.623 0.623 ! spec=cnoe, no=397, id=395
assign (segid "    " and resid   30 and name  HB2) (segid "    " and resid   30 and name HD12) 2.243 0.604 0.604 ! spec=cnoe, no=399, id=397
    or (segid "    " and resid   30 and name  HB2) (segid "    " and resid   30 and name HD11)
    or (segid "    " and resid   30 and name  HB2) (segid "    " and resid   30 and name HD13)
assign (segid "    " and resid   30 and name   HA) (segid "    " and resid   30 and name HD12) 3.142 1.184 1.184 ! spec=cnoe, no=400, id=398
    or (segid "    " and resid   30 and name   HA) (segid "    " and resid   30 and name HD11)
    or (segid "    " and resid   30 and name   HA) (segid "    " and resid   30 and name HD13)
assign (segid "    " and resid    6 and name  HB1) (segid "    " and resid   30 and name HD12) 2.778 0.926 0.926 ! spec=cnoe, no=401, id=399
    or (segid "    " and resid    6 and name  HB1) (segid "    " and resid   30 and name HD11)
    or (segid "    " and resid    6 and name  HB1) (segid "    " and resid   30 and name HD13)
assign (segid "    " and resid   30 and name   HG) (segid "    " and resid   30 and name HD12) 2.365 0.671 0.671 ! spec=cnoe, no=402, id=400
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   27 and name   HN) 4.233 2.150 2.150 ! spec=nnoe, no=2, id=403
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   27 and name   HA) 1.919 0.442 0.442 ! spec=nnoe, no=3, id=404
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   27 and name HG22) 2.102 0.530 0.530 ! spec=nnoe, no=4, id=405
    or (segid "    " and resid   28 and name   HN) (segid "    " and resid   27 and name HG21)
    or (segid "    " and resid   28 and name   HN) (segid "    " and resid   27 and name HG23)
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   27 and name   HB) 3.657 1.605 1.605 ! spec=nnoe, no=5, id=406
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   28 and name HG22) 3.111 1.162 1.162 ! spec=nnoe, no=6, id=407
    or (segid "    " and resid   28 and name   HN) (segid "    " and resid   28 and name HG21)
    or (segid "    " and resid   28 and name   HN) (segid "    " and resid   28 and name HG23)
assign (segid "    " and resid    9 and name   HN) (segid "    " and resid    9 and name HD22) 2.358 0.667 0.667 ! spec=nnoe, no=10, id=411
    or (segid "    " and resid    9 and name   HN) (segid "    " and resid    9 and name HD21)
    or (segid "    " and resid    9 and name   HN) (segid "    " and resid    9 and name HD23)
assign (segid "    " and resid    9 and name   HN) (segid "    " and resid    9 and name  HB1) 2.311 0.641 0.641 ! spec=nnoe, no=11, id=412
assign (segid "    " and resid    9 and name   HN) (segid "    " and resid   55 and name   HB) 4.116 2.033 2.033 ! spec=nnoe, no=13, id=414
assign (segid "    " and resid   58 and name   HN) (segid "    " and resid    6 and name  HB1) 3.103 1.155 1.155 ! spec=nnoe, no=14, id=415
assign (segid "    " and resid   58 and name   HN) (segid "    " and resid   58 and name   HB) 2.260 0.613 0.613 ! spec=nnoe, no=18, id=419
assign (segid "    " and resid   58 and name   HN) (segid "    " and resid    6 and name  HB2) 2.988 1.071 1.071 ! spec=nnoe, no=19, id=420
assign (segid "    " and resid   57 and name   HN) (segid "    " and resid   56 and name   HN) 3.587 1.544 1.544 ! spec=nnoe, no=21, id=422
assign (segid "    " and resid   57 and name   HN) (segid "    " and resid    5 and name   HA) 4.339 2.259 2.259 ! spec=nnoe, no=22, id=423
assign (segid "    " and resid   57 and name   HN) (segid "    " and resid   56 and name   HA) 1.895 0.431 0.431 ! spec=nnoe, no=23, id=424
assign (segid "    " and resid   57 and name   HN) (segid "    " and resid   57 and name   HA) 2.659 0.848 0.848 ! spec=nnoe, no=24, id=425
assign (segid "    " and resid   57 and name   HN) (segid "    " and resid   57 and name   HB) 1.848 0.410 0.410 ! spec=nnoe, no=25, id=426
assign (segid "    " and resid   57 and name   HN) (segid "    " and resid   57 and name HG12) 2.112 0.535 0.535 ! spec=nnoe, no=26, id=427
    or (segid "    " and resid   57 and name   HN) (segid "    " and resid   57 and name HG11)
    or (segid "    " and resid   57 and name   HN) (segid "    " and resid   57 and name HG13)
assign (segid "    " and resid   13 and name   HN) (segid "    " and resid   12 and name   HN) 3.158 1.197 1.197 ! spec=nnoe, no=28, id=429
assign (segid "    " and resid   13 and name   HN) (segid "    " and resid   12 and name   HA) 1.808 0.392 0.392 ! spec=nnoe, no=29, id=430
assign (segid "    " and resid   13 and name   HN) (segid "    " and resid   12 and name  HB1) 2.803 0.943 0.943 ! spec=nnoe, no=31, id=432
assign (segid "    " and resid   13 and name   HN) (segid "    " and resid   12 and name  HB2) 3.080 1.138 1.138 ! spec=nnoe, no=32, id=433
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   29 and name   HN) 4.650 2.595 2.595 ! spec=nnoe, no=33, id=434
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   29 and name   HA) 1.910 0.438 0.438 ! spec=nnoe, no=35, id=436
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   30 and name  HB2) 2.402 0.693 0.693 ! spec=nnoe, no=38, id=439
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   49 and name   HN) 2.437 0.713 0.713 ! spec=nnoe, no=41, id=441
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   20 and name   HA) 2.653 0.845 0.845 ! spec=nnoe, no=42, id=442
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   20 and name  HB2) 2.051 0.505 0.505 ! spec=nnoe, no=43, id=443
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   33 and name   HA) 2.162 0.561 0.561 ! spec=nnoe, no=46, id=446
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   33 and name  HG1) 2.493 0.746 0.746 ! spec=nnoe, no=48, id=448
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   33 and name  HG2) 2.838 0.967 0.967 ! spec=nnoe, no=49, id=449
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   34 and name   HB) 2.202 0.582 0.582 ! spec=nnoe, no=50, id=450
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   34 and name HD12) 3.206 1.234 1.234 ! spec=nnoe, no=51, id=451
    or (segid "    " and resid   34 and name   HN) (segid "    " and resid   34 and name HD11)
    or (segid "    " and resid   34 and name   HN) (segid "    " and resid   34 and name HD13)
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   35 and name   HN) 2.228 0.596 0.596 ! spec=nnoe, no=52, id=452
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   34 and name HG22) 2.935 1.034 1.034 ! spec=nnoe, no=53, id=453
    or (segid "    " and resid   34 and name   HN) (segid "    " and resid   34 and name HG21)
    or (segid "    " and resid   34 and name   HN) (segid "    " and resid   34 and name HG23)
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   19 and name  HB2) 2.156 0.558 0.558 ! spec=nnoe, no=55, id=455
assign (segid "    " and resid   12 and name   HN) (segid "    " and resid   23 and name   HA) 2.498 0.749 0.749 ! spec=nnoe, no=56, id=456
assign (segid "    " and resid   12 and name   HN) (segid "    " and resid   12 and name  HB1) 2.423 0.705 0.705 ! spec=nnoe, no=57, id=457
assign (segid "    " and resid   12 and name   HN) (segid "    " and resid   12 and name  HB2) 2.286 0.627 0.627 ! spec=nnoe, no=58, id=458
assign (segid "    " and resid   12 and name   HN) (segid "    " and resid   11 and name   HA) 1.918 0.442 0.442 ! spec=nnoe, no=59, id=459
assign (segid "    " and resid   12 and name   HN) (segid "    " and resid   11 and name  HB2) 2.313 0.642 0.642 ! spec=nnoe, no=60, id=460
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   28 and name HG22) 2.243 0.604 0.604 ! spec=nnoe, no=61, id=461
    or (segid "    " and resid   29 and name   HN) (segid "    " and resid   28 and name HG21)
    or (segid "    " and resid   29 and name   HN) (segid "    " and resid   28 and name HG23)
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   29 and name   HN) 3.696 1.639 1.639 ! spec=nnoe, no=62, id=462
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   29 and name   HA) 2.031 0.495 0.495 ! spec=nnoe, no=63, id=463
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   43 and name   HB) 2.744 0.903 0.903 ! spec=nnoe, no=64, id=464
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   29 and name HG21) 2.564 0.789 0.789 ! spec=nnoe, no=65, id=465
    or (segid "    " and resid   29 and name   HN) (segid "    " and resid   29 and name HG22)
    or (segid "    " and resid   29 and name   HN) (segid "    " and resid   29 and name HG23)
assign (segid "    " and resid   12 and name   HN) (segid "    " and resid   12 and name   HA) 2.102 0.530 0.530 ! spec=nnoe, no=67, id=467
assign (segid "    " and resid   12 and name   HN) (segid "    " and resid   23 and name  HD2) 4.627 2.569 2.569 ! spec=nnoe, no=69, id=469
assign (segid "    " and resid   12 and name   HN) (segid "    " and resid   22 and name   HN) 2.462 0.727 0.727 ! spec=nnoe, no=70, id=470
assign (segid "    " and resid   52 and name   HN) (segid "    " and resid   53 and name   HN) 2.594 0.808 0.808 ! spec=nnoe, no=77, id=471
assign (segid "    " and resid   52 and name   HN) (segid "    " and resid   37 and name   HA) 3.748 1.686 1.686 ! spec=nnoe, no=78, id=472
assign (segid "    " and resid   52 and name   HN) (segid "    " and resid   52 and name   HA) 2.600 0.811 0.811 ! spec=nnoe, no=79, id=473
assign (segid "    " and resid   52 and name   HN) (segid "    " and resid   52 and name   HB) 2.162 0.561 0.561 ! spec=nnoe, no=80, id=474
assign (segid "    " and resid   52 and name   HN) (segid "    " and resid   39 and name   HN) 3.430 1.412 1.412 ! spec=nnoe, no=83, id=477
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   32 and name   HN) 3.816 1.747 1.747 ! spec=nnoe, no=85, id=479
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   33 and name   HA) 1.918 0.441 0.441 ! spec=nnoe, no=89, id=483
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   23 and name   HN) 3.056 1.121 1.121 ! spec=nnoe, no=93, id=487
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid    8 and name   HN) 2.769 0.920 0.920 ! spec=nnoe, no=94, id=488
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   25 and name  HA1) 2.325 0.649 0.649 ! spec=nnoe, no=96, id=490
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   25 and name  HA2) 2.307 0.639 0.639 ! spec=nnoe, no=97, id=491
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   26 and name  HB1) 2.049 0.504 0.504 ! spec=nnoe, no=98, id=492
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   26 and name  HB2) 2.321 0.646 0.646 ! spec=nnoe, no=99, id=493
assign (segid "    " and resid   46 and name   HN) (segid "    " and resid   47 and name   HN) 3.090 1.146 1.146 ! spec=nnoe, no=101, id=495
assign (segid "    " and resid   46 and name   HN) (segid "    " and resid   43 and name   HB) 3.500 1.470 1.470 ! spec=nnoe, no=102, id=496
assign (segid "    " and resid   46 and name   HN) (segid "    " and resid   45 and name   HN) 2.293 0.631 0.631 ! spec=nnoe, no=104, id=498
assign (segid "    " and resid   46 and name   HN) (segid "    " and resid   45 and name  HA1) 2.692 0.870 0.870 ! spec=nnoe, no=105, id=499
assign (segid "    " and resid   46 and name   HN) (segid "    " and resid   45 and name  HA2) 2.644 0.839 0.839 ! spec=nnoe, no=106, id=500
assign (segid "    " and resid   17 and name   HN) (segid "    " and resid   17 and name   HA) 2.302 0.636 0.636 ! spec=nnoe, no=109, id=503
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   51 and name   HA) 3.063 1.126 1.126 ! spec=nnoe, no=112, id=506
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   39 and name  HB2) 2.254 0.610 0.610 ! spec=nnoe, no=114, id=508
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   50 and name   HN) 2.681 0.863 0.863 ! spec=nnoe, no=116, id=510
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   38 and name   HA) 1.963 0.462 0.462 ! spec=nnoe, no=117, id=511
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   23 and name   HN) 4.173 2.090 2.090 ! spec=nnoe, no=120, id=514
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   11 and name   HN) 2.898 1.008 1.008 ! spec=nnoe, no=121, id=515
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   23 and name   HA) 1.996 0.478 0.478 ! spec=nnoe, no=122, id=516
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   11 and name   HA) 2.356 0.666 0.666 ! spec=nnoe, no=123, id=517
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   24 and name   HA) 2.388 0.684 0.684 ! spec=nnoe, no=124, id=518
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   11 and name  HB2) 3.073 1.133 1.133 ! spec=nnoe, no=125, id=519
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   24 and name  HG2) 2.863 0.983 0.983 ! spec=nnoe, no=126, id=520
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   23 and name  HB2) 1.741 0.364 0.364 ! spec=nnoe, no=127, id=521
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   23 and name  HG2) 2.757 0.912 0.912 ! spec=nnoe, no=128, id=522
assign (segid "    " and resid   38 and name   HN) (segid "    " and resid   37 and name   HA) 2.980 1.066 1.066 ! spec=nnoe, no=130, id=524
assign (segid "    " and resid   38 and name   HN) (segid "    " and resid   37 and name  HB2) 2.861 0.982 0.982 ! spec=nnoe, no=131, id=525
assign (segid "    " and resid   38 and name   HN) (segid "    " and resid   38 and name   HA) 2.794 0.937 0.937 ! spec=nnoe, no=133, id=527
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   15 and name   HA) 2.467 0.730 0.730 ! spec=nnoe, no=137, id=531
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   43 and name HG12) 5.142 3.173 3.173 ! spec=nnoe, no=138, id=532
    or (segid "    " and resid   43 and name   HN) (segid "    " and resid   43 and name HG11)
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   42 and name  HB1) 2.731 0.895 0.895 ! spec=nnoe, no=143, id=536
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   42 and name  HB2) 5.158 3.192 3.192 ! spec=nnoe, no=144, id=537
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   43 and name   HB) 2.298 0.634 0.634 ! spec=nnoe, no=145, id=538
assign (segid "    " and resid   59 and name   HN) (segid "    " and resid   58 and name   HB) 2.041 0.500 0.500 ! spec=nnoe, no=150, id=543
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid   56 and name   HN) 2.483 0.740 0.740 ! spec=nnoe, no=153, id=546
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid    6 and name  HB1) 2.451 0.721 0.721 ! spec=nnoe, no=156, id=549
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid    6 and name  HB2) 2.268 0.617 0.617 ! spec=nnoe, no=157, id=550
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid   57 and name   HA) 3.217 1.242 1.242 ! spec=nnoe, no=159, id=552
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid   55 and name HG22) 3.217 1.242 1.242 ! spec=nnoe, no=160, id=553
    or (segid "    " and resid    7 and name   HN) (segid "    " and resid   55 and name HG21)
    or (segid "    " and resid    7 and name   HN) (segid "    " and resid   55 and name HG23)
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   23 and name   HN) 4.231 2.148 2.148 ! spec=nnoe, no=162, id=555
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   23 and name   HN) 3.467 1.442 1.442 ! spec=nnoe, no=163, id=556
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   22 and name   HA) 2.117 0.538 0.538 ! spec=nnoe, no=164, id=557
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   26 and name  HB1) 2.541 0.775 0.775 ! spec=nnoe, no=166, id=559
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   26 and name  HB2) 3.070 1.131 1.131 ! spec=nnoe, no=167, id=560
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   23 and name  HD2) 2.527 0.766 0.766 ! spec=nnoe, no=169, id=562
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   23 and name  HG2) 2.375 0.677 0.677 ! spec=nnoe, no=170, id=563
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   27 and name   HN) 4.027 1.946 1.946 ! spec=nnoe, no=171, id=564
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   27 and name   HB) 2.085 0.522 0.522 ! spec=nnoe, no=172, id=565
assign (segid "    " and resid   56 and name   HN) (segid "    " and resid   56 and name   HA) 2.674 0.858 0.858 ! spec=nnoe, no=175, id=568
assign (segid "    " and resid   56 and name   HN) (segid "    " and resid   55 and name   HB) 2.067 0.513 0.513 ! spec=nnoe, no=178, id=571
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   27 and name   HA) 2.738 0.900 0.900 ! spec=nnoe, no=180, id=573
assign (segid "    " and resid   19 and name   HN) (segid "    " and resid   18 and name   HN) 2.195 0.578 0.578 ! spec=nnoe, no=181, id=574
assign (segid "    " and resid   19 and name   HN) (segid "    " and resid   18 and name  HA2) 2.598 0.810 0.810 ! spec=nnoe, no=182, id=575
assign (segid "    " and resid   19 and name   HN) (segid "    " and resid   19 and name  HB2) 1.791 0.385 0.385 ! spec=nnoe, no=183, id=576
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   35 and name   HA) 2.438 0.713 0.713 ! spec=nnoe, no=185, id=578
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   35 and name  HB2) 2.642 0.838 0.838 ! spec=nnoe, no=187, id=580
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   34 and name   HB) 2.232 0.598 0.598 ! spec=nnoe, no=188, id=581
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   34 and name HG22) 2.709 0.881 0.881 ! spec=nnoe, no=189, id=582
    or (segid "    " and resid   35 and name   HN) (segid "    " and resid   34 and name HG21)
    or (segid "    " and resid   35 and name   HN) (segid "    " and resid   34 and name HG23)
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   36 and name   HN) 3.788 1.722 1.722 ! spec=nnoe, no=190, id=583
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   33 and name  HG2) 3.472 1.446 1.446 ! spec=nnoe, no=192, id=585
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   34 and name HD12) 5.759 3.980 3.980 ! spec=nnoe, no=193, id=586
    or (segid "    " and resid   35 and name   HN) (segid "    " and resid   34 and name HD11)
    or (segid "    " and resid   35 and name   HN) (segid "    " and resid   34 and name HD13)
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   10 and name   HA) 1.924 0.444 0.444 ! spec=nnoe, no=196, id=589
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   11 and name   HA) 2.466 0.730 0.730 ! spec=nnoe, no=197, id=590
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   11 and name  HB2) 1.947 0.455 0.455 ! spec=nnoe, no=199, id=592
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   10 and name  HB2) 2.452 0.722 0.722 ! spec=nnoe, no=200, id=593
assign (segid "    " and resid   54 and name   HN) (segid "    " and resid   53 and name  HB1) 4.710 2.662 2.662 ! spec=nnoe, no=202, id=595
assign (segid "    " and resid   54 and name   HN) (segid "    " and resid   53 and name   HN) 2.238 0.601 0.601 ! spec=nnoe, no=203, id=596
assign (segid "    " and resid   54 and name   HN) (segid "    " and resid   54 and name   HA) 2.488 0.743 0.743 ! spec=nnoe, no=204, id=597
assign (segid "    " and resid   54 and name   HN) (segid "    " and resid   54 and name  HB2) 2.342 0.658 0.658 ! spec=nnoe, no=205, id=598
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   24 and name  HG2) 3.659 1.606 1.606 ! spec=nnoe, no=208, id=601
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   32 and name   HN) 2.437 0.712 0.712 ! spec=nnoe, no=212, id=605
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   40 and name  HB2) 2.271 0.619 0.619 ! spec=nnoe, no=214, id=607
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   39 and name  HB2) 2.479 0.738 0.738 ! spec=nnoe, no=215, id=608
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   30 and name  HB2) 5.828 4.076 4.076 ! spec=nnoe, no=216, id=609
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   33 and name   HA) 2.764 0.917 0.917 ! spec=nnoe, no=217, id=610
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   41 and name  HA1) 2.344 0.659 0.659 ! spec=nnoe, no=222, id=615
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   31 and name   HA) 2.688 0.867 0.867 ! spec=nnoe, no=223, id=616
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   31 and name   HB) 2.983 1.068 1.068 ! spec=nnoe, no=224, id=617
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   33 and name  HG2) 2.281 0.624 0.624 ! spec=nnoe, no=227, id=620
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   40 and name  HB2) 2.844 0.971 0.971 ! spec=nnoe, no=228, id=621
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   31 and name HG21) 2.847 0.973 0.973 ! spec=nnoe, no=229, id=622
    or (segid "    " and resid   32 and name   HN) (segid "    " and resid   31 and name HG22)
    or (segid "    " and resid   32 and name   HN) (segid "    " and resid   31 and name HG23)
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   41 and name  HA1) 2.271 0.619 0.619 ! spec=nnoe, no=231, id=624
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   41 and name  HA2) 2.069 0.514 0.514 ! spec=nnoe, no=232, id=625
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   42 and name  HB1) 3.171 1.206 1.206 ! spec=nnoe, no=233, id=626
assign (segid "    " and resid   49 and name   HN) (segid "    " and resid   49 and name  HB2) 2.876 0.993 0.993 ! spec=nnoe, no=243, id=636
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid    6 and name   HN) 2.553 0.782 0.782 ! spec=nnoe, no=246, id=639
assign (segid "    " and resid    6 and name   HN) (segid "    " and resid   29 and name   HA) 3.034 1.104 1.104 ! spec=nnoe, no=250, id=643
assign (segid "    " and resid    6 and name   HN) (segid "    " and resid   27 and name HG22) 2.509 0.756 0.756 ! spec=nnoe, no=252, id=645
    or (segid "    " and resid    6 and name   HN) (segid "    " and resid   27 and name HG21)
    or (segid "    " and resid    6 and name   HN) (segid "    " and resid   27 and name HG23)
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid    6 and name   HN) 3.415 1.399 1.399 ! spec=nnoe, no=253, id=646
assign (segid "    " and resid    6 and name   HN) (segid "    " and resid   27 and name   HA) 4.017 1.936 1.936 ! spec=nnoe, no=254, id=647
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   50 and name   HN) 2.585 0.802 0.802 ! spec=nnoe, no=255, id=648
assign (segid "    " and resid   50 and name   HN) (segid "    " and resid   49 and name   HN) 5.694 3.891 3.891 ! spec=nnoe, no=256, id=649
assign (segid "    " and resid   50 and name   HN) (segid "    " and resid   49 and name  HB2) 2.404 0.693 0.693 ! spec=nnoe, no=259, id=652
assign (segid "    " and resid   50 and name   HN) (segid "    " and resid   39 and name  HB2) 3.548 1.511 1.511 ! spec=nnoe, no=260, id=653
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   25 and name   HN) 2.442 0.716 0.716 ! spec=nnoe, no=261, id=654
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   24 and name  HG2) 2.916 1.021 1.021 ! spec=nnoe, no=262, id=655
assign (segid "    " and resid   16 and name   HN) (segid "    " and resid   15 and name   HA) 2.690 0.868 0.868 ! spec=nnoe, no=263, id=656
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   16 and name   HN) 1.892 0.430 0.430 ! spec=nnoe, no=264, id=657
assign (segid "    " and resid   16 and name   HN) (segid "    " and resid   16 and name  HB2) 2.197 0.579 0.579 ! spec=nnoe, no=265, id=658
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   25 and name  HA1) 2.269 0.618 0.618 ! spec=nnoe, no=267, id=660
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   25 and name  HA2) 1.738 0.362 0.362 ! spec=nnoe, no=268, id=661
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   24 and name   HA) 1.706 0.349 0.349 ! spec=nnoe, no=269, id=662
assign (segid "    " and resid   37 and name   HN) (segid "    " and resid   36 and name  HB2) 2.758 0.913 0.913 ! spec=nnoe, no=271, id=664
assign (segid "    " and resid   37 and name   HN) (segid "    " and resid   37 and name   HA) 2.542 0.775 0.775 ! spec=nnoe, no=273, id=666
assign (segid "    " and resid   37 and name   HN) (segid "    " and resid   37 and name  HB2) 2.438 0.713 0.713 ! spec=nnoe, no=275, id=668
assign (segid "    " and resid   47 and name   HN) (segid "    " and resid   47 and name   HA) 2.426 0.706 0.706 ! spec=nnoe, no=282, id=675
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   36 and name   HN) 3.245 1.264 1.264 ! spec=nnoe, no=284, id=677
assign (segid "    " and resid   36 and name   HN) (segid "    " and resid   35 and name   HA) 2.318 0.645 0.645 ! spec=nnoe, no=286, id=679
assign (segid "    " and resid   36 and name   HN) (segid "    " and resid   36 and name   HA) 1.800 0.389 0.389 ! spec=nnoe, no=287, id=680
assign (segid "    " and resid   36 and name   HN) (segid "    " and resid   36 and name  HG2) 2.337 0.655 0.655 ! spec=nnoe, no=288, id=681
assign (segid "    " and resid   36 and name   HN) (segid "    " and resid   36 and name  HB2) 2.178 0.569 0.569 ! spec=nnoe, no=289, id=682
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid    9 and name HD22) 3.372 1.365 1.365 ! spec=nnoe, no=291, id=684
    or (segid "    " and resid   10 and name   HN) (segid "    " and resid    9 and name HD21)
    or (segid "    " and resid   10 and name   HN) (segid "    " and resid    9 and name HD23)
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   10 and name   HN) 3.354 1.350 1.350 ! spec=nnoe, no=293, id=686
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid   10 and name   HA) 2.427 0.707 0.707 ! spec=nnoe, no=294, id=687
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid   54 and name  HB2) 4.119 2.036 2.036 ! spec=nnoe, no=296, id=689
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid   10 and name  HB2) 2.516 0.760 0.760 ! spec=nnoe, no=298, id=691
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid    9 and name  HB1) 2.572 0.794 0.794 ! spec=nnoe, no=299, id=692
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid    9 and name  HB2) 2.496 0.747 0.747 ! spec=nnoe, no=300, id=693
assign (segid "    " and resid   18 and name   HN) (segid "    " and resid   17 and name   HA) 1.744 0.365 0.365 ! spec=nnoe, no=303, id=696
assign (segid "    " and resid   18 and name   HN) (segid "    " and resid   17 and name  HG2) 2.770 0.921 0.921 ! spec=nnoe, no=304, id=697
assign (segid "    " and resid   18 and name   HN) (segid "    " and resid   19 and name  HB2) 2.897 1.007 1.007 ! spec=nnoe, no=305, id=698
assign (segid "    " and resid   18 and name   HN) (segid "    " and resid   18 and name  HA2) 2.053 0.506 0.506 ! spec=nnoe, no=306, id=699
assign (segid "    " and resid   53 and name   HN) (segid "    " and resid   52 and name   HA) 3.072 1.132 1.132 ! spec=nnoe, no=307, id=700
assign (segid "    " and resid   53 and name   HN) (segid "    " and resid   53 and name  HB1) 2.379 0.679 0.679 ! spec=nnoe, no=308, id=701
assign (segid "    " and resid   53 and name   HN) (segid "    " and resid   52 and name   HB) 2.315 0.643 0.643 ! spec=nnoe, no=310, id=703
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   23 and name   HN) 3.534 1.498 1.498 ! spec=nnoe, no=314, id=707
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   22 and name   HA) 2.422 0.704 0.704 ! spec=nnoe, no=316, id=709
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   21 and name  HA1) 2.018 0.489 0.489 ! spec=nnoe, no=317, id=710
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   21 and name  HA2) 2.050 0.505 0.505 ! spec=nnoe, no=318, id=711
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   12 and name  HB1) 2.878 0.994 0.994 ! spec=nnoe, no=319, id=712
assign (segid "    " and resid   41 and name   HN) (segid "    " and resid   41 and name  HA1) 2.541 0.774 0.774 ! spec=nnoe, no=324, id=717
assign (segid "    " and resid   41 and name   HN) (segid "    " and resid   41 and name  HA2) 2.435 0.711 0.711 ! spec=nnoe, no=325, id=718
assign (segid "    " and resid   41 and name   HN) (segid "    " and resid   40 and name  HB2) 3.022 1.096 1.096 ! spec=nnoe, no=326, id=719
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   31 and name   HN) 1.999 0.480 0.480 ! spec=nnoe, no=329, id=722
assign (segid "    " and resid   31 and name   HN) (segid "    " and resid   31 and name HG21) 2.375 0.677 0.677 ! spec=nnoe, no=330, id=723
    or (segid "    " and resid   31 and name   HN) (segid "    " and resid   31 and name HG22)
    or (segid "    " and resid   31 and name   HN) (segid "    " and resid   31 and name HG23)
assign (segid "    " and resid   31 and name   HN) (segid "    " and resid   41 and name  HA1) 2.250 0.608 0.608 ! spec=nnoe, no=331, id=724
assign (segid "    " and resid   31 and name   HN) (segid "    " and resid   31 and name   HA) 1.941 0.452 0.452 ! spec=nnoe, no=332, id=725
assign (segid "    " and resid   31 and name   HN) (segid "    " and resid   31 and name   HB) 2.856 0.979 0.979 ! spec=nnoe, no=333, id=726
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid    8 and name   HN) 3.166 1.203 1.203 ! spec=nnoe, no=334, id=727
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid   27 and name   HA) 3.116 1.165 1.165 ! spec=nnoe, no=337, id=730
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid    8 and name  HA2) 2.088 0.523 0.523 ! spec=nnoe, no=339, id=732
assign (segid "    " and resid   55 and name   HN) (segid "    " and resid   54 and name  HB2) 3.401 1.388 1.388 ! spec=nnoe, no=344, id=737
assign (segid "    " and resid   55 and name   HN) (segid "    " and resid   55 and name   HB) 3.196 1.226 1.226 ! spec=nnoe, no=345, id=738
assign (segid "    " and resid   55 and name   HN) (segid "    " and resid   55 and name HG22) 2.040 0.500 0.500 ! spec=nnoe, no=346, id=739
    or (segid "    " and resid   55 and name   HN) (segid "    " and resid   55 and name HG21)
    or (segid "    " and resid   55 and name   HN) (segid "    " and resid   55 and name HG23)
assign (segid "    " and resid   55 and name   HN) (segid "    " and resid    9 and name  HB1) 3.181 1.214 1.214 ! spec=nnoe, no=347, id=740
assign (segid "    " and resid   55 and name   HN) (segid "    " and resid   56 and name   HN) 3.913 1.838 1.838 ! spec=nnoe, no=348, id=741
assign (segid "    " and resid   55 and name   HN) (segid "    " and resid   54 and name   HA) 2.810 0.948 0.948 ! spec=nnoe, no=350, id=743
assign (segid "    " and resid   49 and name   HN) (segid "    " and resid   48 and name   HN) 3.341 1.339 1.339 ! spec=nnoe, no=352, id=745
assign (segid "    " and resid   41 and name   HN) (segid "    " and resid   48 and name   HN) 2.358 0.667 0.667 ! spec=nnoe, no=353, id=746
assign (segid "    " and resid   48 and name   HN) (segid "    " and resid   47 and name   HA) 1.877 0.423 0.423 ! spec=nnoe, no=354, id=747
assign (segid "    " and resid   48 and name   HN) (segid "    " and resid   20 and name  HB2) 2.871 0.989 0.989 ! spec=nnoe, no=356, id=749
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   20 and name   HA) 1.879 0.424 0.424 ! spec=nnoe, no=360, id=753
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   21 and name  HA1) 2.232 0.598 0.598 ! spec=nnoe, no=361, id=754
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   21 and name  HA2) 1.970 0.466 0.466 ! spec=nnoe, no=362, id=755
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   20 and name HD12) 2.242 0.603 0.603 ! spec=nnoe, no=363, id=756
    or (segid "    " and resid   21 and name   HN) (segid "    " and resid   20 and name HD11)
    or (segid "    " and resid   21 and name   HN) (segid "    " and resid   20 and name HD13)
assign (segid "    " and resid   45 and name   HN) (segid "    " and resid   45 and name  HA1) 2.160 0.560 0.560 ! spec=nnoe, no=367, id=759
assign (segid "    " and resid   45 and name   HN) (segid "    " and resid   45 and name  HA2) 1.988 0.474 0.474 ! spec=nnoe, no=368, id=760




!ambig NOE
assign (segid "    " and resid   55 and name HG22) (segid "    " and resid   52 and name   HA) 2.013 0.486 0.486 ! spec=cnoe, no=152, id=151
    or (segid "    " and resid   52 and name   HA) (segid "    " and resid   52 and name   HB)
assign (segid "    " and resid   43 and name HD12) (segid "    " and resid   43 and name   HA) 2.714 0.884 0.884 ! spec=cnoe, no=212, id=211
    or (segid "    " and resid   43 and name   HA) (segid "    " and resid   28 and name HG12)
    or (segid "    " and resid   43 and name   HA) (segid "    " and resid   28 and name HG11)
assign (segid "    " and resid    6 and name  HB2) (segid "    " and resid   55 and name HG12) 2.594 0.808 0.808 ! spec=cnoe, no=264, id=263
    or (segid "    " and resid    6 and name  HB2) (segid "    " and resid   55 and name HG11)
    or (segid "    " and resid    6 and name  HB2) (segid "    " and resid   55 and name HG13)
    or (segid "    " and resid    6 and name  HB2) (segid "    " and resid   57 and name HG22)
    or (segid "    " and resid    6 and name  HB2) (segid "    " and resid   57 and name HG21)
    or (segid "    " and resid    6 and name  HB2) (segid "    " and resid   57 and name HG23)
assign (segid "    " and resid   14 and name  HB2) (segid "    " and resid   14 and name  HD2) 2.713 0.883 0.883 ! spec=cnoe, no=268, id=267
    or (segid "    " and resid   14 and name  HB2) (segid "    " and resid   21 and name  HA2)
assign (segid "    " and resid   22 and name   HA) (segid "    " and resid   20 and name HD12) 4.512 2.443 2.443 ! spec=cnoe, no=274, id=273
    or (segid "    " and resid   22 and name   HA) (segid "    " and resid   20 and name HD11)
    or (segid "    " and resid   22 and name   HA) (segid "    " and resid   20 and name HD13)
    or (segid "    " and resid   22 and name   HA) (segid "    " and resid   43 and name HD12)
    or (segid "    " and resid   22 and name   HA) (segid "    " and resid   43 and name HD11)
    or (segid "    " and resid   22 and name   HA) (segid "    " and resid   43 and name HD13)
    or (segid "    " and resid   22 and name   HA) (segid "    " and resid   28 and name HG12)
    or (segid "    " and resid   22 and name   HA) (segid "    " and resid   28 and name HG11)
assign (segid "    " and resid    6 and name   HA) (segid "    " and resid   57 and name HG22) 2.412 0.698 0.698 ! spec=cnoe, no=300, id=299
    or (segid "    " and resid    6 and name   HA) (segid "    " and resid   57 and name HG21)
    or (segid "    " and resid    6 and name   HA) (segid "    " and resid   57 and name HG23)
    or (segid "    " and resid    6 and name   HA) (segid "    " and resid   27 and name HG22)
    or (segid "    " and resid    6 and name   HA) (segid "    " and resid   27 and name HG21)
    or (segid "    " and resid    6 and name   HA) (segid "    " and resid   27 and name HG23)
assign (segid "    " and resid   13 and name   HN) (segid "    " and resid   14 and name  HD2) 3.134 1.179 1.179 ! spec=nnoe, no=30, id=431
    or (segid "    " and resid   13 and name   HN) (segid "    " and resid   21 and name  HA2)
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   33 and name   HN) 2.778 0.926 0.926 ! spec=nnoe, no=45, id=445
    or (segid "    " and resid   34 and name   HN) (segid "    " and resid   40 and name   HN)
assign (segid "    " and resid   12 and name   HN) (segid "    " and resid   21 and name  HA2) 5.780 4.009 4.009 ! spec=nnoe, no=68, id=468
    or (segid "    " and resid   12 and name   HN) (segid "    " and resid   14 and name  HD2)
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid    7 and name  HB2) 2.856 0.979 0.979 ! spec=nnoe, no=100, id=494
    or (segid "    " and resid   26 and name   HN) (segid "    " and resid   23 and name  HB2)
assign (segid "    " and resid   17 and name   HN) (segid "    " and resid   17 and name  HG2) 2.307 0.639 0.639 ! spec=nnoe, no=110, id=504
    or (segid "    " and resid   17 and name   HN) (segid "    " and resid   16 and name  HB2)
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   43 and name HG11) 3.404 1.391 1.391 ! spec=nnoe, no=147, id=540
    or (segid "    " and resid   43 and name   HN) (segid "    " and resid   28 and name HG22)
    or (segid "    " and resid   43 and name   HN) (segid "    " and resid   28 and name HG21)
    or (segid "    " and resid   43 and name   HN) (segid "    " and resid   28 and name HG23)
assign (segid "    " and resid   56 and name   HN) (segid "    " and resid    9 and name  HB1) 3.927 1.850 1.850 ! spec=nnoe, no=176, id=569
    or (segid "    " and resid   56 and name   HN) (segid "    " and resid   57 and name HG12)
    or (segid "    " and resid   56 and name   HN) (segid "    " and resid   57 and name HG11)
    or (segid "    " and resid   56 and name   HN) (segid "    " and resid   57 and name HG13)
assign (segid "    " and resid   54 and name   HN) (segid "    " and resid   55 and name HG22) 2.817 0.952 0.952 ! spec=nnoe, no=206, id=599
    or (segid "    " and resid   54 and name   HN) (segid "    " and resid   55 and name HG21)
    or (segid "    " and resid   54 and name   HN) (segid "    " and resid   55 and name HG23)
    or (segid "    " and resid   54 and name   HN) (segid "    " and resid   52 and name   HB)
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   41 and name   HN) 3.622 1.574 1.574 ! spec=nnoe, no=211, id=604
    or (segid "    " and resid   40 and name   HN) (segid "    " and resid   50 and name   HN)
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   32 and name   HN) 2.412 0.698 0.698 ! spec=nnoe, no=221, id=614
    or (segid "    " and resid   33 and name   HN) (segid "    " and resid   32 and name   HN)
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   28 and name HG12) 4.609 2.549 2.549 ! spec=nnoe, no=235, id=628
    or (segid "    " and resid   42 and name   HN) (segid "    " and resid   28 and name HG11)
    or (segid "    " and resid   42 and name   HN) (segid "    " and resid   43 and name HD12)
    or (segid "    " and resid   42 and name   HN) (segid "    " and resid   43 and name HD11)
    or (segid "    " and resid   42 and name   HN) (segid "    " and resid   43 and name HD13)
assign (segid "    " and resid    5 and name   HN) (segid "    " and resid   30 and name  HB2) 5.135 3.164 3.164 ! spec=nnoe, no=240, id=633
    or (segid "    " and resid    5 and name   HN) (segid "    " and resid   57 and name HG12)
    or (segid "    " and resid    5 and name   HN) (segid "    " and resid   57 and name HG11)
    or (segid "    " and resid    5 and name   HN) (segid "    " and resid   57 and name HG13)
assign (segid "    " and resid   37 and name   HN) (segid "    " and resid   36 and name   HA) 2.980 1.066 1.066 ! spec=nnoe, no=274, id=667
    or (segid "    " and resid   37 and name   HN) (segid "    " and resid   35 and name  HB2)
assign (segid "    " and resid   41 and name   HN) (segid "    " and resid   42 and name   HA) 3.387 1.377 1.377 ! spec=nnoe, no=323, id=716
    or (segid "    " and resid   41 and name   HN) (segid "    " and resid   47 and name   HA)
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   31 and name   HN) 3.491 1.462 1.462 ! spec=nnoe, no=328, id=721
    or (segid "    " and resid   31 and name   HN) (segid "    " and resid   33 and name   HN)
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid   56 and name   HN) 4.289 2.208 2.208 ! spec=nnoe, no=335, id=728
    or (segid "    " and resid    8 and name   HN) (segid "    " and resid   28 and name   HN)





! H-bond restraints
!Restraints for slow exchanging amides (peaks still present in HSQC after one hour of hydrogen/deuterium exchange)
!Acceptors determined by looking at preliminary structures in insight.

assign (resid  6 and name  HN)   (resid  28 and name O)    2.3   0.4 0.0
assign (resid  7 and name  HN)   (resid  56 and name O)    2.3   0.4 0.0
assign (resid  8 and name  HN)   (resid  26 and name O)    2.3   0.4 0.0
assign (resid  9 and name  HN)   (resid  54 and name O)    2.3   0.4 0.0
assign (resid  12 and name  HN)   (resid  22 and name O)    2.3   0.4 0.0
assign (resid  20 and name  HN)   (resid  49 and name O)    2.3   0.4 0.0
assign (resid  22 and name  HN)   (resid  12 and name O)    2.3   0.4 0.0
assign (resid  25 and name  HN)   (resid  8 and name O)    2.3   0.4 0.0
assign (resid  26 and name  HN)   (resid  23 and name O)    2.3   0.4 0.0
assign (resid  28 and name  HN)   (resid  6 and name O)    2.3   0.4 0.0
assign (resid  29 and name  HN)   (resid  42 and name O)    2.3   0.4 0.0
assign (resid  30 and name  HN)   (resid  4 and name O)    2.3   0.4 0.0
assign (resid  31 and name  HN)   (resid  40 and name O)    2.3   0.4 0.0
assign (resid  32 and name  HN)   (resid  40 and name O)    2.3   0.4 0.0
assign (resid  39 and name  HN)   (resid  50 and name O)    2.3   0.4 0.0
assign (resid  40 and name  HN)   (resid  32 and name O)    2.3   0.4 0.0
assign (resid  41 and name  HN)   (resid  48 and name O)    2.3   0.4 0.0
assign (resid  42 and name  HN)   (resid  29 and name O)    2.3   0.4 0.0
assign (resid  43 and name  HN)   (resid  46 and name O)    2.3   0.4 0.0
assign (resid  46 and name  HN)   (resid  43 and name O)    2.3   0.4 0.0
assign (resid  48 and name  HN)   (resid  41 and name O)    2.3   0.4 0.0
assign (resid  49 and name  HN)   (resid  18 and name O)    2.3   0.4 0.0
assign (resid  50 and name  HN)   (resid  39 and name O)    2.3   0.4 0.0
assign (resid  52 and name  HN)   (resid  37 and name O)    2.3   0.4 0.0
assign (resid  54 and name  HN)   (resid  51 and name O)    2.3   0.4 0.0
assign (resid  55 and name  HN)   (resid  52 and name O)    2.3   0.4 0.0
assign (resid  56 and name  HN)   (resid  7 and name O)    2.3   0.4 0.0
assign (resid  58 and name  HN)   (resid  5 and name O)    2.3   0.4 0.0





















  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          HT1       MET   1  19.318  -4.782   7.061
    2   2H    MET   1          HT2       MET   1  17.902  -5.665   6.791
    3   3H    MET   1          HT3       MET   1  18.643  -5.700   8.311
    4    HA   MET   1           HA       MET   1  16.705  -4.296   8.362
    5   1HB   MET   1          HB2       MET   1  18.593  -3.720   9.802
    6   2HB   MET   1          HB1       MET   1  19.318  -2.778   8.507
    7   1HG   MET   1          HG2       MET   1  18.235  -1.351  10.149
    8   2HG   MET   1          HG1       MET   1  17.460  -1.219   8.570
    9   1HE   MET   1          HE1       MET   1  14.436  -0.723  10.988
   10   2HE   MET   1          HE2       MET   1  15.359  -0.054   9.641
   11   3HE   MET   1          HE3       MET   1  16.085  -0.154  11.245
   12    H    ASP   2           HN       ASP   2  15.429  -3.883   6.637
   13    HA   ASP   2           HA       ASP   2  15.859  -1.433   5.212
   14   1HB   ASP   2          HB2       ASP   2  17.231  -2.961   3.853
   15   2HB   ASP   2          HB1       ASP   2  15.842  -4.022   3.646
   16    H    GLN   3           HN       GLN   3  13.950  -0.525   4.717
   17    HA   GLN   3           HA       GLN   3  11.571  -2.242   4.552
   18   1HB   GLN   3          HB2       GLN   3  11.757   0.319   6.152
   19   2HB   GLN   3          HB1       GLN   3  10.303  -0.643   5.919
   20   1HG   GLN   3          HG2       GLN   3  11.350  -2.508   7.101
   21   2HG   GLN   3          HG1       GLN   3  12.802  -1.538   7.340
   22   1HE2  GLN   3          HE21      GLN   3  12.763   0.168   8.803
   23   2HE2  GLN   3          HE22      GLN   3  11.523   0.329   9.996
   24    HA   PRO   4           HA       PRO   4  11.777   0.496   0.822
   25   1HB   PRO   4          HB2       PRO   4   9.833  -1.581  -0.041
   26   2HB   PRO   4          HB1       PRO   4  11.228  -0.917  -0.899
   27   1HG   PRO   4          HG2       PRO   4  11.320  -3.358   0.162
   28   2HG   PRO   4          HG1       PRO   4  12.733  -2.286   0.210
   29   1HD   PRO   4          HD2       PRO   4  10.799  -2.978   2.382
   30   2HD   PRO   4          HD1       PRO   4  12.554  -2.724   2.472
   31    H    CYS   5           HN       CYS   5  10.143   1.784  -0.187
   32    HA   CYS   5           HA       CYS   5   7.540   1.792   1.174
   33   1HB   CYS   5          HB2       CYS   5   9.229   4.240   0.632
   34   2HB   CYS   5          HB1       CYS   5   7.607   4.242   1.317
   35    HG   CYS   5           HG       CYS   5   8.717   2.474   3.476
   36    H    CYS   6           HN       CYS   6   5.939   3.202   0.029
   37    HA   CYS   6           HA       CYS   6   6.418   3.521  -2.826
   38   1HB   CYS   6          HB2       CYS   6   4.500   2.237  -3.497
   39   2HB   CYS   6          HB1       CYS   6   5.525   1.216  -2.507
   40    HG   CYS   6           HG       CYS   6   2.471   1.288  -2.192
   41    H    ARG   7           HN       ARG   7   4.268   4.408  -3.849
   42    HA   ARG   7           HA       ARG   7   2.888   6.172  -1.966
   43   1HB   ARG   7          HB2       ARG   7   3.278   8.157  -3.359
   44   2HB   ARG   7          HB1       ARG   7   4.777   7.507  -2.714
   45   1HG   ARG   7          HG2       ARG   7   5.322   6.519  -4.840
   46   2HG   ARG   7          HG1       ARG   7   3.760   7.006  -5.503
   47   1HD   ARG   7          HD2       ARG   7   4.367   9.362  -5.159
   48   2HD   ARG   7          HD1       ARG   7   5.936   8.859  -4.534
   49    HE   ARG   7           HE       ARG   7   5.693   7.721  -7.040
   50   1HH1  ARG   7          HH11      ARG   7   5.744  10.931  -5.688
   51   2HH1  ARG   7          HH12      ARG   7   6.448  11.653  -7.096
   52   1HH2  ARG   7          HH21      ARG   7   6.618   8.664  -8.899
   53   2HH2  ARG   7          HH22      ARG   7   6.938  10.366  -8.923
   54    H    GLY   8           HN       GLY   8   0.794   6.434  -2.419
   55   1HA   GLY   8          HA2       GLY   8  -0.355   4.958  -4.587
   56   2HA   GLY   8          HA1       GLY   8  -1.226   5.932  -3.414
   57    H    LEU   9           HN       LEU   9  -1.112   5.607  -6.496
   58    HA   LEU   9           HA       LEU   9  -0.537   8.309  -7.354
   59   1HB   LEU   9          HB2       LEU   9  -1.435   5.801  -8.728
   60   2HB   LEU   9          HB1       LEU   9  -1.567   7.345  -9.548
   61    HG   LEU   9           HG       LEU   9   0.467   6.166 -10.201
   62   1HD1  LEU   9          HD11      LEU   9   2.077   7.951  -9.770
   63   2HD1  LEU   9          HD12      LEU   9   1.023   8.601  -8.514
   64   3HD1  LEU   9          HD13      LEU   9   0.492   8.598 -10.196
   65   1HD2  LEU   9          HD21      LEU   9   1.243   6.367  -7.293
   66   2HD2  LEU   9          HD22      LEU   9   2.266   5.779  -8.604
   67   3HD2  LEU   9          HD23      LEU   9   0.815   4.886  -8.149
   68    H    TYR  10           HN       TYR  10  -3.288   6.344  -6.554
   69    HA   TYR  10           HA       TYR  10  -5.014   8.705  -6.855
   70   1HB   TYR  10          HB2       TYR  10  -5.886   5.881  -7.473
   71   2HB   TYR  10          HB1       TYR  10  -6.829   7.355  -7.663
   72    HD1  TYR  10           HD1      TYR  10  -4.344   5.181  -9.151
   73    HD2  TYR  10           HD2      TYR  10  -6.249   8.972  -9.457
   74    HE1  TYR  10           HE1      TYR  10  -3.554   5.383 -11.471
   75    HE2  TYR  10           HE2      TYR  10  -5.465   9.186 -11.778
   76    HH   TYR  10           HH       TYR  10  -4.128   6.574 -13.514
   77    H    ASP  11           HN       ASP  11  -6.617   8.947  -5.299
   78    HA   ASP  11           HA       ASP  11  -6.052   7.738  -2.780
   79   1HB   ASP  11          HB2       ASP  11  -8.120   9.062  -2.075
   80   2HB   ASP  11          HB1       ASP  11  -6.735   9.964  -2.664
   81    H    PHE  12           HN       PHE  12  -7.689   6.797  -1.413
   82    HA   PHE  12           HA       PHE  12  -9.999   5.551  -2.520
   83   1HB   PHE  12          HB2       PHE  12  -7.679   4.160  -3.045
   84   2HB   PHE  12          HB1       PHE  12  -8.303   3.393  -1.587
   85    HD1  PHE  12           HD1      PHE  12  -8.852   3.985  -5.131
   86    HD2  PHE  12           HD2      PHE  12 -10.447   2.247  -1.591
   87    HE1  PHE  12           HE1      PHE  12 -10.454   2.705  -6.488
   88    HE2  PHE  12           HE2      PHE  12 -12.052   0.961  -2.941
   89    HZ   PHE  12           HZ       PHE  12 -12.065   1.181  -5.376
   90    H    GLU  13           HN       GLU  13 -11.421   5.313  -0.940
   91    HA   GLU  13           HA       GLU  13 -10.503   5.501   1.812
   92   1HB   GLU  13          HB2       GLU  13 -12.905   5.749   2.355
   93   2HB   GLU  13          HB1       GLU  13 -12.361   6.928   1.169
   94   1HG   GLU  13          HG2       GLU  13 -13.347   5.594  -0.618
   95   2HG   GLU  13          HG1       GLU  13 -13.878   4.399   0.566
   96    HA   PRO  14           HA       PRO  14 -10.693   1.072   2.232
   97   1HB   PRO  14          HB2       PRO  14 -10.596   0.943   4.960
   98   2HB   PRO  14          HB1       PRO  14  -9.179   1.228   3.944
   99   1HG   PRO  14          HG2       PRO  14 -10.853   3.191   5.457
  100   2HG   PRO  14          HG1       PRO  14  -9.090   3.122   5.282
  101   1HD   PRO  14          HD2       PRO  14 -10.622   4.830   3.851
  102   2HD   PRO  14          HD1       PRO  14  -9.133   4.117   3.199
  103    H    GLU  15           HN       GLU  15 -12.407  -0.246   2.184
  104    HA   GLU  15           HA       GLU  15 -14.725   0.383   3.885
  105   1HB   GLU  15          HB2       GLU  15 -14.901  -0.557   1.019
  106   2HB   GLU  15          HB1       GLU  15 -16.246  -0.154   2.078
  107   1HG   GLU  15          HG2       GLU  15 -15.535   2.169   2.129
  108   2HG   GLU  15          HG1       GLU  15 -14.149   1.779   1.111
  109    H    ASN  16           HN       ASN  16 -12.531  -1.921   2.669
  110    HA   ASN  16           HA       ASN  16 -14.151  -4.119   3.780
  111   1HB   ASN  16          HB2       ASN  16 -13.594  -4.251   1.322
  112   2HB   ASN  16          HB1       ASN  16 -11.900  -4.384   1.779
  113   1HD2  ASN  16          HD21      ASN  16 -13.607  -6.264   0.359
  114   2HD2  ASN  16          HD22      ASN  16 -13.579  -7.728   1.275
  115    H    GLN  17           HN       GLN  17 -13.338  -5.304   5.412
  116    HA   GLN  17           HA       GLN  17 -11.182  -4.358   6.938
  117   1HB   GLN  17          HB2       GLN  17 -12.602  -7.023   6.966
  118   2HB   GLN  17          HB1       GLN  17 -11.413  -6.543   8.167
  119   1HG   GLN  17          HG2       GLN  17 -12.808  -4.706   8.872
  120   2HG   GLN  17          HG1       GLN  17 -13.975  -5.070   7.601
  121   1HE2  GLN  17          HE21      GLN  17 -14.296  -4.975  10.516
  122   2HE2  GLN  17          HE22      GLN  17 -14.909  -6.524  10.973
  123    H    GLY  18           HN       GLY  18  -9.060  -4.858   7.034
  124   1HA   GLY  18          HA2       GLY  18  -7.206  -6.342   6.730
  125   2HA   GLY  18          HA1       GLY  18  -8.072  -7.097   5.402
  126    H    GLU  19           HN       GLU  19  -8.823  -4.406   4.332
  127    HA   GLU  19           HA       GLU  19  -6.469  -4.046   2.706
  128   1HB   GLU  19          HB2       GLU  19  -8.924  -3.933   1.937
  129   2HB   GLU  19          HB1       GLU  19  -8.930  -2.319   2.631
  130   1HG   GLU  19          HG2       GLU  19  -7.106  -1.667   1.145
  131   2HG   GLU  19          HG1       GLU  19  -7.098  -3.288   0.450
  132    H    LEU  20           HN       LEU  20  -5.691  -1.789   2.234
  133    HA   LEU  20           HA       LEU  20  -5.531  -0.255   4.747
  134   1HB   LEU  20          HB2       LEU  20  -3.434  -1.440   3.953
  135   2HB   LEU  20          HB1       LEU  20  -3.422  -0.328   2.598
  136    HG   LEU  20           HG       LEU  20  -3.284   1.566   4.211
  137   1HD1  LEU  20          HD11      LEU  20  -2.887  -0.632   6.237
  138   2HD1  LEU  20          HD12      LEU  20  -4.280   0.444   6.140
  139   3HD1  LEU  20          HD13      LEU  20  -2.689   1.096   6.528
  140   1HD2  LEU  20          HD21      LEU  20  -0.932   1.209   4.780
  141   2HD2  LEU  20          HD22      LEU  20  -1.285   0.684   3.134
  142   3HD2  LEU  20          HD23      LEU  20  -1.106  -0.509   4.419
  143    H    GLY  21           HN       GLY  21  -6.226   1.782   4.696
  144   1HA   GLY  21          HA2       GLY  21  -7.076   2.906   2.148
  145   2HA   GLY  21          HA1       GLY  21  -7.454   3.536   3.744
  146    H    PHE  22           HN       PHE  22  -6.470   4.929   1.356
  147    HA   PHE  22           HA       PHE  22  -4.606   6.643   2.594
  148   1HB   PHE  22          HB2       PHE  22  -2.634   6.208   1.161
  149   2HB   PHE  22          HB1       PHE  22  -3.003   4.853   2.221
  150    HD1  PHE  22           HD1      PHE  22  -2.797   6.011  -1.214
  151    HD2  PHE  22           HD2      PHE  22  -3.959   2.792   1.313
  152    HE1  PHE  22           HE1      PHE  22  -2.853   4.508  -3.161
  153    HE2  PHE  22           HE2      PHE  22  -4.015   1.282  -0.628
  154    HZ   PHE  22           HZ       PHE  22  -3.451   2.145  -2.873
  155    H    LYS  23           HN       LYS  23  -3.671   8.247   0.948
  156    HA   LYS  23           HA       LYS  23  -5.543   8.565  -1.285
  157   1HB   LYS  23          HB2       LYS  23  -5.264  11.068  -0.913
  158   2HB   LYS  23          HB1       LYS  23  -6.298  10.185   0.210
  159   1HG   LYS  23          HG2       LYS  23  -5.007  11.610   1.545
  160   2HG   LYS  23          HG1       LYS  23  -4.268  10.018   1.707
  161   1HD   LYS  23          HD2       LYS  23  -2.706  10.698  -0.145
  162   2HD   LYS  23          HD1       LYS  23  -3.311  12.343   0.068
  163   1HE   LYS  23          HE2       LYS  23  -2.609  12.283   2.421
  164   2HE   LYS  23          HE1       LYS  23  -1.983  10.651   2.187
  165   1HZ   LYS  23          HZ1       LYS  23  -0.423  11.531   0.557
  166   2HZ   LYS  23          HZ2       LYS  23  -0.221  12.288   2.055
  167   3HZ   LYS  23          HZ3       LYS  23  -1.019  13.096   0.802
  168    H    GLU  24           HN       GLU  24  -4.569  10.789  -2.416
  169    HA   GLU  24           HA       GLU  24  -2.356   9.809  -3.907
  170   1HB   GLU  24          HB2       GLU  24  -2.444  12.089  -4.969
  171   2HB   GLU  24          HB1       GLU  24  -3.958  11.193  -5.019
  172   1HG   GLU  24          HG2       GLU  24  -5.002  12.837  -3.979
  173   2HG   GLU  24          HG1       GLU  24  -3.879  12.711  -2.621
  174    H    GLY  25           HN       GLY  25  -0.270  10.021  -3.518
  175   1HA   GLY  25          HA2       GLY  25   1.708  11.141  -2.913
  176   2HA   GLY  25          HA1       GLY  25   0.740  12.317  -2.037
  177    H    ASP  26           HN       ASP  26  -0.533   9.521  -1.066
  178    HA   ASP  26           HA       ASP  26   0.728   9.626   1.485
  179   1HB   ASP  26          HB2       ASP  26  -1.634   8.989   1.214
  180   2HB   ASP  26          HB1       ASP  26  -1.142   7.536   0.349
  181    H    ILE  27           HN       ILE  27   2.553   8.705   2.098
  182    HA   ILE  27           HA       ILE  27   3.747   6.623   0.427
  183    HB   ILE  27           HB       ILE  27   4.948   8.145   2.745
  184   1HG1  ILE  27          HG12      ILE  27   5.424   8.498  -0.222
  185   2HG1  ILE  27          HG11      ILE  27   4.389   9.542   0.747
  186   1HG2  ILE  27          HG21      ILE  27   7.087   7.259   1.936
  187   2HG2  ILE  27          HG22      ILE  27   6.230   6.325   0.710
  188   3HG2  ILE  27          HG23      ILE  27   5.986   5.967   2.420
  189   1HD1  ILE  27          HD11      ILE  27   6.331  10.149   2.121
  190   2HD1  ILE  27          HD12      ILE  27   6.544  10.569   0.421
  191   3HD1  ILE  27          HD13      ILE  27   7.352   9.150   1.087
  192    H    ILE  28           HN       ILE  28   3.588   4.551   0.975
  193    HA   ILE  28           HA       ILE  28   2.943   3.879   3.772
  194    HB   ILE  28           HB       ILE  28   2.453   2.175   1.328
  195   1HG1  ILE  28          HG12      ILE  28   0.423   3.789   2.881
  196   2HG1  ILE  28          HG11      ILE  28   1.137   4.323   1.364
  197   1HG2  ILE  28          HG21      ILE  28   2.676   0.930   3.416
  198   2HG2  ILE  28          HG22      ILE  28   1.019   0.876   2.817
  199   3HG2  ILE  28          HG23      ILE  28   1.437   1.941   4.158
  200   1HD1  ILE  28          HD11      ILE  28  -0.526   1.846   1.759
  201   2HD1  ILE  28          HD12      ILE  28   0.193   2.374   0.237
  202   3HD1  ILE  28          HD13      ILE  28  -1.056   3.352   1.008
  203    H    THR  29           HN       THR  29   4.106   2.320   4.853
  204    HA   THR  29           HA       THR  29   6.655   1.566   3.618
  205    HB   THR  29           HB       THR  29   7.315   0.869   5.919
  206    HG1  THR  29           HG1      THR  29   4.780   0.875   6.399
  207   1HG2  THR  29          HG21      THR  29   6.291   3.699   5.653
  208   2HG2  THR  29          HG22      THR  29   7.872   3.105   5.146
  209   3HG2  THR  29          HG23      THR  29   7.454   3.148   6.859
  210    H    LEU  30           HN       LEU  30   6.675  -0.344   2.591
  211    HA   LEU  30           HA       LEU  30   4.820  -2.420   3.423
  212   1HB   LEU  30          HB2       LEU  30   5.393  -3.513   1.366
  213   2HB   LEU  30          HB1       LEU  30   4.954  -1.835   1.075
  214    HG   LEU  30           HG       LEU  30   7.833  -2.279   1.407
  215   1HD1  LEU  30          HD11      LEU  30   8.132  -3.232  -0.829
  216   2HD1  LEU  30          HD12      LEU  30   6.387  -3.443  -0.969
  217   3HD1  LEU  30          HD13      LEU  30   7.290  -4.346   0.248
  218   1HD2  LEU  30          HD21      LEU  30   6.886  -0.143   0.729
  219   2HD2  LEU  30          HD22      LEU  30   6.145  -0.905  -0.679
  220   3HD2  LEU  30          HD23      LEU  30   7.901  -0.808  -0.551
  221    H    THR  31           HN       THR  31   5.359  -4.433   4.021
  222    HA   THR  31           HA       THR  31   7.991  -5.459   4.024
  223    HB   THR  31           HB       THR  31   8.076  -3.793   5.887
  224    HG1  THR  31           HG1      THR  31   9.586  -5.375   6.054
  225   1HG2  THR  31          HG21      THR  31   7.011  -4.390   8.018
  226   2HG2  THR  31          HG22      THR  31   6.204  -5.746   7.231
  227   3HG2  THR  31          HG23      THR  31   5.813  -4.093   6.758
  228    H    ASN  32           HN       ASN  32   5.025  -5.949   3.543
  229    HA   ASN  32           HA       ASN  32   4.963  -8.697   4.496
  230   1HB   ASN  32          HB2       ASN  32   2.755  -6.665   4.851
  231   2HB   ASN  32          HB1       ASN  32   2.562  -8.394   5.100
  232   1HD2  ASN  32          HD21      ASN  32   2.293  -6.086   6.934
  233   2HD2  ASN  32          HD22      ASN  32   3.327  -6.444   8.271
  234    H    GLN  33           HN       GLN  33   2.754  -9.642   3.363
  235    HA   GLN  33           HA       GLN  33   1.956  -8.412   0.953
  236   1HB   GLN  33          HB2       GLN  33   4.459  -9.859   0.865
  237   2HB   GLN  33          HB1       GLN  33   3.279 -10.511  -0.271
  238   1HG   GLN  33          HG2       GLN  33   3.014  -8.462  -1.346
  239   2HG   GLN  33          HG1       GLN  33   3.833  -7.578  -0.044
  240   1HE2  GLN  33          HE21      GLN  33   4.232  -9.621  -2.841
  241   2HE2  GLN  33          HE22      GLN  33   5.932  -9.378  -3.033
  242    H    ILE  34           HN       ILE  34   0.486  -9.533  -0.252
  243    HA   ILE  34           HA       ILE  34  -0.619 -11.887   1.065
  244    HB   ILE  34           HB       ILE  34  -1.858  -9.913  -0.853
  245   1HG1  ILE  34          HG12      ILE  34  -1.633  -9.199   1.508
  246   2HG1  ILE  34          HG11      ILE  34  -3.313  -9.354   1.009
  247   1HG2  ILE  34          HG21      ILE  34  -3.060 -12.436   0.289
  248   2HG2  ILE  34          HG22      ILE  34  -2.708 -12.106  -1.408
  249   3HG2  ILE  34          HG23      ILE  34  -3.957 -11.185  -0.571
  250   1HD1  ILE  34          HD11      ILE  34  -1.749 -11.299   2.691
  251   2HD1  ILE  34          HD12      ILE  34  -3.401 -11.549   2.127
  252   3HD1  ILE  34          HD13      ILE  34  -3.038 -10.222   3.229
  253    H    ASP  35           HN       ASP  35   0.215 -10.634  -2.111
  254    HA   ASP  35           HA       ASP  35   1.179 -13.137  -3.027
  255   1HB   ASP  35          HB2       ASP  35  -0.438 -13.564  -4.809
  256   2HB   ASP  35          HB1       ASP  35  -1.226 -13.613  -3.236
  257    H    GLU  36           HN       GLU  36   1.095 -12.842  -5.728
  258    HA   GLU  36           HA       GLU  36   2.988 -10.768  -6.139
  259   1HB   GLU  36          HB2       GLU  36   1.581 -12.531  -8.144
  260   2HB   GLU  36          HB1       GLU  36   2.982 -11.522  -8.482
  261   1HG   GLU  36          HG2       GLU  36   4.296 -12.820  -6.879
  262   2HG   GLU  36          HG1       GLU  36   2.892 -13.839  -6.561
  263    H    ASN  37           HN       ASN  37  -0.330 -10.582  -5.962
  264    HA   ASN  37           HA       ASN  37  -0.538  -8.515  -8.027
  265   1HB   ASN  37          HB2       ASN  37  -2.692  -9.844  -6.375
  266   2HB   ASN  37          HB1       ASN  37  -2.974  -8.633  -7.620
  267   1HD2  ASN  37          HD21      ASN  37  -0.862  -9.682  -9.344
  268   2HD2  ASN  37          HD22      ASN  37  -1.491 -11.134 -10.036
  269    H    TRP  38           HN       TRP  38  -1.485  -8.943  -4.598
  270    HA   TRP  38           HA       TRP  38  -1.058  -6.051  -4.292
  271   1HB   TRP  38          HB2       TRP  38  -2.822  -6.415  -2.325
  272   2HB   TRP  38          HB1       TRP  38  -3.308  -6.056  -3.972
  273    HD1  TRP  38           HD1      TRP  38  -3.215  -8.929  -1.453
  274    HE1  TRP  38           HE1      TRP  38  -4.832 -10.766  -2.248
  275    HE3  TRP  38           HE3      TRP  38  -4.436  -7.007  -6.028
  276    HZ2  TRP  38           HZ2      TRP  38  -6.422 -11.322  -4.512
  277    HZ3  TRP  38           HZ3      TRP  38  -6.019  -8.249  -7.444
  278    HH2  TRP  38           HH2      TRP  38  -6.990 -10.361  -6.701
  279    H    TYR  39           HN       TYR  39   0.163  -5.318  -2.695
  280    HA   TYR  39           HA       TYR  39   1.633  -7.306  -1.108
  281   1HB   TYR  39          HB2       TYR  39   2.106  -4.402  -1.770
  282   2HB   TYR  39          HB1       TYR  39   3.050  -5.247  -0.553
  283    HD1  TYR  39           HD1      TYR  39   1.916  -6.929  -3.633
  284    HD2  TYR  39           HD2      TYR  39   5.137  -4.925  -1.701
  285    HE1  TYR  39           HE1      TYR  39   3.454  -7.735  -5.371
  286    HE2  TYR  39           HE2      TYR  39   6.682  -5.727  -3.438
  287    HH   TYR  39           HH       TYR  39   5.630  -7.098  -6.346
  288    H    GLU  40           HN       GLU  40   2.432  -6.156   1.058
  289    HA   GLU  40           HA       GLU  40   0.141  -4.960   2.407
  290   1HB   GLU  40          HB2       GLU  40   1.393  -7.578   3.098
  291   2HB   GLU  40          HB1       GLU  40   0.741  -6.572   4.382
  292   1HG   GLU  40          HG2       GLU  40  -1.414  -6.524   3.074
  293   2HG   GLU  40          HG1       GLU  40  -0.716  -7.787   2.061
  294    H    GLY  41           HN       GLY  41   0.597  -3.678   4.141
  295   1HA   GLY  41          HA2       GLY  41   3.178  -3.549   5.363
  296   2HA   GLY  41          HA1       GLY  41   2.927  -2.234   4.219
  297    H    MET  42           HN       MET  42   3.157  -0.883   6.202
  298    HA   MET  42           HA       MET  42   0.516  -0.523   7.422
  299   1HB   MET  42          HB2       MET  42   2.931  -0.144   9.145
  300   2HB   MET  42          HB1       MET  42   1.265  -0.479   9.611
  301   1HG   MET  42          HG2       MET  42   1.506  -2.776   8.829
  302   2HG   MET  42          HG1       MET  42   3.168  -2.442   8.346
  303   1HE   MET  42          HE1       MET  42   4.900  -1.767  11.792
  304   2HE   MET  42          HE2       MET  42   4.185  -0.573  10.708
  305   3HE   MET  42          HE3       MET  42   5.130  -1.908  10.049
  306    H    ILE  43           HN       ILE  43   0.097   1.549   8.235
  307    HA   ILE  43           HA       ILE  43   1.974   3.678   7.533
  308    HB   ILE  43           HB       ILE  43   0.547   3.590   5.597
  309   1HG1  ILE  43          HG12      ILE  43  -0.642   5.827   5.807
  310   2HG1  ILE  43          HG11      ILE  43  -0.139   5.835   7.496
  311   1HG2  ILE  43          HG21      ILE  43  -1.874   3.758   5.717
  312   2HG2  ILE  43          HG22      ILE  43  -1.800   3.781   7.478
  313   3HG2  ILE  43          HG23      ILE  43  -1.305   2.338   6.594
  314   1HD1  ILE  43          HD11      ILE  43   1.342   7.160   6.020
  315   2HD1  ILE  43          HD12      ILE  43   1.751   5.678   5.153
  316   3HD1  ILE  43          HD13      ILE  43   2.185   5.853   6.853
  317    H    HIS  44           HN       HIS  44   2.188   5.033   9.175
  318    HA   HIS  44           HA       HIS  44   1.810   6.222  11.072
  319   1HB   HIS  44          HB2       HIS  44  -0.235   7.004   9.906
  320   2HB   HIS  44          HB1       HIS  44  -1.120   5.643  10.586
  321    HD1  HIS  44           HD1      HIS  44   0.552   8.861  11.603
  322    HD2  HIS  44           HD2      HIS  44  -1.997   5.984  13.181
  323    HE1  HIS  44           HE1      HIS  44  -0.276   9.816  13.778
  324    HE2  HIS  44           HE2      HIS  44  -1.858   8.079  14.691
  325    H    GLY  45           HN       GLY  45  -0.877   3.894  11.350
  326   1HA   GLY  45          HA2       GLY  45   0.583   2.316  13.288
  327   2HA   GLY  45          HA1       GLY  45  -0.725   3.272  13.968
  328    H    GLU  46           HN       GLU  46  -0.874   1.875  10.748
  329    HA   GLU  46           HA       GLU  46  -2.554  -0.311  11.711
  330   1HB   GLU  46          HB2       GLU  46  -3.493   1.727   9.688
  331   2HB   GLU  46          HB1       GLU  46  -4.338   0.238  10.083
  332   1HG   GLU  46          HG2       GLU  46  -4.633   1.013  12.380
  333   2HG   GLU  46          HG1       GLU  46  -3.784   2.506  11.984
  334    H    SER  47           HN       SER  47  -2.743  -2.050  10.329
  335    HA   SER  47           HA       SER  47  -0.835  -2.047   8.089
  336   1HB   SER  47          HB2       SER  47  -1.908  -4.400   9.667
  337   2HB   SER  47          HB1       SER  47  -0.669  -4.465   8.413
  338    HG   SER  47           HG       SER  47  -0.493  -3.627  11.045
  339    H    GLY  48           HN       GLY  48  -1.387  -3.434   6.231
  340   1HA   GLY  48          HA2       GLY  48  -3.886  -4.512   5.690
  341   2HA   GLY  48          HA1       GLY  48  -3.973  -2.819   5.225
  342    H    PHE  49           HN       PHE  49  -4.388  -4.518   3.226
  343    HA   PHE  49           HA       PHE  49  -1.804  -4.833   1.865
  344   1HB   PHE  49          HB2       PHE  49  -2.869  -6.414   0.391
  345   2HB   PHE  49          HB1       PHE  49  -3.238  -6.857   2.051
  346    HD1  PHE  49           HD1      PHE  49  -4.587  -5.567  -1.091
  347    HD2  PHE  49           HD2      PHE  49  -5.488  -6.697   2.912
  348    HE1  PHE  49           HE1      PHE  49  -6.986  -5.565  -1.634
  349    HE2  PHE  49           HE2      PHE  49  -7.889  -6.702   2.374
  350    HZ   PHE  49           HZ       PHE  49  -8.638  -6.183   0.089
  351    H    PHE  50           HN       PHE  50  -1.581  -4.188  -0.343
  352    HA   PHE  50           HA       PHE  50  -3.599  -2.466  -1.481
  353   1HB   PHE  50          HB2       PHE  50  -1.904  -0.582  -1.759
  354   2HB   PHE  50          HB1       PHE  50  -2.598  -0.798  -0.157
  355    HD1  PHE  50           HD1      PHE  50   0.416  -0.754  -2.123
  356    HD2  PHE  50           HD2      PHE  50  -1.246  -1.923   1.617
  357    HE1  PHE  50           HE1      PHE  50   2.678  -0.902  -1.168
  358    HE2  PHE  50           HE2      PHE  50   1.014  -2.072   2.578
  359    HZ   PHE  50           HZ       PHE  50   2.980  -1.561   1.185
  360    HA   PRO  51           HA       PRO  51  -1.773  -4.810  -4.939
  361   1HB   PRO  51          HB2       PRO  51  -3.532  -3.374  -6.648
  362   2HB   PRO  51          HB1       PRO  51  -3.698  -5.038  -6.087
  363   1HG   PRO  51          HG2       PRO  51  -4.967  -2.568  -5.068
  364   2HG   PRO  51          HG1       PRO  51  -5.548  -4.241  -5.011
  365   1HD   PRO  51          HD2       PRO  51  -4.630  -2.984  -2.822
  366   2HD   PRO  51          HD1       PRO  51  -4.344  -4.724  -3.083
  367    H    ILE  52           HN       ILE  52  -0.310  -4.274  -6.468
  368    HA   ILE  52           HA       ILE  52   1.057  -1.830  -6.263
  369    HB   ILE  52           HB       ILE  52   1.197  -3.707  -8.620
  370   1HG1  ILE  52          HG12      ILE  52   2.760  -3.893  -6.037
  371   2HG1  ILE  52          HG11      ILE  52   1.376  -4.909  -6.425
  372   1HG2  ILE  52          HG21      ILE  52   2.378  -1.599  -8.905
  373   2HG2  ILE  52          HG22      ILE  52   3.521  -2.931  -8.743
  374   3HG2  ILE  52          HG23      ILE  52   3.228  -1.852  -7.380
  375   1HD1  ILE  52          HD11      ILE  52   2.580  -5.794  -8.360
  376   2HD1  ILE  52          HD12      ILE  52   3.452  -6.075  -6.854
  377   3HD1  ILE  52          HD13      ILE  52   3.970  -4.790  -7.945
  378    H    ASN  53           HN       ASN  53  -1.668  -2.750  -8.178
  379    HA   ASN  53           HA       ASN  53  -1.347  -0.799 -10.227
  380   1HB   ASN  53          HB2       ASN  53  -3.706  -2.450  -9.325
  381   2HB   ASN  53          HB1       ASN  53  -3.754  -1.364 -10.705
  382   1HD2  ASN  53          HD21      ASN  53  -2.593  -1.870 -12.558
  383   2HD2  ASN  53          HD22      ASN  53  -1.977  -3.457 -12.849
  384    H    TYR  54           HN       TYR  54  -1.569  -0.110  -7.164
  385    HA   TYR  54           HA       TYR  54  -3.303   2.217  -7.622
  386   1HB   TYR  54          HB2       TYR  54  -3.316   0.367  -5.246
  387   2HB   TYR  54          HB1       TYR  54  -3.928   2.014  -5.143
  388    HD1  TYR  54           HD1      TYR  54  -6.000   2.642  -6.230
  389    HD2  TYR  54           HD2      TYR  54  -4.485  -1.318  -6.566
  390    HE1  TYR  54           HE1      TYR  54  -8.177   1.890  -7.093
  391    HE2  TYR  54           HE2      TYR  54  -6.656  -2.082  -7.430
  392    HH   TYR  54           HH       TYR  54  -9.083   0.055  -8.457
  393    H    VAL  55           HN       VAL  55  -0.312   1.023  -6.729
  394    HA   VAL  55           HA       VAL  55   0.488   3.664  -5.742
  395    HB   VAL  55           HB       VAL  55   1.935   2.699  -4.015
  396   1HG1  VAL  55          HG11      VAL  55  -0.657   3.233  -3.758
  397   2HG1  VAL  55          HG12      VAL  55   0.308   2.606  -2.423
  398   3HG1  VAL  55          HG13      VAL  55  -0.712   1.516  -3.361
  399   1HG2  VAL  55          HG21      VAL  55   0.625   0.080  -4.761
  400   2HG2  VAL  55          HG22      VAL  55   1.659   0.337  -3.356
  401   3HG2  VAL  55          HG23      VAL  55   2.322   0.508  -4.982
  402    H    GLU  56           HN       GLU  56   2.975   3.701  -5.544
  403    HA   GLU  56           HA       GLU  56   4.224   2.156  -7.703
  404   1HB   GLU  56          HB2       GLU  56   3.597   4.397  -8.567
  405   2HB   GLU  56          HB1       GLU  56   4.557   5.135  -7.293
  406   1HG   GLU  56          HG2       GLU  56   6.576   4.183  -8.204
  407   2HG   GLU  56          HG1       GLU  56   5.647   3.308  -9.420
  408    H    VAL  57           HN       VAL  57   5.512   0.910  -6.469
  409    HA   VAL  57           HA       VAL  57   6.708   1.654  -4.056
  410    HB   VAL  57           HB       VAL  57   7.637  -0.461  -6.006
  411   1HG1  VAL  57          HG11      VAL  57   9.363   0.071  -4.385
  412   2HG1  VAL  57          HG12      VAL  57   8.662  -1.507  -4.027
  413   3HG1  VAL  57          HG13      VAL  57   8.206  -0.102  -3.064
  414   1HG2  VAL  57          HG21      VAL  57   6.328  -2.006  -4.632
  415   2HG2  VAL  57          HG22      VAL  57   5.305  -0.760  -5.349
  416   3HG2  VAL  57          HG23      VAL  57   5.762  -0.655  -3.650
  417    H    ILE  58           HN       ILE  58   8.215   3.105  -3.694
  418    HA   ILE  58           HA       ILE  58   9.803   4.277  -5.736
  419    HB   ILE  58           HB       ILE  58  10.178   4.464  -2.744
  420   1HG1  ILE  58          HG12      ILE  58   8.628   6.313  -4.572
  421   2HG1  ILE  58          HG11      ILE  58   7.886   5.091  -3.543
  422   1HG2  ILE  58          HG21      ILE  58  11.093   6.271  -4.979
  423   2HG2  ILE  58          HG22      ILE  58  12.117   5.222  -3.999
  424   3HG2  ILE  58          HG23      ILE  58  11.289   6.590  -3.256
  425   1HD1  ILE  58          HD11      ILE  58   9.524   7.430  -2.593
  426   2HD1  ILE  58          HD12      ILE  58   8.761   6.214  -1.569
  427   3HD1  ILE  58          HD13      ILE  58   7.765   7.299  -2.538
  428    H    VAL  59           HN       VAL  59  10.563   2.086  -3.038
  429    HA   VAL  59           HA       VAL  59  13.203   1.603  -4.237
  430    HB   VAL  59           HB       VAL  59  12.224   0.961  -1.452
  431   1HG1  VAL  59          HG11      VAL  59  14.953   0.658  -2.700
  432   2HG1  VAL  59          HG12      VAL  59  13.890  -0.641  -2.164
  433   3HG1  VAL  59          HG13      VAL  59  14.596   0.463  -0.985
  434   1HG2  VAL  59          HG21      VAL  59  14.120   3.094  -2.427
  435   2HG2  VAL  59          HG22      VAL  59  13.741   2.747  -0.741
  436   3HG2  VAL  59          HG23      VAL  59  12.486   3.355  -1.819
  437    HA   PRO  60           HA       PRO  60  11.221  -2.202  -5.757
  438   1HB   PRO  60          HB2       PRO  60  14.050  -2.670  -6.558
  439   2HB   PRO  60          HB1       PRO  60  12.571  -2.818  -7.512
  440   1HG   PRO  60          HG2       PRO  60  14.203  -0.746  -7.857
  441   2HG   PRO  60          HG1       PRO  60  12.442  -0.538  -7.915
  442   1HD   PRO  60          HD2       PRO  60  14.366   0.159  -5.739
  443   2HD   PRO  60          HD1       PRO  60  12.910   1.020  -6.279
  Start of MODEL    2
    1   1H    MET   1          HT1       MET   1  20.902   2.681   2.810
    2   2H    MET   1          HT2       MET   1  20.354   1.796   1.476
    3   3H    MET   1          HT3       MET   1  21.820   1.390   2.216
    4    HA   MET   1           HA       MET   1  20.054  -0.156   2.806
    5   1HB   MET   1          HB2       MET   1  21.974   0.547   4.363
    6   2HB   MET   1          HB1       MET   1  20.772   1.506   5.215
    7   1HG   MET   1          HG2       MET   1  21.095  -0.614   6.318
    8   2HG   MET   1          HG1       MET   1  19.468  -0.515   5.646
    9   1HE   MET   1          HE1       MET   1  22.891  -2.970   3.759
   10   2HE   MET   1          HE2       MET   1  23.044  -2.104   5.288
   11   3HE   MET   1          HE3       MET   1  22.860  -1.207   3.781
   12    H    ASP   2           HN       ASP   2  18.566   2.030   1.738
   13    HA   ASP   2           HA       ASP   2  16.705   2.951   3.724
   14   1HB   ASP   2          HB2       ASP   2  17.200   4.339   1.780
   15   2HB   ASP   2          HB1       ASP   2  16.608   3.078   0.702
   16    H    GLN   3           HN       GLN   3  14.751   2.148   4.250
   17    HA   GLN   3           HA       GLN   3  14.143  -0.550   3.613
   18   1HB   GLN   3          HB2       GLN   3  12.105  -0.182   4.944
   19   2HB   GLN   3          HB1       GLN   3  13.542   0.405   5.770
   20   1HG   GLN   3          HG2       GLN   3  13.005   2.679   5.191
   21   2HG   GLN   3          HG1       GLN   3  11.635   2.142   4.221
   22   1HE2  GLN   3          HE21      GLN   3  11.724   3.946   6.518
   23   2HE2  GLN   3          HE22      GLN   3  10.655   3.270   7.695
   24    HA   PRO   4           HA       PRO   4  11.670  -0.132  -0.020
   25   1HB   PRO   4          HB2       PRO   4   9.853  -2.125   0.325
   26   2HB   PRO   4          HB1       PRO   4  11.540  -2.423  -0.106
   27   1HG   PRO   4          HG2       PRO   4  10.214  -2.578   2.573
   28   2HG   PRO   4          HG1       PRO   4  11.387  -3.688   1.840
   29   1HD   PRO   4          HD2       PRO   4  12.100  -1.845   3.680
   30   2HD   PRO   4          HD1       PRO   4  13.183  -2.337   2.362
   31    H    CYS   5           HN       CYS   5  10.230   1.410  -0.445
   32    HA   CYS   5           HA       CYS   5   7.767   1.539   1.144
   33   1HB   CYS   5          HB2       CYS   5   9.515   3.903   0.438
   34   2HB   CYS   5          HB1       CYS   5   7.915   4.014   1.164
   35    HG   CYS   5           HG       CYS   5  10.829   2.994   2.579
   36    H    CYS   6           HN       CYS   6   6.298   3.340   0.036
   37    HA   CYS   6           HA       CYS   6   6.529   3.498  -2.816
   38   1HB   CYS   6          HB2       CYS   6   4.662   2.165  -3.444
   39   2HB   CYS   6          HB1       CYS   6   5.674   1.166  -2.419
   40    HG   CYS   6           HG       CYS   6   2.536   1.570  -2.141
   41    H    ARG   7           HN       ARG   7   4.343   4.356  -3.734
   42    HA   ARG   7           HA       ARG   7   3.034   6.132  -1.801
   43   1HB   ARG   7          HB2       ARG   7   4.399   7.039  -4.337
   44   2HB   ARG   7          HB1       ARG   7   3.253   8.028  -3.442
   45   1HG   ARG   7          HG2       ARG   7   4.727   7.939  -1.482
   46   2HG   ARG   7          HG1       ARG   7   5.884   6.986  -2.413
   47   1HD   ARG   7          HD2       ARG   7   6.146   8.817  -3.994
   48   2HD   ARG   7          HD1       ARG   7   4.949   9.767  -3.114
   49    HE   ARG   7           HE       ARG   7   6.917   9.111  -1.288
   50   1HH1  ARG   7          HH11      ARG   7   6.691  10.879  -4.282
   51   2HH1  ARG   7          HH12      ARG   7   7.978  11.968  -3.885
   52   1HH2  ARG   7          HH21      ARG   7   8.613  10.542  -0.758
   53   2HH2  ARG   7          HH22      ARG   7   9.074  11.773  -1.886
   54    H    GLY   8           HN       GLY   8   0.904   6.438  -2.166
   55   1HA   GLY   8          HA2       GLY   8  -0.354   4.864  -4.221
   56   2HA   GLY   8          HA1       GLY   8  -1.168   5.851  -3.018
   57    H    LEU   9           HN       LEU   9  -1.019   5.473  -6.165
   58    HA   LEU   9           HA       LEU   9  -0.563   8.159  -7.070
   59   1HB   LEU   9          HB2       LEU   9  -1.657   5.692  -8.401
   60   2HB   LEU   9          HB1       LEU   9  -1.590   7.239  -9.220
   61    HG   LEU   9           HG       LEU   9   0.288   5.882  -9.889
   62   1HD1  LEU   9          HD11      LEU   9   2.118   7.390  -9.349
   63   2HD1  LEU   9          HD12      LEU   9   1.171   8.087  -8.034
   64   3HD1  LEU   9          HD13      LEU   9   0.643   8.289  -9.706
   65   1HD2  LEU   9          HD21      LEU   9   1.045   5.786  -6.971
   66   2HD2  LEU   9          HD22      LEU   9   1.975   5.123  -8.314
   67   3HD2  LEU   9          HD23      LEU   9   0.400   4.441  -7.912
   68    H    TYR  10           HN       TYR  10  -3.330   6.174  -6.275
   69    HA   TYR  10           HA       TYR  10  -5.040   8.560  -6.504
   70   1HB   TYR  10          HB2       TYR  10  -5.929   5.747  -7.146
   71   2HB   TYR  10          HB1       TYR  10  -6.857   7.230  -7.338
   72    HD1  TYR  10           HD1      TYR  10  -4.735   4.898  -8.951
   73    HD2  TYR  10           HD2      TYR  10  -5.876   8.996  -8.974
   74    HE1  TYR  10           HE1      TYR  10  -3.909   5.109 -11.257
   75    HE2  TYR  10           HE2      TYR  10  -5.055   9.218 -11.282
   76    HH   TYR  10           HH       TYR  10  -3.461   8.106 -12.784
   77    H    ASP  11           HN       ASP  11  -6.705   8.756  -4.988
   78    HA   ASP  11           HA       ASP  11  -6.132   7.758  -2.419
   79   1HB   ASP  11          HB2       ASP  11  -8.430   8.736  -1.872
   80   2HB   ASP  11          HB1       ASP  11  -7.208   9.835  -2.490
   81    H    PHE  12           HN       PHE  12  -7.821   6.728  -1.034
   82    HA   PHE  12           HA       PHE  12  -9.653   4.895  -2.249
   83   1HB   PHE  12          HB2       PHE  12  -7.026   4.002  -2.111
   84   2HB   PHE  12          HB1       PHE  12  -7.821   3.273  -0.720
   85    HD1  PHE  12           HD1      PHE  12  -8.157   3.703  -4.390
   86    HD2  PHE  12           HD2      PHE  12  -9.129   1.380  -0.961
   87    HE1  PHE  12           HE1      PHE  12  -9.144   1.980  -5.842
   88    HE2  PHE  12           HE2      PHE  12 -10.115  -0.350  -2.406
   89    HZ   PHE  12           HZ       PHE  12 -10.123  -0.050  -4.851
   90    H    GLU  13           HN       GLU  13 -11.301   4.896  -0.911
   91    HA   GLU  13           HA       GLU  13 -10.904   5.414   1.927
   92   1HB   GLU  13          HB2       GLU  13 -12.647   6.644   0.660
   93   2HB   GLU  13          HB1       GLU  13 -13.463   5.121   0.339
   94   1HG   GLU  13          HG2       GLU  13 -14.609   6.153   2.124
   95   2HG   GLU  13          HG1       GLU  13 -13.681   4.824   2.818
   96    HA   PRO  14           HA       PRO  14 -10.735   0.963   2.694
   97   1HB   PRO  14          HB2       PRO  14 -11.549   2.011   5.376
   98   2HB   PRO  14          HB1       PRO  14 -10.315   0.813   4.965
   99   1HG   PRO  14          HG2       PRO  14  -9.626   3.305   5.586
  100   2HG   PRO  14          HG1       PRO  14  -8.787   2.420   4.300
  101   1HD   PRO  14          HD2       PRO  14 -10.763   4.632   4.098
  102   2HD   PRO  14          HD1       PRO  14  -9.412   4.221   3.024
  103    H    GLU  15           HN       GLU  15 -12.303  -0.474   2.371
  104    HA   GLU  15           HA       GLU  15 -14.984   0.049   3.442
  105   1HB   GLU  15          HB2       GLU  15 -16.038  -0.648   1.380
  106   2HB   GLU  15          HB1       GLU  15 -14.945   0.688   1.050
  107   1HG   GLU  15          HG2       GLU  15 -14.283  -2.211   0.589
  108   2HG   GLU  15          HG1       GLU  15 -14.885  -1.110  -0.648
  109    H    ASN  16           HN       ASN  16 -12.523  -2.191   2.438
  110    HA   ASN  16           HA       ASN  16 -14.086  -4.424   3.550
  111   1HB   ASN  16          HB2       ASN  16 -13.463  -4.817   1.243
  112   2HB   ASN  16          HB1       ASN  16 -11.780  -4.431   1.592
  113   1HD2  ASN  16          HD21      ASN  16 -10.522  -5.903   2.739
  114   2HD2  ASN  16          HD22      ASN  16 -10.983  -7.560   2.910
  115    H    GLN  17           HN       GLN  17 -13.391  -5.425   5.335
  116    HA   GLN  17           HA       GLN  17 -11.374  -4.329   6.944
  117   1HB   GLN  17          HB2       GLN  17 -12.800  -6.984   7.039
  118   2HB   GLN  17          HB1       GLN  17 -11.628  -6.499   8.255
  119   1HG   GLN  17          HG2       GLN  17 -13.865  -6.065   9.034
  120   2HG   GLN  17          HG1       GLN  17 -13.003  -4.547   8.794
  121   1HE2  GLN  17          HE21      GLN  17 -15.551  -6.614   7.658
  122   2HE2  GLN  17          HE22      GLN  17 -16.311  -5.455   6.627
  123    H    GLY  18           HN       GLY  18  -9.238  -4.540   6.914
  124   1HA   GLY  18          HA2       GLY  18  -7.316  -6.042   6.926
  125   2HA   GLY  18          HA1       GLY  18  -8.088  -6.933   5.623
  126    H    GLU  19           HN       GLU  19  -8.899  -4.360   4.325
  127    HA   GLU  19           HA       GLU  19  -6.541  -4.058   2.718
  128   1HB   GLU  19          HB2       GLU  19  -8.995  -3.954   1.947
  129   2HB   GLU  19          HB1       GLU  19  -8.984  -2.311   2.570
  130   1HG   GLU  19          HG2       GLU  19  -7.135  -1.759   1.063
  131   2HG   GLU  19          HG1       GLU  19  -7.190  -3.399   0.417
  132    H    LEU  20           HN       LEU  20  -5.725  -1.846   2.145
  133    HA   LEU  20           HA       LEU  20  -5.491  -0.220   4.592
  134   1HB   LEU  20          HB2       LEU  20  -3.405  -1.324   3.825
  135   2HB   LEU  20          HB1       LEU  20  -3.526  -0.447   2.313
  136    HG   LEU  20           HG       LEU  20  -3.342   1.686   3.588
  137   1HD1  LEU  20          HD11      LEU  20  -2.769  -0.163   5.901
  138   2HD1  LEU  20          HD12      LEU  20  -4.151   0.923   5.743
  139   3HD1  LEU  20          HD13      LEU  20  -2.523   1.583   5.901
  140   1HD2  LEU  20          HD21      LEU  20  -1.396   0.686   2.517
  141   2HD2  LEU  20          HD22      LEU  20  -1.081  -0.273   3.964
  142   3HD2  LEU  20          HD23      LEU  20  -0.946   1.485   4.024
  143    H    GLY  21           HN       GLY  21  -5.957   1.907   4.536
  144   1HA   GLY  21          HA2       GLY  21  -6.977   2.974   1.991
  145   2HA   GLY  21          HA1       GLY  21  -7.386   3.576   3.590
  146    H    PHE  22           HN       PHE  22  -6.390   5.023   1.230
  147    HA   PHE  22           HA       PHE  22  -4.568   6.742   2.523
  148   1HB   PHE  22          HB2       PHE  22  -2.578   6.336   1.052
  149   2HB   PHE  22          HB1       PHE  22  -2.902   5.038   2.196
  150    HD1  PHE  22           HD1      PHE  22  -2.914   6.019  -1.327
  151    HD2  PHE  22           HD2      PHE  22  -3.662   2.877   1.443
  152    HE1  PHE  22           HE1      PHE  22  -2.948   4.399  -3.180
  153    HE2  PHE  22           HE2      PHE  22  -3.698   1.251  -0.404
  154    HZ   PHE  22           HZ       PHE  22  -3.340   2.012  -2.719
  155    H    LYS  23           HN       LYS  23  -3.933   8.549   1.212
  156    HA   LYS  23           HA       LYS  23  -5.655   8.869  -1.139
  157   1HB   LYS  23          HB2       LYS  23  -5.196  11.355  -0.745
  158   2HB   LYS  23          HB1       LYS  23  -6.298  10.530   0.357
  159   1HG   LYS  23          HG2       LYS  23  -3.410  10.701   1.036
  160   2HG   LYS  23          HG1       LYS  23  -4.442  12.112   1.278
  161   1HD   LYS  23          HD2       LYS  23  -5.355   9.467   2.295
  162   2HD   LYS  23          HD1       LYS  23  -4.097  10.326   3.188
  163   1HE   LYS  23          HE2       LYS  23  -6.266  10.881   4.100
  164   2HE   LYS  23          HE1       LYS  23  -5.573  12.298   3.313
  165   1HZ   LYS  23          HZ1       LYS  23  -6.968  11.902   1.402
  166   2HZ   LYS  23          HZ2       LYS  23  -7.927  12.003   2.791
  167   3HZ   LYS  23          HZ3       LYS  23  -7.597  10.495   2.099
  168    H    GLU  24           HN       GLU  24  -4.709  10.758  -2.561
  169    HA   GLU  24           HA       GLU  24  -2.440   9.736  -3.868
  170   1HB   GLU  24          HB2       GLU  24  -2.538  11.829  -5.178
  171   2HB   GLU  24          HB1       GLU  24  -4.120  11.073  -5.020
  172   1HG   GLU  24          HG2       GLU  24  -4.089  12.708  -2.858
  173   2HG   GLU  24          HG1       GLU  24  -3.150  13.647  -4.022
  174    H    GLY  25           HN       GLY  25  -0.319  10.264  -3.787
  175   1HA   GLY  25          HA2       GLY  25   1.618  11.389  -3.181
  176   2HA   GLY  25          HA1       GLY  25   0.630  12.585  -2.362
  177    H    ASP  26           HN       ASP  26  -0.512   9.807  -1.171
  178    HA   ASP  26           HA       ASP  26   0.838  10.130   1.325
  179   1HB   ASP  26          HB2       ASP  26  -1.549   9.422   1.097
  180   2HB   ASP  26          HB1       ASP  26  -0.987   7.873   0.473
  181    H    ILE  27           HN       ILE  27   2.214   8.686   2.392
  182    HA   ILE  27           HA       ILE  27   3.651   6.836   0.604
  183    HB   ILE  27           HB       ILE  27   4.689   8.209   3.087
  184   1HG1  ILE  27          HG12      ILE  27   5.357   8.725   0.180
  185   2HG1  ILE  27          HG11      ILE  27   4.294   9.734   1.154
  186   1HG2  ILE  27          HG21      ILE  27   6.875   7.342   2.373
  187   2HG2  ILE  27          HG22      ILE  27   6.089   6.481   1.048
  188   3HG2  ILE  27          HG23      ILE  27   5.732   6.045   2.719
  189   1HD1  ILE  27          HD11      ILE  27   7.222   9.244   1.646
  190   2HD1  ILE  27          HD12      ILE  27   6.163  10.227   2.658
  191   3HD1  ILE  27          HD13      ILE  27   6.497  10.714   0.996
  192    H    ILE  28           HN       ILE  28   3.842   4.743   1.136
  193    HA   ILE  28           HA       ILE  28   2.922   3.889   3.805
  194    HB   ILE  28           HB       ILE  28   2.414   2.454   1.195
  195   1HG1  ILE  28          HG12      ILE  28   1.026   4.488   1.479
  196   2HG1  ILE  28          HG11      ILE  28   0.068   3.012   1.514
  197   1HG2  ILE  28          HG21      ILE  28   2.731   0.901   3.019
  198   2HG2  ILE  28          HG22      ILE  28   1.029   0.945   2.561
  199   3HG2  ILE  28          HG23      ILE  28   1.572   1.787   4.011
  200   1HD1  ILE  28          HD11      ILE  28   0.912   4.638   3.900
  201   2HD1  ILE  28          HD12      ILE  28  -0.016   3.140   3.958
  202   3HD1  ILE  28          HD13      ILE  28  -0.700   4.572   3.189
  203    H    THR  29           HN       THR  29   4.085   2.258   4.792
  204    HA   THR  29           HA       THR  29   6.669   1.658   3.585
  205    HB   THR  29           HB       THR  29   7.298   0.744   5.748
  206    HG1  THR  29           HG1      THR  29   5.408  -0.198   6.463
  207   1HG2  THR  29          HG21      THR  29   7.445   3.172   5.458
  208   2HG2  THR  29          HG22      THR  29   7.067   2.751   7.129
  209   3HG2  THR  29          HG23      THR  29   5.796   3.346   6.059
  210    H    LEU  30           HN       LEU  30   7.175  -0.237   2.664
  211    HA   LEU  30           HA       LEU  30   5.145  -2.346   2.649
  212   1HB   LEU  30          HB2       LEU  30   6.406  -1.279   0.585
  213   2HB   LEU  30          HB1       LEU  30   7.635  -2.455   1.008
  214    HG   LEU  30           HG       LEU  30   4.767  -3.154   0.382
  215   1HD1  LEU  30          HD11      LEU  30   7.226  -3.307  -1.355
  216   2HD1  LEU  30          HD12      LEU  30   5.849  -2.229  -1.580
  217   3HD1  LEU  30          HD13      LEU  30   5.643  -3.970  -1.759
  218   1HD2  LEU  30          HD21      LEU  30   5.828  -4.799   1.801
  219   2HD2  LEU  30          HD22      LEU  30   7.235  -4.852   0.738
  220   3HD2  LEU  30          HD23      LEU  30   5.674  -5.440   0.165
  221    H    THR  31           HN       THR  31   5.387  -4.198   3.741
  222    HA   THR  31           HA       THR  31   7.910  -5.405   4.195
  223    HB   THR  31           HB       THR  31   8.145  -3.711   5.908
  224    HG1  THR  31           HG1      THR  31   8.365  -6.251   6.312
  225   1HG2  THR  31          HG21      THR  31   6.588  -3.431   7.715
  226   2HG2  THR  31          HG22      THR  31   5.606  -4.777   7.140
  227   3HG2  THR  31          HG23      THR  31   5.700  -3.290   6.198
  228    H    ASN  32           HN       ASN  32   4.990  -5.798   3.391
  229    HA   ASN  32           HA       ASN  32   4.721  -8.440   4.544
  230   1HB   ASN  32          HB2       ASN  32   2.648  -6.269   4.791
  231   2HB   ASN  32          HB1       ASN  32   2.283  -7.973   4.992
  232   1HD2  ASN  32          HD21      ASN  32   3.708  -5.175   6.392
  233   2HD2  ASN  32          HD22      ASN  32   4.032  -5.851   7.949
  234    H    GLN  33           HN       GLN  33   2.503  -9.353   3.455
  235    HA   GLN  33           HA       GLN  33   1.772  -8.300   0.946
  236   1HB   GLN  33          HB2       GLN  33   4.205  -9.885   1.001
  237   2HB   GLN  33          HB1       GLN  33   2.998 -10.529  -0.112
  238   1HG   GLN  33          HG2       GLN  33   2.889  -8.560  -1.326
  239   2HG   GLN  33          HG1       GLN  33   3.692  -7.622  -0.053
  240   1HE2  GLN  33          HE21      GLN  33   4.805 -10.774  -1.077
  241   2HE2  GLN  33          HE22      GLN  33   6.252 -10.234  -1.850
  242    H    ILE  34           HN       ILE  34   0.234  -9.484  -0.150
  243    HA   ILE  34           HA       ILE  34  -0.794 -11.795   1.329
  244    HB   ILE  34           HB       ILE  34  -2.394  -9.799  -0.274
  245   1HG1  ILE  34          HG12      ILE  34  -1.534  -8.796   1.782
  246   2HG1  ILE  34          HG11      ILE  34  -3.270  -9.053   1.907
  247   1HG2  ILE  34          HG21      ILE  34  -3.287 -12.100   1.462
  248   2HG2  ILE  34          HG22      ILE  34  -3.399 -12.008  -0.296
  249   3HG2  ILE  34          HG23      ILE  34  -4.351 -10.914   0.707
  250   1HD1  ILE  34          HD11      ILE  34  -2.143  -9.619   3.979
  251   2HD1  ILE  34          HD12      ILE  34  -1.135 -10.789   3.129
  252   3HD1  ILE  34          HD13      ILE  34  -2.876 -11.050   3.255
  253    H    ASP  35           HN       ASP  35  -0.014 -10.489  -1.789
  254    HA   ASP  35           HA       ASP  35  -0.032 -13.130  -2.942
  255   1HB   ASP  35          HB2       ASP  35  -2.388 -12.418  -3.213
  256   2HB   ASP  35          HB1       ASP  35  -1.843 -11.004  -4.108
  257    H    GLU  36           HN       GLU  36   0.658 -12.997  -5.323
  258    HA   GLU  36           HA       GLU  36   3.084 -11.609  -5.482
  259   1HB   GLU  36          HB2       GLU  36   1.482 -12.688  -7.804
  260   2HB   GLU  36          HB1       GLU  36   3.218 -12.405  -7.756
  261   1HG   GLU  36          HG2       GLU  36   1.691 -14.460  -6.176
  262   2HG   GLU  36          HG1       GLU  36   2.755 -14.759  -7.549
  263    H    ASN  37           HN       ASN  37  -0.146 -10.687  -6.339
  264    HA   ASN  37           HA       ASN  37   0.825  -8.335  -7.796
  265   1HB   ASN  37          HB2       ASN  37  -1.965  -9.471  -7.518
  266   2HB   ASN  37          HB1       ASN  37  -1.555  -8.027  -8.439
  267   1HD2  ASN  37          HD21      ASN  37  -0.396  -8.229 -10.356
  268   2HD2  ASN  37          HD22      ASN  37  -0.261  -9.737 -11.188
  269    H    TRP  38           HN       TRP  38  -1.094  -9.271  -4.979
  270    HA   TRP  38           HA       TRP  38  -1.383  -6.461  -4.228
  271   1HB   TRP  38          HB2       TRP  38  -2.470  -8.668  -2.536
  272   2HB   TRP  38          HB1       TRP  38  -3.116  -7.056  -2.825
  273    HD1  TRP  38           HD1      TRP  38  -3.194  -7.308  -6.069
  274    HE1  TRP  38           HE1      TRP  38  -5.040  -8.755  -7.126
  275    HE3  TRP  38           HE3      TRP  38  -4.363 -10.211  -2.027
  276    HZ2  TRP  38           HZ2      TRP  38  -6.766 -10.847  -6.347
  277    HZ3  TRP  38           HZ3      TRP  38  -6.124 -11.912  -2.266
  278    HH2  TRP  38           HH2      TRP  38  -7.301 -12.222  -4.383
  279    H    TYR  39           HN       TYR  39  -0.107  -5.515  -2.789
  280    HA   TYR  39           HA       TYR  39   1.673  -7.234  -1.179
  281   1HB   TYR  39          HB2       TYR  39   1.983  -4.342  -2.025
  282   2HB   TYR  39          HB1       TYR  39   3.097  -5.196  -0.966
  283    HD1  TYR  39           HD1      TYR  39   2.382  -7.761  -3.003
  284    HD2  TYR  39           HD2      TYR  39   4.179  -3.912  -3.280
  285    HE1  TYR  39           HE1      TYR  39   3.667  -8.509  -4.956
  286    HE2  TYR  39           HE2      TYR  39   5.469  -4.653  -5.237
  287    HH   TYR  39           HH       TYR  39   6.278  -6.750  -6.223
  288    H    GLU  40           HN       GLU  40   2.358  -6.089   0.942
  289    HA   GLU  40           HA       GLU  40   0.080  -4.692   2.098
  290   1HB   GLU  40          HB2       GLU  40  -0.378  -7.004   2.582
  291   2HB   GLU  40          HB1       GLU  40   1.241  -7.240   3.217
  292   1HG   GLU  40          HG2       GLU  40   0.757  -5.766   5.076
  293   2HG   GLU  40          HG1       GLU  40  -0.839  -5.423   4.414
  294    H    GLY  41           HN       GLY  41   0.536  -3.230   3.606
  295   1HA   GLY  41          HA2       GLY  41   3.159  -3.177   4.873
  296   2HA   GLY  41          HA1       GLY  41   2.773  -1.831   3.807
  297    H    MET  42           HN       MET  42   3.234  -0.852   6.098
  298    HA   MET  42           HA       MET  42   0.599  -0.447   7.326
  299   1HB   MET  42          HB2       MET  42   1.577  -0.458   9.560
  300   2HB   MET  42          HB1       MET  42   1.834  -1.998   8.752
  301   1HG   MET  42          HG2       MET  42   3.873  -1.607   9.744
  302   2HG   MET  42          HG1       MET  42   4.130  -1.018   8.103
  303   1HE   MET  42          HE1       MET  42   5.959  -0.336  10.644
  304   2HE   MET  42          HE2       MET  42   6.260   1.387  10.409
  305   3HE   MET  42          HE3       MET  42   6.320   0.285   9.032
  306    H    ILE  43           HN       ILE  43   0.402   1.473   8.568
  307    HA   ILE  43           HA       ILE  43   2.358   3.576   8.283
  308    HB   ILE  43           HB       ILE  43   1.204   3.739   6.127
  309   1HG1  ILE  43          HG12      ILE  43   0.392   5.953   8.025
  310   2HG1  ILE  43          HG11      ILE  43   1.978   5.792   7.275
  311   1HG2  ILE  43          HG21      ILE  43  -1.304   4.096   7.763
  312   2HG2  ILE  43          HG22      ILE  43  -0.907   2.700   6.762
  313   3HG2  ILE  43          HG23      ILE  43  -1.181   4.272   6.013
  314   1HD1  ILE  43          HD11      ILE  43   0.969   6.085   5.069
  315   2HD1  ILE  43          HD12      ILE  43   0.604   7.452   6.123
  316   3HD1  ILE  43          HD13      ILE  43  -0.624   6.225   5.810
  317    H    HIS  44           HN       HIS  44   2.097   5.149   9.834
  318    HA   HIS  44           HA       HIS  44   1.379   6.128  11.751
  319   1HB   HIS  44          HB2       HIS  44  -1.316   5.166  10.777
  320   2HB   HIS  44          HB1       HIS  44  -1.092   6.205  12.180
  321    HD1  HIS  44           HD1      HIS  44   0.694   8.364  11.301
  322    HD2  HIS  44           HD2      HIS  44  -2.131   6.719   8.735
  323    HE1  HIS  44           HE1      HIS  44   0.298  10.106   9.531
  324    HE2  HIS  44           HE2      HIS  44  -1.379   9.069   7.962
  325    H    GLY  45           HN       GLY  45  -0.998   3.479  11.760
  326   1HA   GLY  45          HA2       GLY  45   0.544   1.966  13.680
  327   2HA   GLY  45          HA1       GLY  45  -0.865   2.760  14.362
  328    H    GLU  46           HN       GLU  46  -0.808   1.481  11.086
  329    HA   GLU  46           HA       GLU  46  -2.039  -1.008  11.822
  330   1HB   GLU  46          HB2       GLU  46  -4.179  -0.605  10.675
  331   2HB   GLU  46          HB1       GLU  46  -3.973   0.430  12.081
  332   1HG   GLU  46          HG2       GLU  46  -3.335   1.358   9.300
  333   2HG   GLU  46          HG1       GLU  46  -4.952   1.482   9.994
  334    H    SER  47           HN       SER  47  -2.246  -2.468  10.133
  335    HA   SER  47           HA       SER  47  -0.797  -1.693   7.691
  336   1HB   SER  47          HB2       SER  47   0.371  -3.392   8.977
  337   2HB   SER  47          HB1       SER  47  -1.075  -4.400   9.015
  338    HG   SER  47           HG       SER  47   0.792  -4.539   7.261
  339    H    GLY  48           HN       GLY  48  -1.362  -3.120   5.761
  340   1HA   GLY  48          HA2       GLY  48  -3.906  -4.326   5.532
  341   2HA   GLY  48          HA1       GLY  48  -4.002  -2.659   4.981
  342    H    PHE  49           HN       PHE  49  -4.539  -4.689   3.208
  343    HA   PHE  49           HA       PHE  49  -2.084  -5.032   1.645
  344   1HB   PHE  49          HB2       PHE  49  -3.440  -6.645   0.297
  345   2HB   PHE  49          HB1       PHE  49  -3.255  -7.094   1.987
  346    HD1  PHE  49           HD1      PHE  49  -5.615  -5.515  -0.404
  347    HD2  PHE  49           HD2      PHE  49  -5.116  -7.542   3.304
  348    HE1  PHE  49           HE1      PHE  49  -8.057  -5.743  -0.206
  349    HE2  PHE  49           HE2      PHE  49  -7.557  -7.771   3.511
  350    HZ   PHE  49           HZ       PHE  49  -9.031  -6.872   1.754
  351    H    PHE  50           HN       PHE  50  -2.132  -4.684  -0.670
  352    HA   PHE  50           HA       PHE  50  -4.167  -3.297  -1.997
  353   1HB   PHE  50          HB2       PHE  50  -3.076  -1.049  -2.157
  354   2HB   PHE  50          HB1       PHE  50  -3.712  -1.429  -0.562
  355    HD1  PHE  50           HD1      PHE  50  -0.811  -0.523  -2.470
  356    HD2  PHE  50           HD2      PHE  50  -2.108  -2.157   1.240
  357    HE1  PHE  50           HE1      PHE  50   1.385  -0.018  -1.482
  358    HE2  PHE  50           HE2      PHE  50   0.086  -1.655   2.232
  359    HZ   PHE  50           HZ       PHE  50   1.836  -0.583   0.871
  360    HA   PRO  51           HA       PRO  51  -1.406  -5.115  -5.104
  361   1HB   PRO  51          HB2       PRO  51  -3.004  -4.052  -7.167
  362   2HB   PRO  51          HB1       PRO  51  -3.082  -5.687  -6.512
  363   1HG   PRO  51          HG2       PRO  51  -4.773  -3.323  -5.911
  364   2HG   PRO  51          HG1       PRO  51  -5.201  -5.042  -5.919
  365   1HD   PRO  51          HD2       PRO  51  -4.876  -3.687  -3.627
  366   2HD   PRO  51          HD1       PRO  51  -4.372  -5.389  -3.777
  367    H    ILE  52           HN       ILE  52  -0.025  -4.298  -6.716
  368    HA   ILE  52           HA       ILE  52   1.087  -1.776  -6.210
  369    HB   ILE  52           HB       ILE  52   1.387  -3.261  -8.815
  370   1HG1  ILE  52          HG12      ILE  52   2.959  -3.746  -6.276
  371   2HG1  ILE  52          HG11      ILE  52   1.661  -4.791  -6.843
  372   1HG2  ILE  52          HG21      ILE  52   2.389  -1.053  -8.743
  373   2HG2  ILE  52          HG22      ILE  52   3.644  -2.293  -8.766
  374   3HG2  ILE  52          HG23      ILE  52   3.246  -1.468  -7.259
  375   1HD1  ILE  52          HD11      ILE  52   4.271  -4.239  -8.228
  376   2HD1  ILE  52          HD12      ILE  52   2.949  -5.180  -8.919
  377   3HD1  ILE  52          HD13      ILE  52   3.765  -5.744  -7.462
  378    H    ASN  53           HN       ASN  53  -1.610  -2.660  -8.110
  379    HA   ASN  53           HA       ASN  53  -1.545  -0.643 -10.078
  380   1HB   ASN  53          HB2       ASN  53  -2.964  -2.654 -10.225
  381   2HB   ASN  53          HB1       ASN  53  -3.940  -2.056  -8.886
  382   1HD2  ASN  53          HD21      ASN  53  -3.100  -1.654 -12.231
  383   2HD2  ASN  53          HD22      ASN  53  -4.417  -0.614 -12.647
  384    H    TYR  54           HN       TYR  54  -1.825  -0.281  -6.779
  385    HA   TYR  54           HA       TYR  54  -3.365   2.211  -7.102
  386   1HB   TYR  54          HB2       TYR  54  -3.153   0.426  -4.674
  387   2HB   TYR  54          HB1       TYR  54  -3.961   1.990  -4.696
  388    HD1  TYR  54           HD1      TYR  54  -5.547   2.040  -7.057
  389    HD2  TYR  54           HD2      TYR  54  -4.693  -1.277  -4.532
  390    HE1  TYR  54           HE1      TYR  54  -7.628   0.955  -7.789
  391    HE2  TYR  54           HE2      TYR  54  -6.772  -2.372  -5.259
  392    HH   TYR  54           HH       TYR  54  -8.566  -1.324  -7.931
  393    H    VAL  55           HN       VAL  55  -0.297   1.001  -6.479
  394    HA   VAL  55           HA       VAL  55   0.534   3.618  -5.451
  395    HB   VAL  55           HB       VAL  55   2.077   2.608  -3.829
  396   1HG1  VAL  55          HG11      VAL  55  -0.823   1.856  -3.466
  397   2HG1  VAL  55          HG12      VAL  55  -0.052   3.373  -3.006
  398   3HG1  VAL  55          HG13      VAL  55   0.377   1.879  -2.175
  399   1HG2  VAL  55          HG21      VAL  55   2.369   0.435  -4.891
  400   2HG2  VAL  55          HG22      VAL  55   0.694   0.018  -4.529
  401   3HG2  VAL  55          HG23      VAL  55   1.850   0.244  -3.217
  402    H    GLU  56           HN       GLU  56   3.037   3.631  -5.306
  403    HA   GLU  56           HA       GLU  56   4.226   2.202  -7.573
  404   1HB   GLU  56          HB2       GLU  56   5.452   4.323  -8.161
  405   2HB   GLU  56          HB1       GLU  56   3.727   4.350  -8.491
  406   1HG   GLU  56          HG2       GLU  56   3.308   5.703  -6.570
  407   2HG   GLU  56          HG1       GLU  56   4.974   5.529  -6.021
  408    H    VAL  57           HN       VAL  57   5.568   0.895  -6.461
  409    HA   VAL  57           HA       VAL  57   6.832   1.480  -4.044
  410    HB   VAL  57           HB       VAL  57   7.726  -0.453  -6.188
  411   1HG1  VAL  57          HG11      VAL  57   8.466  -0.275  -3.270
  412   2HG1  VAL  57          HG12      VAL  57   9.535  -0.005  -4.648
  413   3HG1  VAL  57          HG13      VAL  57   8.881  -1.614  -4.340
  414   1HG2  VAL  57          HG21      VAL  57   6.551  -2.135  -4.837
  415   2HG2  VAL  57          HG22      VAL  57   5.456  -0.894  -5.443
  416   3HG2  VAL  57          HG23      VAL  57   5.983  -0.859  -3.760
  417    H    ILE  58           HN       ILE  58   8.268   3.017  -3.655
  418    HA   ILE  58           HA       ILE  58   9.780   4.343  -5.642
  419    HB   ILE  58           HB       ILE  58  10.190   4.308  -2.648
  420   1HG1  ILE  58          HG12      ILE  58   8.760   6.345  -4.367
  421   2HG1  ILE  58          HG11      ILE  58   7.942   5.078  -3.460
  422   1HG2  ILE  58          HG21      ILE  58  12.186   5.077  -3.777
  423   2HG2  ILE  58          HG22      ILE  58  11.374   6.442  -3.011
  424   3HG2  ILE  58          HG23      ILE  58  11.236   6.198  -4.752
  425   1HD1  ILE  58          HD11      ILE  58   8.758   6.007  -1.380
  426   2HD1  ILE  58          HD12      ILE  58   7.893   7.233  -2.310
  427   3HD1  ILE  58          HD13      ILE  58   9.656   7.241  -2.263
  428    H    VAL  59           HN       VAL  59  10.580   1.820  -3.297
  429    HA   VAL  59           HA       VAL  59  12.918   1.133  -4.902
  430    HB   VAL  59           HB       VAL  59  13.931   2.527  -3.256
  431   1HG1  VAL  59          HG11      VAL  59  13.633   2.155  -0.838
  432   2HG1  VAL  59          HG12      VAL  59  12.403   0.944  -1.195
  433   3HG1  VAL  59          HG13      VAL  59  12.137   2.629  -1.639
  434   1HG2  VAL  59          HG21      VAL  59  15.411   0.981  -2.104
  435   2HG2  VAL  59          HG22      VAL  59  15.097   0.422  -3.747
  436   3HG2  VAL  59          HG23      VAL  59  14.279  -0.341  -2.385
  437    HA   PRO  60           HA       PRO  60  11.019  -2.847  -4.092
  438   1HB   PRO  60          HB2       PRO  60  12.855  -4.369  -5.393
  439   2HB   PRO  60          HB1       PRO  60  11.604  -3.443  -6.230
  440   1HG   PRO  60          HG2       PRO  60  14.483  -2.760  -5.773
  441   2HG   PRO  60          HG1       PRO  60  13.506  -2.566  -7.241
  442   1HD   PRO  60          HD2       PRO  60  14.040  -0.506  -5.574
  443   2HD   PRO  60          HD1       PRO  60  12.517  -0.626  -6.478
  Start of MODEL    3
    1   1H    MET   1          HT1       MET   1  19.911   5.057   5.065
    2   2H    MET   1          HT2       MET   1  20.102   4.721   3.420
    3   3H    MET   1          HT3       MET   1  20.457   3.534   4.570
    4    HA   MET   1           HA       MET   1  18.172   3.384   5.220
    5   1HB   MET   1          HB2       MET   1  17.785   5.542   3.138
    6   2HB   MET   1          HB1       MET   1  16.468   4.635   3.872
    7   1HG   MET   1          HG2       MET   1  17.133   5.486   6.076
    8   2HG   MET   1          HG1       MET   1  18.410   6.429   5.310
    9   1HE   MET   1          HE1       MET   1  17.986   8.545   3.768
   10   2HE   MET   1          HE2       MET   1  16.388   8.982   3.161
   11   3HE   MET   1          HE3       MET   1  17.127   7.454   2.679
   12    H    ASP   2           HN       ASP   2  17.442   1.512   4.477
   13    HA   ASP   2           HA       ASP   2  17.472   0.984   1.596
   14   1HB   ASP   2          HB2       ASP   2  19.563   0.057   2.685
   15   2HB   ASP   2          HB1       ASP   2  18.518  -1.023   3.601
   16    H    GLN   3           HN       GLN   3  15.279   1.648   3.195
   17    HA   GLN   3           HA       GLN   3  13.872  -0.894   3.601
   18   1HB   GLN   3          HB2       GLN   3  13.256   1.910   4.533
   19   2HB   GLN   3          HB1       GLN   3  12.155   0.557   4.745
   20   1HG   GLN   3          HG2       GLN   3  14.953   0.679   5.846
   21   2HG   GLN   3          HG1       GLN   3  13.492   1.069   6.752
   22   1HE2  GLN   3          HE21      GLN   3  15.476  -0.991   7.262
   23   2HE2  GLN   3          HE22      GLN   3  14.626  -2.495   7.260
   24    HA   PRO   4           HA       PRO   4  11.705  -0.092  -0.226
   25   1HB   PRO   4          HB2       PRO   4   9.864  -2.063  -0.056
   26   2HB   PRO   4          HB1       PRO   4  11.561  -2.384  -0.435
   27   1HG   PRO   4          HG2       PRO   4  10.123  -2.640   2.180
   28   2HG   PRO   4          HG1       PRO   4  11.284  -3.751   1.430
   29   1HD   PRO   4          HD2       PRO   4  11.977  -2.007   3.391
   30   2HD   PRO   4          HD1       PRO   4  13.101  -2.513   2.114
   31    H    CYS   5           HN       CYS   5  10.231   1.433  -0.603
   32    HA   CYS   5           HA       CYS   5   7.780   1.497   0.990
   33   1HB   CYS   5          HB2       CYS   5   7.963   3.948   1.277
   34   2HB   CYS   5          HB1       CYS   5   9.250   3.079   2.107
   35    HG   CYS   5           HG       CYS   5   9.456   5.410  -0.228
   36    H    CYS   6           HN       CYS   6   6.021   2.550  -0.020
   37    HA   CYS   6           HA       CYS   6   6.422   3.239  -2.848
   38   1HB   CYS   6          HB2       CYS   6   4.588   1.952  -3.572
   39   2HB   CYS   6          HB1       CYS   6   5.486   0.897  -2.497
   40    HG   CYS   6           HG       CYS   6   3.010   2.652  -1.051
   41    H    ARG   7           HN       ARG   7   4.253   4.170  -3.725
   42    HA   ARG   7           HA       ARG   7   2.937   5.850  -1.723
   43   1HB   ARG   7          HB2       ARG   7   3.283   7.887  -3.058
   44   2HB   ARG   7          HB1       ARG   7   4.803   7.212  -2.487
   45   1HG   ARG   7          HG2       ARG   7   5.304   6.329  -4.650
   46   2HG   ARG   7          HG1       ARG   7   3.702   6.763  -5.249
   47   1HD   ARG   7          HD2       ARG   7   5.380   8.361  -6.007
   48   2HD   ARG   7          HD1       ARG   7   4.217   9.129  -4.928
   49    HE   ARG   7           HE       ARG   7   6.367   8.290  -3.375
   50   1HH1  ARG   7          HH11      ARG   7   5.739  10.548  -5.956
   51   2HH1  ARG   7          HH12      ARG   7   6.986  11.649  -5.469
   52   1HH2  ARG   7          HH21      ARG   7   8.010   9.732  -2.729
   53   2HH2  ARG   7          HH22      ARG   7   8.277  11.184  -3.636
   54    H    GLY   8           HN       GLY   8   0.824   6.262  -2.172
   55   1HA   GLY   8          HA2       GLY   8  -0.376   4.809  -4.343
   56   2HA   GLY   8          HA1       GLY   8  -1.220   5.769  -3.139
   57    H    LEU   9           HN       LEU   9  -1.231   5.526  -6.205
   58    HA   LEU   9           HA       LEU   9  -0.655   8.279  -6.964
   59   1HB   LEU   9          HB2       LEU   9  -1.468   5.835  -8.521
   60   2HB   LEU   9          HB1       LEU   9  -1.441   7.429  -9.246
   61    HG   LEU   9           HG       LEU   9   0.578   6.230  -9.818
   62   1HD1  LEU   9          HD11      LEU   9   1.154   8.387  -7.793
   63   2HD1  LEU   9          HD12      LEU   9   0.750   8.644  -9.490
   64   3HD1  LEU   9          HD13      LEU   9   2.249   7.823  -9.056
   65   1HD2  LEU   9          HD21      LEU   9   0.651   4.686  -7.938
   66   2HD2  LEU   9          HD22      LEU   9   1.058   6.013  -6.849
   67   3HD2  LEU   9          HD23      LEU   9   2.187   5.533  -8.116
   68    H    TYR  10           HN       TYR  10  -3.345   6.135  -6.421
   69    HA   TYR  10           HA       TYR  10  -5.179   8.409  -6.809
   70   1HB   TYR  10          HB2       TYR  10  -5.909   5.526  -7.312
   71   2HB   TYR  10          HB1       TYR  10  -6.859   6.962  -7.684
   72    HD1  TYR  10           HD1      TYR  10  -4.230   4.734  -8.809
   73    HD2  TYR  10           HD2      TYR  10  -6.151   8.459  -9.540
   74    HE1  TYR  10           HE1      TYR  10  -3.257   4.787 -11.068
   75    HE2  TYR  10           HE2      TYR  10  -5.185   8.522 -11.800
   76    HH   TYR  10           HH       TYR  10  -3.306   7.577 -13.026
   77    H    ASP  11           HN       ASP  11  -6.862   8.625  -5.343
   78    HA   ASP  11           HA       ASP  11  -6.361   7.512  -2.753
   79   1HB   ASP  11          HB2       ASP  11  -8.438   8.840  -2.145
   80   2HB   ASP  11          HB1       ASP  11  -7.070   9.747  -2.765
   81    H    PHE  12           HN       PHE  12  -8.041   6.585  -1.432
   82    HA   PHE  12           HA       PHE  12 -10.290   5.295  -2.608
   83   1HB   PHE  12          HB2       PHE  12  -7.886   3.904  -2.912
   84   2HB   PHE  12          HB1       PHE  12  -8.720   3.127  -1.570
   85    HD1  PHE  12           HD1      PHE  12  -8.973   4.019  -5.128
   86    HD2  PHE  12           HD2      PHE  12 -10.666   1.817  -1.904
   87    HE1  PHE  12           HE1      PHE  12 -10.405   2.801  -6.717
   88    HE2  PHE  12           HE2      PHE  12 -12.100   0.595  -3.486
   89    HZ   PHE  12           HZ       PHE  12 -11.986   1.088  -5.883
   90    H    GLU  13           HN       GLU  13 -11.771   4.891  -1.114
   91    HA   GLU  13           HA       GLU  13 -10.913   4.840   1.705
   92   1HB   GLU  13          HB2       GLU  13 -12.439   6.748   0.762
   93   2HB   GLU  13          HB1       GLU  13 -13.703   5.529   0.827
   94   1HG   GLU  13          HG2       GLU  13 -12.047   6.485   3.153
   95   2HG   GLU  13          HG1       GLU  13 -13.715   6.934   2.809
   96    HA   PRO  14           HA       PRO  14 -12.488   0.619   0.731
   97   1HB   PRO  14          HB2       PRO  14 -11.015  -0.601   2.685
   98   2HB   PRO  14          HB1       PRO  14 -10.418  -0.288   1.052
   99   1HG   PRO  14          HG2       PRO  14  -9.958   1.264   3.566
  100   2HG   PRO  14          HG1       PRO  14  -8.808   0.841   2.284
  101   1HD   PRO  14          HD2       PRO  14  -9.919   3.288   2.454
  102   2HD   PRO  14          HD1       PRO  14  -9.543   2.533   0.893
  103    H    GLU  15           HN       GLU  15 -14.255  -0.268   1.613
  104    HA   GLU  15           HA       GLU  15 -15.039   0.599   4.305
  105   1HB   GLU  15          HB2       GLU  15 -17.329  -0.207   3.588
  106   2HB   GLU  15          HB1       GLU  15 -16.705   1.188   2.721
  107   1HG   GLU  15          HG2       GLU  15 -17.712  -0.225   1.121
  108   2HG   GLU  15          HG1       GLU  15 -15.970  -0.380   0.910
  109    H    ASN  16           HN       ASN  16 -13.392  -1.830   3.076
  110    HA   ASN  16           HA       ASN  16 -14.675  -3.881   4.759
  111   1HB   ASN  16          HB2       ASN  16 -14.630  -4.466   2.361
  112   2HB   ASN  16          HB1       ASN  16 -12.879  -4.282   2.357
  113   1HD2  ASN  16          HD21      ASN  16 -11.603  -5.819   3.373
  114   2HD2  ASN  16          HD22      ASN  16 -12.213  -7.374   3.815
  115    H    GLN  17           HN       GLN  17 -13.520  -4.781   6.368
  116    HA   GLN  17           HA       GLN  17 -11.130  -3.552   7.243
  117   1HB   GLN  17          HB2       GLN  17 -12.450  -6.126   8.114
  118   2HB   GLN  17          HB1       GLN  17 -11.100  -5.372   8.951
  119   1HG   GLN  17          HG2       GLN  17 -12.457  -3.408   9.408
  120   2HG   GLN  17          HG1       GLN  17 -13.807  -4.123   8.529
  121   1HE2  GLN  17          HE21      GLN  17 -11.872  -4.253  11.418
  122   2HE2  GLN  17          HE22      GLN  17 -12.941  -5.255  12.333
  123    H    GLY  18           HN       GLY  18  -9.018  -4.167   7.143
  124   1HA   GLY  18          HA2       GLY  18  -7.349  -5.916   6.826
  125   2HA   GLY  18          HA1       GLY  18  -8.406  -6.614   5.608
  126    H    GLU  19           HN       GLU  19  -8.993  -3.862   4.559
  127    HA   GLU  19           HA       GLU  19  -6.707  -3.736   2.769
  128   1HB   GLU  19          HB2       GLU  19  -9.065  -1.904   2.584
  129   2HB   GLU  19          HB1       GLU  19  -8.070  -2.564   1.295
  130   1HG   GLU  19          HG2       GLU  19  -9.078  -4.774   1.681
  131   2HG   GLU  19          HG1       GLU  19 -10.114  -4.063   2.917
  132    H    LEU  20           HN       LEU  20  -5.791  -1.625   2.175
  133    HA   LEU  20           HA       LEU  20  -5.433   0.037   4.567
  134   1HB   LEU  20          HB2       LEU  20  -3.411  -0.904   3.572
  135   2HB   LEU  20          HB1       LEU  20  -3.798  -0.156   2.035
  136    HG   LEU  20           HG       LEU  20  -3.492   2.065   3.023
  137   1HD1  LEU  20          HD11      LEU  20  -4.163   1.603   5.301
  138   2HD1  LEU  20          HD12      LEU  20  -2.532   2.273   5.279
  139   3HD1  LEU  20          HD13      LEU  20  -2.772   0.543   5.522
  140   1HD2  LEU  20          HD21      LEU  20  -1.176   0.202   3.531
  141   2HD2  LEU  20          HD22      LEU  20  -1.074   1.953   3.341
  142   3HD2  LEU  20          HD23      LEU  20  -1.586   0.948   1.986
  143    H    GLY  21           HN       GLY  21  -6.407   1.956   4.689
  144   1HA   GLY  21          HA2       GLY  21  -7.499   3.114   2.215
  145   2HA   GLY  21          HA1       GLY  21  -8.087   3.442   3.837
  146    H    PHE  22           HN       PHE  22  -6.920   5.055   1.457
  147    HA   PHE  22           HA       PHE  22  -5.856   7.161   2.982
  148   1HB   PHE  22          HB2       PHE  22  -3.939   5.163   2.383
  149   2HB   PHE  22          HB1       PHE  22  -3.584   6.539   1.343
  150    HD1  PHE  22           HD1      PHE  22  -3.693   8.881   2.617
  151    HD2  PHE  22           HD2      PHE  22  -2.948   5.113   4.449
  152    HE1  PHE  22           HE1      PHE  22  -2.583  10.017   4.496
  153    HE2  PHE  22           HE2      PHE  22  -1.839   6.242   6.332
  154    HZ   PHE  22           HZ       PHE  22  -1.666   8.703   6.362
  155    H    LYS  23           HN       LYS  23  -4.337   8.540   1.199
  156    HA   LYS  23           HA       LYS  23  -5.889   8.562  -1.281
  157   1HB   LYS  23          HB2       LYS  23  -5.689  11.115  -1.163
  158   2HB   LYS  23          HB1       LYS  23  -6.925  10.324  -0.193
  159   1HG   LYS  23          HG2       LYS  23  -4.255  10.858   0.997
  160   2HG   LYS  23          HG1       LYS  23  -5.419  12.178   0.846
  161   1HD   LYS  23          HD2       LYS  23  -6.122   9.540   2.099
  162   2HD   LYS  23          HD1       LYS  23  -5.428  10.867   3.036
  163   1HE   LYS  23          HE2       LYS  23  -7.293  12.306   2.366
  164   2HE   LYS  23          HE1       LYS  23  -7.978  10.981   1.426
  165   1HZ   LYS  23          HZ1       LYS  23  -8.222   9.711   3.472
  166   2HZ   LYS  23          HZ2       LYS  23  -9.058  11.178   3.571
  167   3HZ   LYS  23          HZ3       LYS  23  -7.578  10.993   4.369
  168    H    GLU  24           HN       GLU  24  -4.868  10.150  -2.892
  169    HA   GLU  24           HA       GLU  24  -2.409   9.235  -3.701
  170   1HB   GLU  24          HB2       GLU  24  -2.301  11.255  -5.121
  171   2HB   GLU  24          HB1       GLU  24  -3.888  10.496  -5.161
  172   1HG   GLU  24          HG2       GLU  24  -4.265  12.224  -3.156
  173   2HG   GLU  24          HG1       GLU  24  -3.061  13.111  -4.091
  174    H    GLY  25           HN       GLY  25  -0.303  10.021  -3.594
  175   1HA   GLY  25          HA2       GLY  25   1.491  11.244  -2.776
  176   2HA   GLY  25          HA1       GLY  25   0.358  12.273  -1.918
  177    H    ASP  26           HN       ASP  26  -0.552   9.250  -1.092
  178    HA   ASP  26           HA       ASP  26   0.582   9.461   1.522
  179   1HB   ASP  26          HB2       ASP  26  -0.694   7.504   2.054
  180   2HB   ASP  26          HB1       ASP  26  -1.687   8.509   1.005
  181    H    ILE  27           HN       ILE  27   2.089   8.152   2.526
  182    HA   ILE  27           HA       ILE  27   3.701   6.437   0.744
  183    HB   ILE  27           HB       ILE  27   4.735   7.985   3.129
  184   1HG1  ILE  27          HG12      ILE  27   4.043   9.527   1.344
  185   2HG1  ILE  27          HG11      ILE  27   5.794   9.499   1.519
  186   1HG2  ILE  27          HG21      ILE  27   6.000   5.975   2.642
  187   2HG2  ILE  27          HG22      ILE  27   6.943   7.405   2.220
  188   3HG2  ILE  27          HG23      ILE  27   6.161   6.459   0.953
  189   1HD1  ILE  27          HD11      ILE  27   4.229   8.030  -0.591
  190   2HD1  ILE  27          HD12      ILE  27   5.986   8.077  -0.434
  191   3HD1  ILE  27          HD13      ILE  27   5.096   9.549  -0.820
  192    H    ILE  28           HN       ILE  28   3.743   4.357   1.334
  193    HA   ILE  28           HA       ILE  28   3.179   3.688   4.153
  194    HB   ILE  28           HB       ILE  28   2.500   1.903   1.828
  195   1HG1  ILE  28          HG12      ILE  28   1.268   4.003   1.535
  196   2HG1  ILE  28          HG11      ILE  28   0.181   2.699   1.996
  197   1HG2  ILE  28          HG21      ILE  28   2.700   0.892   4.067
  198   2HG2  ILE  28          HG22      ILE  28   1.065   0.785   3.413
  199   3HG2  ILE  28          HG23      ILE  28   1.444   1.985   4.649
  200   1HD1  ILE  28          HD11      ILE  28  -0.359   4.782   3.133
  201   2HD1  ILE  28          HD12      ILE  28   1.256   4.819   3.843
  202   3HD1  ILE  28          HD13      ILE  28   0.130   3.533   4.278
  203    H    THR  29           HN       THR  29   4.423   2.125   5.133
  204    HA   THR  29           HA       THR  29   6.908   1.450   3.791
  205    HB   THR  29           HB       THR  29   7.623   0.523   5.937
  206    HG1  THR  29           HG1      THR  29   5.496  -0.245   6.569
  207   1HG2  THR  29          HG21      THR  29   7.870   2.929   5.608
  208   2HG2  THR  29          HG22      THR  29   7.515   2.566   7.296
  209   3HG2  THR  29          HG23      THR  29   6.247   3.195   6.244
  210    H    LEU  30           HN       LEU  30   7.378  -0.478   2.904
  211    HA   LEU  30           HA       LEU  30   5.304  -2.536   2.995
  212   1HB   LEU  30          HB2       LEU  30   7.576  -1.947   1.144
  213   2HB   LEU  30          HB1       LEU  30   6.873  -3.552   1.186
  214    HG   LEU  30           HG       LEU  30   4.654  -2.538   0.654
  215   1HD1  LEU  30          HD11      LEU  30   6.258  -0.034   0.164
  216   2HD1  LEU  30          HD12      LEU  30   5.149  -0.282   1.512
  217   3HD1  LEU  30          HD13      LEU  30   4.537  -0.263  -0.141
  218   1HD2  LEU  30          HD21      LEU  30   6.848  -1.953  -1.329
  219   2HD2  LEU  30          HD22      LEU  30   5.137  -2.158  -1.699
  220   3HD2  LEU  30          HD23      LEU  30   6.075  -3.518  -1.086
  221    H    THR  31           HN       THR  31   5.539  -4.449   3.922
  222    HA   THR  31           HA       THR  31   8.037  -5.700   4.362
  223    HB   THR  31           HB       THR  31   8.195  -4.041   6.146
  224    HG1  THR  31           HG1      THR  31   8.463  -6.641   6.405
  225   1HG2  THR  31          HG21      THR  31   5.717  -3.812   6.482
  226   2HG2  THR  31          HG22      THR  31   6.654  -3.937   7.969
  227   3HG2  THR  31          HG23      THR  31   5.762  -5.334   7.371
  228    H    ASN  32           HN       ASN  32   5.130  -5.992   3.481
  229    HA   ASN  32           HA       ASN  32   4.782  -8.697   4.443
  230   1HB   ASN  32          HB2       ASN  32   2.752  -6.499   4.823
  231   2HB   ASN  32          HB1       ASN  32   2.358  -8.208   4.916
  232   1HD2  ASN  32          HD21      ASN  32   3.799  -5.523   6.501
  233   2HD2  ASN  32          HD22      ASN  32   4.109  -6.300   8.012
  234    H    GLN  33           HN       GLN  33   2.678  -9.573   3.211
  235    HA   GLN  33           HA       GLN  33   1.899  -8.269   0.833
  236   1HB   GLN  33          HB2       GLN  33   4.412  -9.707   0.723
  237   2HB   GLN  33          HB1       GLN  33   3.246 -10.314  -0.449
  238   1HG   GLN  33          HG2       GLN  33   2.993  -8.225  -1.448
  239   2HG   GLN  33          HG1       GLN  33   3.810  -7.393  -0.110
  240   1HE2  GLN  33          HE21      GLN  33   4.215  -9.334  -2.977
  241   2HE2  GLN  33          HE22      GLN  33   5.919  -9.102  -3.146
  242    H    ILE  34           HN       ILE  34   0.438  -9.382  -0.418
  243    HA   ILE  34           HA       ILE  34  -0.611 -11.803   0.830
  244    HB   ILE  34           HB       ILE  34  -1.952  -9.775  -0.956
  245   1HG1  ILE  34          HG12      ILE  34  -1.640  -9.140   1.423
  246   2HG1  ILE  34          HG11      ILE  34  -3.335  -9.297   0.979
  247   1HG2  ILE  34          HG21      ILE  34  -2.806 -11.937  -1.567
  248   2HG2  ILE  34          HG22      ILE  34  -4.022 -11.096  -0.607
  249   3HG2  ILE  34          HG23      ILE  34  -3.046 -12.368   0.125
  250   1HD1  ILE  34          HD11      ILE  34  -3.384 -11.514   2.029
  251   2HD1  ILE  34          HD12      ILE  34  -2.937 -10.242   3.165
  252   3HD1  ILE  34          HD13      ILE  34  -1.699 -11.311   2.507
  253    H    ASP  35           HN       ASP  35   0.385 -10.429  -2.223
  254    HA   ASP  35           HA       ASP  35   1.095 -12.963  -3.290
  255   1HB   ASP  35          HB2       ASP  35  -1.387 -13.021  -3.575
  256   2HB   ASP  35          HB1       ASP  35  -1.262 -11.605  -4.612
  257    H    GLU  36           HN       GLU  36   1.594 -12.654  -5.776
  258    HA   GLU  36           HA       GLU  36   3.527 -10.645  -5.990
  259   1HB   GLU  36          HB2       GLU  36   3.626 -11.268  -8.385
  260   2HB   GLU  36          HB1       GLU  36   3.670 -12.663  -7.316
  261   1HG   GLU  36          HG2       GLU  36   1.300 -13.065  -7.740
  262   2HG   GLU  36          HG1       GLU  36   1.257 -11.669  -8.815
  263    H    ASN  37           HN       ASN  37   0.187 -10.408  -6.212
  264    HA   ASN  37           HA       ASN  37   0.288  -8.048  -7.951
  265   1HB   ASN  37          HB2       ASN  37  -1.374  -9.786  -8.507
  266   2HB   ASN  37          HB1       ASN  37  -2.108  -9.583  -6.920
  267   1HD2  ASN  37          HD21      ASN  37  -1.602  -8.162 -10.051
  268   2HD2  ASN  37          HD22      ASN  37  -2.822  -6.945  -9.919
  269    H    TRP  38           HN       TRP  38  -1.207  -9.057  -4.859
  270    HA   TRP  38           HA       TRP  38  -1.410  -6.243  -4.098
  271   1HB   TRP  38          HB2       TRP  38  -2.394  -8.078  -2.091
  272   2HB   TRP  38          HB1       TRP  38  -3.247  -6.803  -2.955
  273    HD1  TRP  38           HD1      TRP  38  -2.384 -10.547  -3.271
  274    HE1  TRP  38           HE1      TRP  38  -4.129 -11.655  -4.800
  275    HE3  TRP  38           HE3      TRP  38  -4.951  -6.376  -4.731
  276    HZ2  TRP  38           HZ2      TRP  38  -6.307 -10.869  -6.413
  277    HZ3  TRP  38           HZ3      TRP  38  -6.855  -6.640  -6.268
  278    HH2  TRP  38           HH2      TRP  38  -7.517  -8.843  -7.090
  279    H    TYR  39           HN       TYR  39  -0.248  -5.305  -2.524
  280    HA   TYR  39           HA       TYR  39   1.743  -6.993  -1.137
  281   1HB   TYR  39          HB2       TYR  39   1.837  -4.131  -2.083
  282   2HB   TYR  39          HB1       TYR  39   2.934  -4.715  -0.838
  283    HD1  TYR  39           HD1      TYR  39   1.706  -6.223  -4.029
  284    HD2  TYR  39           HD2      TYR  39   5.058  -4.938  -1.745
  285    HE1  TYR  39           HE1      TYR  39   3.214  -7.066  -5.779
  286    HE2  TYR  39           HE2      TYR  39   6.574  -5.777  -3.489
  287    HH   TYR  39           HH       TYR  39   6.568  -7.406  -5.310
  288    H    GLU  40           HN       GLU  40   2.449  -6.032   1.033
  289    HA   GLU  40           HA       GLU  40   0.194  -4.740   2.369
  290   1HB   GLU  40          HB2       GLU  40   1.397  -7.382   3.083
  291   2HB   GLU  40          HB1       GLU  40   0.672  -6.377   4.327
  292   1HG   GLU  40          HG2       GLU  40  -1.420  -6.355   2.967
  293   2HG   GLU  40          HG1       GLU  40  -0.666  -7.544   1.905
  294    H    GLY  41           HN       GLY  41   0.663  -3.445   4.051
  295   1HA   GLY  41          HA2       GLY  41   3.216  -3.395   5.343
  296   2HA   GLY  41          HA1       GLY  41   3.028  -2.081   4.187
  297    H    MET  42           HN       MET  42   3.347  -0.946   6.405
  298    HA   MET  42           HA       MET  42   0.671  -0.202   7.320
  299   1HB   MET  42          HB2       MET  42   1.229  -0.363   9.659
  300   2HB   MET  42          HB1       MET  42   1.500  -1.925   8.895
  301   1HG   MET  42          HG2       MET  42   3.899  -1.461   8.797
  302   2HG   MET  42          HG1       MET  42   3.625   0.095   9.576
  303   1HE   MET  42          HE1       MET  42   1.379  -0.621  11.727
  304   2HE   MET  42          HE2       MET  42   2.790   0.383  12.059
  305   3HE   MET  42          HE3       MET  42   2.392  -0.961  13.130
  306    H    ILE  43           HN       ILE  43   0.619   1.764   8.543
  307    HA   ILE  43           HA       ILE  43   2.948   3.499   8.380
  308    HB   ILE  43           HB       ILE  43   1.888   3.910   6.243
  309   1HG1  ILE  43          HG12      ILE  43   1.251   6.352   6.558
  310   2HG1  ILE  43          HG11      ILE  43   1.457   6.093   8.287
  311   1HG2  ILE  43          HG21      ILE  43  -0.413   4.708   6.063
  312   2HG2  ILE  43          HG22      ILE  43  -0.621   4.505   7.803
  313   3HG2  ILE  43          HG23      ILE  43  -0.344   3.097   6.778
  314   1HD1  ILE  43          HD11      ILE  43   3.788   5.614   8.004
  315   2HD1  ILE  43          HD12      ILE  43   3.429   7.114   7.147
  316   3HD1  ILE  43          HD13      ILE  43   3.623   5.609   6.248
  317    H    HIS  44           HN       HIS  44   3.057   4.874  10.058
  318    HA   HIS  44           HA       HIS  44   2.564   5.935  11.999
  319   1HB   HIS  44          HB2       HIS  44   0.830   7.097  10.736
  320   2HB   HIS  44          HB1       HIS  44  -0.286   5.760  10.998
  321    HD1  HIS  44           HD1      HIS  44   1.521   8.464  12.936
  322    HD2  HIS  44           HD2      HIS  44  -1.726   5.900  13.322
  323    HE1  HIS  44           HE1      HIS  44   0.349   9.176  15.044
  324    HE2  HIS  44           HE2      HIS  44  -1.655   7.660  15.216
  325    H    GLY  45           HN       GLY  45  -0.425   4.011  11.824
  326   1HA   GLY  45          HA2       GLY  45   0.602   2.098  13.747
  327   2HA   GLY  45          HA1       GLY  45  -0.634   3.179  14.371
  328    H    GLU  46           HN       GLU  46  -0.627   2.045  11.053
  329    HA   GLU  46           HA       GLU  46  -2.597  -0.011  11.635
  330   1HB   GLU  46          HB2       GLU  46  -3.890   2.106  11.433
  331   2HB   GLU  46          HB1       GLU  46  -3.260   2.300   9.804
  332   1HG   GLU  46          HG2       GLU  46  -5.477   1.408   9.692
  333   2HG   GLU  46          HG1       GLU  46  -4.331   0.175   9.169
  334    H    SER  47           HN       SER  47  -2.759  -1.580  10.074
  335    HA   SER  47           HA       SER  47  -0.936  -1.288   7.775
  336   1HB   SER  47          HB2       SER  47  -0.550  -3.717   7.910
  337   2HB   SER  47          HB1       SER  47  -0.087  -2.907   9.406
  338    HG   SER  47           HG       SER  47  -1.411  -4.907   9.551
  339    H    GLY  48           HN       GLY  48  -1.469  -2.897   5.985
  340   1HA   GLY  48          HA2       GLY  48  -3.972  -4.020   5.576
  341   2HA   GLY  48          HA1       GLY  48  -4.089  -2.350   5.036
  342    H    PHE  49           HN       PHE  49  -4.481  -4.392   3.226
  343    HA   PHE  49           HA       PHE  49  -1.943  -4.594   1.770
  344   1HB   PHE  49          HB2       PHE  49  -2.869  -6.397   0.534
  345   2HB   PHE  49          HB1       PHE  49  -3.322  -6.665   2.211
  346    HD1  PHE  49           HD1      PHE  49  -4.512  -5.876  -1.141
  347    HD2  PHE  49           HD2      PHE  49  -5.631  -6.442   2.926
  348    HE1  PHE  49           HE1      PHE  49  -6.867  -6.081  -1.822
  349    HE2  PHE  49           HE2      PHE  49  -7.988  -6.647   2.253
  350    HZ   PHE  49           HZ       PHE  49  -8.609  -6.468  -0.124
  351    H    PHE  50           HN       PHE  50  -1.950  -4.278  -0.565
  352    HA   PHE  50           HA       PHE  50  -4.016  -2.874  -1.891
  353   1HB   PHE  50          HB2       PHE  50  -2.540  -1.256  -0.180
  354   2HB   PHE  50          HB1       PHE  50  -1.799  -0.981  -1.751
  355    HD1  PHE  50           HD1      PHE  50  -4.404  -1.391  -3.364
  356    HD2  PHE  50           HD2      PHE  50  -3.452   0.910   0.089
  357    HE1  PHE  50           HE1      PHE  50  -6.203   0.189  -3.923
  358    HE2  PHE  50           HE2      PHE  50  -5.251   2.493  -0.467
  359    HZ   PHE  50           HZ       PHE  50  -6.630   2.133  -2.474
  360    HA   PRO  51           HA       PRO  51  -1.320  -4.862  -4.960
  361   1HB   PRO  51          HB2       PRO  51  -2.931  -4.108  -7.087
  362   2HB   PRO  51          HB1       PRO  51  -3.118  -5.591  -6.148
  363   1HG   PRO  51          HG2       PRO  51  -4.561  -2.986  -5.884
  364   2HG   PRO  51          HG1       PRO  51  -5.198  -4.639  -5.773
  365   1HD   PRO  51          HD2       PRO  51  -4.760  -3.198  -3.573
  366   2HD   PRO  51          HD1       PRO  51  -4.387  -4.938  -3.608
  367    H    ILE  52           HN       ILE  52  -0.021  -4.161  -6.697
  368    HA   ILE  52           HA       ILE  52   1.060  -1.589  -6.437
  369    HB   ILE  52           HB       ILE  52   1.327  -3.363  -8.863
  370   1HG1  ILE  52          HG12      ILE  52   2.993  -3.400  -6.336
  371   2HG1  ILE  52          HG11      ILE  52   1.768  -4.598  -6.739
  372   1HG2  ILE  52          HG21      ILE  52   3.524  -2.290  -9.070
  373   2HG2  ILE  52          HG22      ILE  52   3.154  -1.282  -7.671
  374   3HG2  ILE  52          HG23      ILE  52   2.209  -1.118  -9.152
  375   1HD1  ILE  52          HD11      ILE  52   4.287  -4.040  -8.287
  376   2HD1  ILE  52          HD12      ILE  52   3.049  -5.213  -8.736
  377   3HD1  ILE  52          HD13      ILE  52   3.975  -5.433  -7.251
  378    H    ASN  53           HN       ASN  53  -1.673  -2.679  -8.176
  379    HA   ASN  53           HA       ASN  53  -1.686  -0.817 -10.295
  380   1HB   ASN  53          HB2       ASN  53  -3.948  -2.310  -8.963
  381   2HB   ASN  53          HB1       ASN  53  -4.088  -1.415 -10.468
  382   1HD2  ASN  53          HD21      ASN  53  -1.427  -2.185 -11.377
  383   2HD2  ASN  53          HD22      ASN  53  -1.550  -3.836 -11.867
  384    H    TYR  54           HN       TYR  54  -1.707  -0.080  -7.129
  385    HA   TYR  54           HA       TYR  54  -3.272   2.355  -7.612
  386   1HB   TYR  54          HB2       TYR  54  -3.469   0.552  -5.203
  387   2HB   TYR  54          HB1       TYR  54  -4.047   2.215  -5.204
  388    HD1  TYR  54           HD1      TYR  54  -5.974   2.860  -6.589
  389    HD2  TYR  54           HD2      TYR  54  -4.679  -1.185  -6.350
  390    HE1  TYR  54           HE1      TYR  54  -8.122   2.122  -7.533
  391    HE2  TYR  54           HE2      TYR  54  -6.822  -1.935  -7.295
  392    HH   TYR  54           HH       TYR  54  -9.145  -1.100  -7.480
  393    H    VAL  55           HN       VAL  55  -0.366   1.014  -6.718
  394    HA   VAL  55           HA       VAL  55   0.503   3.573  -5.574
  395    HB   VAL  55           HB       VAL  55   1.983   2.411  -3.969
  396   1HG1  VAL  55          HG11      VAL  55  -0.972   1.856  -3.703
  397   2HG1  VAL  55          HG12      VAL  55  -0.097   3.280  -3.142
  398   3HG1  VAL  55          HG13      VAL  55   0.192   1.716  -2.385
  399   1HG2  VAL  55          HG21      VAL  55   1.619   0.056  -3.456
  400   2HG2  VAL  55          HG22      VAL  55   2.128   0.260  -5.133
  401   3HG2  VAL  55          HG23      VAL  55   0.434  -0.057  -4.757
  402    H    GLU  56           HN       GLU  56   2.996   3.521  -5.371
  403    HA   GLU  56           HA       GLU  56   4.207   2.152  -7.662
  404   1HB   GLU  56          HB2       GLU  56   3.664   4.416  -8.409
  405   2HB   GLU  56          HB1       GLU  56   4.496   5.094  -7.016
  406   1HG   GLU  56          HG2       GLU  56   6.607   4.144  -7.839
  407   2HG   GLU  56          HG1       GLU  56   5.757   3.527  -9.256
  408    H    VAL  57           HN       VAL  57   5.525   0.803  -6.589
  409    HA   VAL  57           HA       VAL  57   6.792   1.398  -4.137
  410    HB   VAL  57           HB       VAL  57   7.573  -0.701  -6.169
  411   1HG1  VAL  57          HG11      VAL  57   8.151  -0.482  -3.216
  412   2HG1  VAL  57          HG12      VAL  57   9.318  -0.313  -4.527
  413   3HG1  VAL  57          HG13      VAL  57   8.542  -1.868  -4.233
  414   1HG2  VAL  57          HG21      VAL  57   5.228  -0.904  -5.531
  415   2HG2  VAL  57          HG22      VAL  57   5.679  -0.880  -3.826
  416   3HG2  VAL  57          HG23      VAL  57   6.180  -2.225  -4.852
  417    H    ILE  58           HN       ILE  58   8.111   3.139  -4.087
  418    HA   ILE  58           HA       ILE  58   9.790   4.004  -6.164
  419    HB   ILE  58           HB       ILE  58  10.147   4.513  -3.208
  420   1HG1  ILE  58          HG12      ILE  58   8.628   6.162  -5.241
  421   2HG1  ILE  58          HG11      ILE  58   7.866   5.066  -4.092
  422   1HG2  ILE  58          HG21      ILE  58  11.099   6.042  -5.627
  423   2HG2  ILE  58          HG22      ILE  58  12.101   5.114  -4.512
  424   3HG2  ILE  58          HG23      ILE  58  11.275   6.567  -3.953
  425   1HD1  ILE  58          HD11      ILE  58   9.513   7.484  -3.390
  426   2HD1  ILE  58          HD12      ILE  58   8.734   6.393  -2.244
  427   3HD1  ILE  58          HD13      ILE  58   7.754   7.371  -3.337
  428    H    VAL  59           HN       VAL  59  10.319   1.803  -3.477
  429    HA   VAL  59           HA       VAL  59  12.970   1.174  -4.600
  430    HB   VAL  59           HB       VAL  59  12.239   1.044  -1.673
  431   1HG1  VAL  59          HG11      VAL  59  14.648   0.716  -1.347
  432   2HG1  VAL  59          HG12      VAL  59  14.878   0.711  -3.095
  433   3HG1  VAL  59          HG13      VAL  59  13.937  -0.567  -2.326
  434   1HG2  VAL  59          HG21      VAL  59  12.312   3.360  -2.391
  435   2HG2  VAL  59          HG22      VAL  59  13.878   3.095  -3.159
  436   3HG2  VAL  59          HG23      VAL  59  13.727   2.988  -1.405
  437    HA   PRO  60           HA       PRO  60  10.569  -2.708  -5.043
  438   1HB   PRO  60          HB2       PRO  60  13.083  -3.420  -6.461
  439   2HB   PRO  60          HB1       PRO  60  11.404  -3.610  -6.980
  440   1HG   PRO  60          HG2       PRO  60  12.946  -1.705  -8.023
  441   2HG   PRO  60          HG1       PRO  60  11.232  -1.405  -7.677
  442   1HD   PRO  60          HD2       PRO  60  13.657  -0.543  -6.154
  443   2HD   PRO  60          HD1       PRO  60  12.148   0.340  -6.466
  Start of MODEL    4
    1   1H    MET   1          HT1       MET   1  19.143  -0.855   3.144
    2   2H    MET   1          HT2       MET   1  17.671  -1.641   2.864
    3   3H    MET   1          HT3       MET   1  19.080  -2.545   3.102
    4    HA   MET   1           HA       MET   1  17.667  -2.560   5.062
    5   1HB   MET   1          HB2       MET   1  20.282  -1.068   5.348
    6   2HB   MET   1          HB1       MET   1  19.412  -1.821   6.678
    7   1HG   MET   1          HG2       MET   1  19.662  -4.003   5.590
    8   2HG   MET   1          HG1       MET   1  20.569  -3.237   4.287
    9   1HE   MET   1          HE1       MET   1  23.005  -2.165   4.598
   10   2HE   MET   1          HE2       MET   1  23.759  -1.962   6.180
   11   3HE   MET   1          HE3       MET   1  22.277  -1.089   5.789
   12    H    ASP   2           HN       ASP   2  17.153   0.021   3.406
   13    HA   ASP   2           HA       ASP   2  16.650   1.862   5.630
   14   1HB   ASP   2          HB2       ASP   2  16.237   3.555   3.901
   15   2HB   ASP   2          HB1       ASP   2  17.810   2.795   3.678
   16    H    GLN   3           HN       GLN   3  15.120  -0.653   4.640
   17    HA   GLN   3           HA       GLN   3  12.975  -1.388   4.626
   18   1HB   GLN   3          HB2       GLN   3  12.810  -0.155   6.733
   19   2HB   GLN   3          HB1       GLN   3  12.405   1.313   5.855
   20   1HG   GLN   3          HG2       GLN   3  10.351   0.278   5.053
   21   2HG   GLN   3          HG1       GLN   3  10.758  -1.205   5.916
   22   1HE2  GLN   3          HE21      GLN   3   8.897  -1.117   7.162
   23   2HE2  GLN   3          HE22      GLN   3   8.693   0.028   8.440
   24    HA   PRO   4           HA       PRO   4  12.061   0.331   0.499
   25   1HB   PRO   4          HB2       PRO   4  10.224  -2.014   0.610
   26   2HB   PRO   4          HB1       PRO   4  11.333  -1.512  -0.672
   27   1HG   PRO   4          HG2       PRO   4  11.934  -3.567   0.904
   28   2HG   PRO   4          HG1       PRO   4  13.186  -2.417   0.398
   29   1HD   PRO   4          HD2       PRO   4  11.790  -2.669   3.027
   30   2HD   PRO   4          HD1       PRO   4  13.480  -2.253   2.682
   31    H    CYS   5           HN       CYS   5  10.522   1.771  -0.031
   32    HA   CYS   5           HA       CYS   5   7.955   1.664   1.408
   33   1HB   CYS   5          HB2       CYS   5   9.564   4.143   0.768
   34   2HB   CYS   5          HB1       CYS   5   7.960   4.131   1.492
   35    HG   CYS   5           HG       CYS   5   9.422   4.648   3.658
   36    H    CYS   6           HN       CYS   6   6.381   3.318   0.305
   37    HA   CYS   6           HA       CYS   6   6.676   3.522  -2.560
   38   1HB   CYS   6          HB2       CYS   6   4.822   2.167  -3.184
   39   2HB   CYS   6          HB1       CYS   6   5.837   1.185  -2.144
   40    HG   CYS   6           HG       CYS   6   3.224   2.848  -0.757
   41    H    ARG   7           HN       ARG   7   4.478   4.356  -3.492
   42    HA   ARG   7           HA       ARG   7   3.117   6.092  -1.569
   43   1HB   ARG   7          HB2       ARG   7   3.437   8.087  -2.914
   44   2HB   ARG   7          HB1       ARG   7   4.994   7.421  -2.441
   45   1HG   ARG   7          HG2       ARG   7   5.211   6.398  -4.668
   46   2HG   ARG   7          HG1       ARG   7   3.676   7.138  -5.134
   47   1HD   ARG   7          HD2       ARG   7   6.179   8.595  -4.289
   48   2HD   ARG   7          HD1       ARG   7   5.551   8.469  -5.932
   49    HE   ARG   7           HE       ARG   7   3.487   9.595  -4.702
   50   1HH1  ARG   7          HH11      ARG   7   6.889  10.319  -4.485
   51   2HH1  ARG   7          HH12      ARG   7   6.640  12.003  -4.159
   52   1HH2  ARG   7          HH21      ARG   7   3.151  11.807  -4.270
   53   2HH2  ARG   7          HH22      ARG   7   4.515  12.848  -4.036
   54    H    GLY   8           HN       GLY   8   1.043   6.686  -2.137
   55   1HA   GLY   8          HA2       GLY   8  -0.224   4.985  -4.080
   56   2HA   GLY   8          HA1       GLY   8  -1.021   6.151  -3.037
   57    H    LEU   9           HN       LEU   9  -0.978   5.453  -6.051
   58    HA   LEU   9           HA       LEU   9  -0.242   8.018  -7.197
   59   1HB   LEU   9          HB2       LEU   9  -1.134   5.384  -8.300
   60   2HB   LEU   9          HB1       LEU   9  -1.260   6.820  -9.297
   61    HG   LEU   9           HG       LEU   9   0.794   5.562  -9.758
   62   1HD1  LEU   9          HD11      LEU   9   1.271   8.231  -8.445
   63   2HD1  LEU   9          HD12      LEU   9   0.798   7.959 -10.121
   64   3HD1  LEU   9          HD13      LEU   9   2.377   7.419  -9.552
   65   1HD2  LEU   9          HD21      LEU   9   1.500   6.181  -6.893
   66   2HD2  LEU   9          HD22      LEU   9   2.583   5.473  -8.090
   67   3HD2  LEU   9          HD23      LEU   9   1.154   4.586  -7.561
   68    H    TYR  10           HN       TYR  10  -3.100   6.159  -6.436
   69    HA   TYR  10           HA       TYR  10  -4.721   8.575  -6.755
   70   1HB   TYR  10          HB2       TYR  10  -5.607   5.899  -7.839
   71   2HB   TYR  10          HB1       TYR  10  -6.467   7.432  -7.946
   72    HD1  TYR  10           HD1      TYR  10  -3.988   5.297  -9.453
   73    HD2  TYR  10           HD2      TYR  10  -5.503   9.272  -9.366
   74    HE1  TYR  10           HE1      TYR  10  -2.891   5.758 -11.605
   75    HE2  TYR  10           HE2      TYR  10  -4.411   9.742 -11.517
   76    HH   TYR  10           HH       TYR  10  -3.084   7.285 -13.481
   77    H    ASP  11           HN       ASP  11  -6.518   8.681  -5.390
   78    HA   ASP  11           HA       ASP  11  -6.281   7.437  -2.912
   79   1HB   ASP  11          HB2       ASP  11  -8.736   8.220  -2.651
   80   2HB   ASP  11          HB1       ASP  11  -7.471   9.418  -2.871
   81    H    PHE  12           HN       PHE  12  -7.793   6.061  -1.827
   82    HA   PHE  12           HA       PHE  12  -9.518   4.347  -3.342
   83   1HB   PHE  12          HB2       PHE  12  -6.771   3.535  -2.714
   84   2HB   PHE  12          HB1       PHE  12  -8.002   2.389  -2.198
   85    HD1  PHE  12           HD1      PHE  12  -6.035   3.552  -4.908
   86    HD2  PHE  12           HD2      PHE  12  -9.732   1.670  -3.964
   87    HE1  PHE  12           HE1      PHE  12  -6.182   2.696  -7.210
   88    HE2  PHE  12           HE2      PHE  12  -9.886   0.809  -6.264
   89    HZ   PHE  12           HZ       PHE  12  -8.110   1.324  -7.890
   90    H    GLU  13           HN       GLU  13 -11.147   3.787  -2.091
   91    HA   GLU  13           HA       GLU  13 -10.860   4.017   0.811
   92   1HB   GLU  13          HB2       GLU  13 -13.355   3.937   0.815
   93   2HB   GLU  13          HB1       GLU  13 -12.695   5.290  -0.092
   94   1HG   GLU  13          HG2       GLU  13 -13.095   4.115  -2.178
   95   2HG   GLU  13          HG1       GLU  13 -13.705   2.719  -1.290
   96    HA   PRO  14           HA       PRO  14 -10.790  -0.421   0.995
   97   1HB   PRO  14          HB2       PRO  14 -11.033  -0.753   3.661
   98   2HB   PRO  14          HB1       PRO  14  -9.551  -0.136   2.920
   99   1HG   PRO  14          HG2       PRO  14 -11.760   1.364   4.272
  100   2HG   PRO  14          HG1       PRO  14 -10.007   1.594   4.404
  101   1HD   PRO  14          HD2       PRO  14 -11.616   3.141   2.831
  102   2HD   PRO  14          HD1       PRO  14  -9.903   2.840   2.481
  103    H    GLU  15           HN       GLU  15 -12.325  -1.925   0.701
  104    HA   GLU  15           HA       GLU  15 -15.086  -1.261   1.248
  105   1HB   GLU  15          HB2       GLU  15 -14.473  -2.316  -0.881
  106   2HB   GLU  15          HB1       GLU  15 -13.865  -3.722  -0.018
  107   1HG   GLU  15          HG2       GLU  15 -16.109  -4.190   0.815
  108   2HG   GLU  15          HG1       GLU  15 -16.723  -2.776  -0.040
  109    H    ASN  16           HN       ASN  16 -12.681  -3.577   2.381
  110    HA   ASN  16           HA       ASN  16 -14.453  -4.192   4.645
  111   1HB   ASN  16          HB2       ASN  16 -13.619  -6.541   4.596
  112   2HB   ASN  16          HB1       ASN  16 -14.578  -6.112   3.183
  113   1HD2  ASN  16          HD21      ASN  16 -13.674  -7.728   1.937
  114   2HD2  ASN  16          HD22      ASN  16 -12.053  -7.647   1.345
  115    H    GLN  17           HN       GLN  17 -13.105  -5.397   6.405
  116    HA   GLN  17           HA       GLN  17 -10.985  -3.625   7.139
  117   1HB   GLN  17          HB2       GLN  17 -10.821  -5.007   9.170
  118   2HB   GLN  17          HB1       GLN  17 -12.479  -4.525   8.837
  119   1HG   GLN  17          HG2       GLN  17 -12.981  -6.713   7.956
  120   2HG   GLN  17          HG1       GLN  17 -11.301  -7.208   8.149
  121   1HE2  GLN  17          HE21      GLN  17 -13.746  -8.342   9.283
  122   2HE2  GLN  17          HE22      GLN  17 -13.530  -8.322  10.996
  123    H    GLY  18           HN       GLY  18  -8.799  -4.040   7.350
  124   1HA   GLY  18          HA2       GLY  18  -6.951  -5.627   7.350
  125   2HA   GLY  18          HA1       GLY  18  -7.839  -6.565   6.160
  126    H    GLU  19           HN       GLU  19  -8.607  -4.069   4.708
  127    HA   GLU  19           HA       GLU  19  -6.222  -3.922   3.069
  128   1HB   GLU  19          HB2       GLU  19  -8.839  -2.471   2.668
  129   2HB   GLU  19          HB1       GLU  19  -7.585  -2.753   1.471
  130   1HG   GLU  19          HG2       GLU  19  -8.027  -5.150   1.564
  131   2HG   GLU  19          HG1       GLU  19  -9.287  -4.869   2.765
  132    H    LEU  20           HN       LEU  20  -5.673  -1.680   2.160
  133    HA   LEU  20           HA       LEU  20  -5.471   0.181   4.434
  134   1HB   LEU  20          HB2       LEU  20  -3.355  -0.811   3.486
  135   2HB   LEU  20          HB1       LEU  20  -3.679   0.083   2.013
  136    HG   LEU  20           HG       LEU  20  -3.587   2.195   3.322
  137   1HD1  LEU  20          HD11      LEU  20  -2.628   2.145   5.571
  138   2HD1  LEU  20          HD12      LEU  20  -2.671   0.381   5.549
  139   3HD1  LEU  20          HD13      LEU  20  -4.175   1.301   5.506
  140   1HD2  LEU  20          HD21      LEU  20  -1.152   2.196   3.610
  141   2HD2  LEU  20          HD22      LEU  20  -1.634   1.421   2.101
  142   3HD2  LEU  20          HD23      LEU  20  -1.143   0.436   3.479
  143    H    GLY  21           HN       GLY  21  -6.542   2.035   4.306
  144   1HA   GLY  21          HA2       GLY  21  -7.420   2.951   1.638
  145   2HA   GLY  21          HA1       GLY  21  -8.330   3.207   3.119
  146    H    PHE  22           HN       PHE  22  -6.648   4.799   0.904
  147    HA   PHE  22           HA       PHE  22  -6.179   7.071   2.579
  148   1HB   PHE  22          HB2       PHE  22  -3.873   5.391   1.705
  149   2HB   PHE  22          HB1       PHE  22  -3.678   7.138   1.681
  150    HD1  PHE  22           HD1      PHE  22  -4.537   8.315   3.924
  151    HD2  PHE  22           HD2      PHE  22  -3.217   4.282   3.595
  152    HE1  PHE  22           HE1      PHE  22  -4.020   8.291   6.330
  153    HE2  PHE  22           HE2      PHE  22  -2.700   4.251   6.001
  154    HZ   PHE  22           HZ       PHE  22  -3.102   6.257   7.371
  155    H    LYS  23           HN       LYS  23  -4.537   8.592   1.013
  156    HA   LYS  23           HA       LYS  23  -5.833   8.529  -1.617
  157   1HB   LYS  23          HB2       LYS  23  -5.611  11.070  -1.551
  158   2HB   LYS  23          HB1       LYS  23  -6.907  10.326  -0.618
  159   1HG   LYS  23          HG2       LYS  23  -4.287  10.867   0.680
  160   2HG   LYS  23          HG1       LYS  23  -5.430  12.192   0.435
  161   1HD   LYS  23          HD2       LYS  23  -6.233   9.603   1.725
  162   2HD   LYS  23          HD1       LYS  23  -5.541  10.933   2.661
  163   1HE   LYS  23          HE2       LYS  23  -7.341  12.404   1.826
  164   2HE   LYS  23          HE1       LYS  23  -8.044  11.029   0.975
  165   1HZ   LYS  23          HZ1       LYS  23  -7.683  11.252   3.917
  166   2HZ   LYS  23          HZ2       LYS  23  -8.341   9.920   3.108
  167   3HZ   LYS  23          HZ3       LYS  23  -9.148  11.406   3.083
  168    H    GLU  24           HN       GLU  24  -4.708  10.068  -3.172
  169    HA   GLU  24           HA       GLU  24  -2.177   9.124  -3.770
  170   1HB   GLU  24          HB2       GLU  24  -2.054  11.000  -5.362
  171   2HB   GLU  24          HB1       GLU  24  -3.618  10.195  -5.415
  172   1HG   GLU  24          HG2       GLU  24  -4.214  12.057  -3.640
  173   2HG   GLU  24          HG1       GLU  24  -2.907  12.906  -4.466
  174    H    GLY  25           HN       GLY  25  -0.120  10.020  -3.632
  175   1HA   GLY  25          HA2       GLY  25   1.572  11.392  -2.834
  176   2HA   GLY  25          HA1       GLY  25   0.351  12.425  -2.106
  177    H    ASP  26           HN       ASP  26  -0.532   9.505  -1.059
  178    HA   ASP  26           HA       ASP  26   0.664   9.924   1.530
  179   1HB   ASP  26          HB2       ASP  26  -1.696   9.190   1.255
  180   2HB   ASP  26          HB1       ASP  26  -1.116   7.665   0.591
  181    H    ILE  27           HN       ILE  27   2.343   8.879   2.416
  182    HA   ILE  27           HA       ILE  27   3.733   6.900   0.761
  183    HB   ILE  27           HB       ILE  27   4.753   8.381   3.187
  184   1HG1  ILE  27          HG12      ILE  27   4.253   9.914   1.328
  185   2HG1  ILE  27          HG11      ILE  27   5.986   9.787   1.604
  186   1HG2  ILE  27          HG21      ILE  27   5.923   6.298   2.833
  187   2HG2  ILE  27          HG22      ILE  27   6.967   7.647   2.384
  188   3HG2  ILE  27          HG23      ILE  27   6.174   6.692   1.132
  189   1HD1  ILE  27          HD11      ILE  27   4.442   8.387  -0.567
  190   2HD1  ILE  27          HD12      ILE  27   6.181   8.279  -0.298
  191   3HD1  ILE  27          HD13      ILE  27   5.456   9.816  -0.767
  192    H    ILE  28           HN       ILE  28   3.826   4.826   1.302
  193    HA   ILE  28           HA       ILE  28   3.200   4.041   4.072
  194    HB   ILE  28           HB       ILE  28   2.278   2.611   1.574
  195   1HG1  ILE  28          HG12      ILE  28   1.027   4.693   2.015
  196   2HG1  ILE  28          HG11      ILE  28   0.022   3.266   2.237
  197   1HG2  ILE  28          HG21      ILE  28   2.781   1.051   3.356
  198   2HG2  ILE  28          HG22      ILE  28   1.036   1.164   3.132
  199   3HG2  ILE  28          HG23      ILE  28   1.806   1.989   4.487
  200   1HD1  ILE  28          HD11      ILE  28   0.384   3.453   4.678
  201   2HD1  ILE  28          HD12      ILE  28  -0.440   4.845   3.977
  202   3HD1  ILE  28          HD13      ILE  28   1.269   4.952   4.394
  203    H    THR  29           HN       THR  29   4.382   2.328   4.909
  204    HA   THR  29           HA       THR  29   6.783   1.643   3.407
  205    HB   THR  29           HB       THR  29   7.695   0.800   5.443
  206    HG1  THR  29           HG1      THR  29   5.116   0.325   6.051
  207   1HG2  THR  29          HG21      THR  29   6.045   3.252   6.070
  208   2HG2  THR  29          HG22      THR  29   7.629   3.239   5.294
  209   3HG2  THR  29          HG23      THR  29   7.463   2.709   6.968
  210    H    LEU  30           HN       LEU  30   7.238  -0.335   2.597
  211    HA   LEU  30           HA       LEU  30   5.082  -2.312   2.649
  212   1HB   LEU  30          HB2       LEU  30   6.222  -1.439   0.514
  213   2HB   LEU  30          HB1       LEU  30   7.580  -2.443   0.988
  214    HG   LEU  30           HG       LEU  30   6.050  -4.420   0.960
  215   1HD1  LEU  30          HD11      LEU  30   3.944  -3.215   1.263
  216   2HD1  LEU  30          HD12      LEU  30   3.913  -4.223  -0.183
  217   3HD1  LEU  30          HD13      LEU  30   4.137  -2.480  -0.328
  218   1HD2  LEU  30          HD21      LEU  30   7.524  -3.936  -0.916
  219   2HD2  LEU  30          HD22      LEU  30   6.304  -2.873  -1.616
  220   3HD2  LEU  30          HD23      LEU  30   5.991  -4.604  -1.481
  221    H    THR  31           HN       THR  31   5.265  -4.257   3.630
  222    HA   THR  31           HA       THR  31   7.757  -5.488   4.165
  223    HB   THR  31           HB       THR  31   7.874  -3.788   5.911
  224    HG1  THR  31           HG1      THR  31   8.743  -5.842   6.398
  225   1HG2  THR  31          HG21      THR  31   6.271  -3.727   7.738
  226   2HG2  THR  31          HG22      THR  31   5.338  -5.022   6.991
  227   3HG2  THR  31          HG23      THR  31   5.447  -3.449   6.203
  228    H    ASN  32           HN       ASN  32   4.853  -5.840   3.250
  229    HA   ASN  32           HA       ASN  32   4.551  -8.522   4.301
  230   1HB   ASN  32          HB2       ASN  32   2.472  -6.358   4.565
  231   2HB   ASN  32          HB1       ASN  32   2.103  -8.067   4.699
  232   1HD2  ASN  32          HD21      ASN  32   2.946  -9.247   6.464
  233   2HD2  ASN  32          HD22      ASN  32   3.440  -8.448   7.914
  234    H    GLN  33           HN       GLN  33   2.654  -9.596   3.035
  235    HA   GLN  33           HA       GLN  33   1.756  -8.412   0.638
  236   1HB   GLN  33          HB2       GLN  33   4.415  -9.562   0.570
  237   2HB   GLN  33          HB1       GLN  33   3.336 -10.312  -0.605
  238   1HG   GLN  33          HG2       GLN  33   2.846  -8.261  -1.616
  239   2HG   GLN  33          HG1       GLN  33   3.598  -7.341  -0.301
  240   1HE2  GLN  33          HE21      GLN  33   5.852  -7.239  -0.192
  241   2HE2  GLN  33          HE22      GLN  33   6.859  -7.632  -1.539
  242    H    ILE  34           HN       ILE  34   0.423  -9.697  -0.590
  243    HA   ILE  34           HA       ILE  34  -0.307 -12.223   0.681
  244    HB   ILE  34           HB       ILE  34  -1.935 -10.292  -0.967
  245   1HG1  ILE  34          HG12      ILE  34  -3.424 -10.473   1.092
  246   2HG1  ILE  34          HG11      ILE  34  -2.098 -11.335   1.863
  247   1HG2  ILE  34          HG21      ILE  34  -2.525 -12.489  -1.757
  248   2HG2  ILE  34          HG22      ILE  34  -3.820 -11.887  -0.722
  249   3HG2  ILE  34          HG23      ILE  34  -2.683 -13.085  -0.104
  250   1HD1  ILE  34          HD11      ILE  34  -2.165  -8.964   2.467
  251   2HD1  ILE  34          HD12      ILE  34  -1.937  -8.536   0.771
  252   3HD1  ILE  34          HD13      ILE  34  -0.670  -9.401   1.640
  253    H    ASP  35           HN       ASP  35   0.569 -10.729  -2.331
  254    HA   ASP  35           HA       ASP  35   1.452 -13.189  -3.440
  255   1HB   ASP  35          HB2       ASP  35  -0.089 -13.223  -5.399
  256   2HB   ASP  35          HB1       ASP  35  -0.892 -13.584  -3.875
  257    H    GLU  36           HN       GLU  36   1.578 -12.639  -6.094
  258    HA   GLU  36           HA       GLU  36   3.561 -10.604  -6.175
  259   1HB   GLU  36          HB2       GLU  36   3.728 -11.146  -8.563
  260   2HB   GLU  36          HB1       GLU  36   3.753 -12.594  -7.567
  261   1HG   GLU  36          HG2       GLU  36   1.416 -13.012  -8.090
  262   2HG   GLU  36          HG1       GLU  36   1.359 -11.539  -9.058
  263    H    ASN  37           HN       ASN  37   0.188 -10.539  -6.490
  264    HA   ASN  37           HA       ASN  37   0.251  -8.094  -8.106
  265   1HB   ASN  37          HB2       ASN  37  -1.301  -9.936  -8.769
  266   2HB   ASN  37          HB1       ASN  37  -2.160  -9.704  -7.249
  267   1HD2  ASN  37          HD21      ASN  37  -0.772  -7.072  -9.065
  268   2HD2  ASN  37          HD22      ASN  37  -2.270  -6.365  -9.559
  269    H    TRP  38           HN       TRP  38  -1.315  -9.307  -5.125
  270    HA   TRP  38           HA       TRP  38  -1.725  -6.541  -4.283
  271   1HB   TRP  38          HB2       TRP  38  -2.637  -8.874  -2.647
  272   2HB   TRP  38          HB1       TRP  38  -3.369  -7.281  -2.828
  273    HD1  TRP  38           HD1      TRP  38  -3.609  -7.282  -6.031
  274    HE1  TRP  38           HE1      TRP  38  -5.377  -8.783  -7.143
  275    HE3  TRP  38           HE3      TRP  38  -4.337 -10.631  -2.237
  276    HZ2  TRP  38           HZ2      TRP  38  -6.883 -11.080  -6.499
  277    HZ3  TRP  38           HZ3      TRP  38  -5.961 -12.450  -2.565
  278    HH2  TRP  38           HH2      TRP  38  -7.208 -12.667  -4.652
  279    H    TYR  39           HN       TYR  39  -0.486  -5.545  -2.846
  280    HA   TYR  39           HA       TYR  39   1.464  -7.169  -1.329
  281   1HB   TYR  39          HB2       TYR  39   1.594  -4.255  -2.142
  282   2HB   TYR  39          HB1       TYR  39   2.806  -5.090  -1.185
  283    HD1  TYR  39           HD1      TYR  39   1.973  -7.575  -3.272
  284    HD2  TYR  39           HD2      TYR  39   3.787  -3.730  -3.509
  285    HE1  TYR  39           HE1      TYR  39   3.122  -8.247  -5.338
  286    HE2  TYR  39           HE2      TYR  39   4.938  -4.396  -5.574
  287    HH   TYR  39           HH       TYR  39   4.116  -7.169  -7.326
  288    H    GLU  40           HN       GLU  40   2.206  -5.900   0.743
  289    HA   GLU  40           HA       GLU  40   0.005  -4.497   1.993
  290   1HB   GLU  40          HB2       GLU  40  -0.636  -6.773   2.415
  291   2HB   GLU  40          HB1       GLU  40   0.967  -7.166   3.011
  292   1HG   GLU  40          HG2       GLU  40   0.627  -5.676   4.913
  293   2HG   GLU  40          HG1       GLU  40  -0.976  -5.263   4.305
  294    H    GLY  41           HN       GLY  41   0.549  -3.239   3.718
  295   1HA   GLY  41          HA2       GLY  41   3.158  -3.413   4.949
  296   2HA   GLY  41          HA1       GLY  41   2.951  -2.022   3.893
  297    H    MET  42           HN       MET  42   3.420  -0.993   6.096
  298    HA   MET  42           HA       MET  42   0.840  -0.276   7.266
  299   1HB   MET  42          HB2       MET  42   1.536  -0.594   9.524
  300   2HB   MET  42          HB1       MET  42   1.852  -2.094   8.662
  301   1HG   MET  42          HG2       MET  42   4.199  -1.568   8.515
  302   2HG   MET  42          HG1       MET  42   3.921   0.007   9.256
  303   1HE   MET  42          HE1       MET  42   5.884  -1.970  12.027
  304   2HE   MET  42          HE2       MET  42   5.795  -0.451  11.135
  305   3HE   MET  42          HE3       MET  42   6.121  -1.958  10.279
  306    H    ILE  43           HN       ILE  43   0.950   1.613   8.631
  307    HA   ILE  43           HA       ILE  43   3.255   3.355   8.237
  308    HB   ILE  43           HB       ILE  43   1.840   3.902   6.342
  309   1HG1  ILE  43          HG12      ILE  43   1.318   6.323   6.922
  310   2HG1  ILE  43          HG11      ILE  43   1.824   5.946   8.567
  311   1HG2  ILE  43          HG21      ILE  43  -0.438   4.714   6.610
  312   2HG2  ILE  43          HG22      ILE  43  -0.344   4.437   8.348
  313   3HG2  ILE  43          HG23      ILE  43  -0.278   3.072   7.234
  314   1HD1  ILE  43          HD11      ILE  43   4.056   5.499   7.863
  315   2HD1  ILE  43          HD12      ILE  43   3.572   7.024   7.120
  316   3HD1  ILE  43          HD13      ILE  43   3.592   5.542   6.162
  317    H    HIS  44           HN       HIS  44   3.729   4.375  10.064
  318    HA   HIS  44           HA       HIS  44   3.595   5.259  12.149
  319   1HB   HIS  44          HB2       HIS  44   1.835   6.684  11.129
  320   2HB   HIS  44          HB1       HIS  44   0.628   5.494  11.605
  321    HD1  HIS  44           HD1      HIS  44   2.776   8.222  12.953
  322    HD2  HIS  44           HD2      HIS  44   0.019   5.449  14.356
  323    HE1  HIS  44           HE1      HIS  44   2.207   8.962  15.288
  324    HE2  HIS  44           HE2      HIS  44   0.585   7.233  16.140
  325    H    GLY  45           HN       GLY  45   0.400   3.678  12.113
  326   1HA   GLY  45          HA2       GLY  45   1.398   1.510  13.770
  327   2HA   GLY  45          HA1       GLY  45   0.302   2.624  14.570
  328    H    GLU  46           HN       GLU  46   0.016   1.747  11.180
  329    HA   GLU  46           HA       GLU  46  -2.102  -0.160  11.758
  330   1HB   GLU  46          HB2       GLU  46  -3.732   1.019  10.323
  331   2HB   GLU  46          HB1       GLU  46  -3.315   1.938  11.763
  332   1HG   GLU  46          HG2       GLU  46  -1.766   3.296  10.421
  333   2HG   GLU  46          HG1       GLU  46  -2.254   2.398   8.984
  334    H    SER  47           HN       SER  47  -2.271  -1.724  10.250
  335    HA   SER  47           HA       SER  47  -0.557  -1.457   7.877
  336   1HB   SER  47          HB2       SER  47  -0.502  -3.925   7.851
  337   2HB   SER  47          HB1       SER  47   0.084  -3.274   9.382
  338    HG   SER  47           HG       SER  47  -1.524  -5.091   9.388
  339    H    GLY  48           HN       GLY  48  -1.291  -2.873   6.003
  340   1HA   GLY  48          HA2       GLY  48  -3.958  -3.579   5.576
  341   2HA   GLY  48          HA1       GLY  48  -3.765  -1.912   5.048
  342    H    PHE  49           HN       PHE  49  -4.358  -4.321   3.458
  343    HA   PHE  49           HA       PHE  49  -1.955  -4.349   1.756
  344   1HB   PHE  49          HB2       PHE  49  -2.644  -6.517   0.926
  345   2HB   PHE  49          HB1       PHE  49  -2.580  -6.559   2.684
  346    HD1  PHE  49           HD1      PHE  49  -4.746  -6.673  -0.253
  347    HD2  PHE  49           HD2      PHE  49  -4.600  -6.776   3.999
  348    HE1  PHE  49           HE1      PHE  49  -7.062  -7.503  -0.197
  349    HE2  PHE  49           HE2      PHE  49  -6.913  -7.610   4.062
  350    HZ   PHE  49           HZ       PHE  49  -8.133  -8.012   1.958
  351    H    PHE  50           HN       PHE  50  -2.312  -4.522  -0.560
  352    HA   PHE  50           HA       PHE  50  -4.718  -4.133  -1.872
  353   1HB   PHE  50          HB2       PHE  50  -4.102  -1.835  -0.484
  354   2HB   PHE  50          HB1       PHE  50  -3.455  -1.497  -2.087
  355    HD1  PHE  50           HD1      PHE  50  -4.961  -1.554  -4.057
  356    HD2  PHE  50           HD2      PHE  50  -6.430  -1.871  -0.076
  357    HE1  PHE  50           HE1      PHE  50  -7.222  -0.994  -4.851
  358    HE2  PHE  50           HE2      PHE  50  -8.692  -1.313  -0.862
  359    HZ   PHE  50           HZ       PHE  50  -9.091  -0.873  -3.252
  360    HA   PRO  51           HA       PRO  51  -1.993  -5.291  -5.213
  361   1HB   PRO  51          HB2       PRO  51  -3.635  -3.964  -7.133
  362   2HB   PRO  51          HB1       PRO  51  -3.580  -5.687  -6.764
  363   1HG   PRO  51          HG2       PRO  51  -5.475  -3.619  -5.834
  364   2HG   PRO  51          HG1       PRO  51  -5.709  -5.366  -6.010
  365   1HD   PRO  51          HD2       PRO  51  -5.477  -4.199  -3.599
  366   2HD   PRO  51          HD1       PRO  51  -4.818  -5.823  -3.915
  367    H    ILE  52           HN       ILE  52  -0.690  -4.338  -6.848
  368    HA   ILE  52           HA       ILE  52   0.573  -1.968  -6.106
  369    HB   ILE  52           HB       ILE  52   0.614  -3.136  -8.885
  370   1HG1  ILE  52          HG12      ILE  52   2.364  -3.927  -6.549
  371   2HG1  ILE  52          HG11      ILE  52   0.977  -4.864  -7.093
  372   1HG2  ILE  52          HG21      ILE  52   2.639  -1.556  -7.304
  373   2HG2  ILE  52          HG22      ILE  52   1.710  -0.987  -8.691
  374   3HG2  ILE  52          HG23      ILE  52   2.918  -2.254  -8.900
  375   1HD1  ILE  52          HD11      ILE  52   2.051  -5.159  -9.274
  376   2HD1  ILE  52          HD12      ILE  52   3.031  -5.798  -7.953
  377   3HD1  ILE  52          HD13      ILE  52   3.450  -4.253  -8.694
  378    H    ASN  53           HN       ASN  53  -2.284  -2.440  -7.966
  379    HA   ASN  53           HA       ASN  53  -2.199  -0.119  -9.564
  380   1HB   ASN  53          HB2       ASN  53  -4.547  -1.718  -8.530
  381   2HB   ASN  53          HB1       ASN  53  -4.650  -0.474  -9.767
  382   1HD2  ASN  53          HD21      ASN  53  -3.555  -3.672  -9.005
  383   2HD2  ASN  53          HD22      ASN  53  -3.251  -4.178 -10.629
  384    H    TYR  54           HN       TYR  54  -1.974  -0.151  -6.378
  385    HA   TYR  54           HA       TYR  54  -3.668   2.223  -5.991
  386   1HB   TYR  54          HB2       TYR  54  -4.514   0.660  -4.489
  387   2HB   TYR  54          HB1       TYR  54  -2.933  -0.041  -4.170
  388    HD1  TYR  54           HD1      TYR  54  -4.583   3.305  -3.784
  389    HD2  TYR  54           HD2      TYR  54  -2.122   0.295  -2.056
  390    HE1  TYR  54           HE1      TYR  54  -4.413   4.635  -1.722
  391    HE2  TYR  54           HE2      TYR  54  -1.943   1.617   0.008
  392    HH   TYR  54           HH       TYR  54  -2.149   3.977   0.703
  393    H    VAL  55           HN       VAL  55  -0.465   0.849  -5.637
  394    HA   VAL  55           HA       VAL  55   0.573   3.539  -5.120
  395    HB   VAL  55           HB       VAL  55   2.216   2.606  -3.470
  396   1HG1  VAL  55          HG11      VAL  55   0.398   2.344  -1.626
  397   2HG1  VAL  55          HG12      VAL  55  -0.714   2.795  -2.918
  398   3HG1  VAL  55          HG13      VAL  55   0.591   3.886  -2.456
  399   1HG2  VAL  55          HG21      VAL  55   1.994   0.246  -4.048
  400   2HG2  VAL  55          HG22      VAL  55   0.329   0.250  -3.467
  401   3HG2  VAL  55          HG23      VAL  55   1.657   0.511  -2.337
  402    H    GLU  56           HN       GLU  56   3.065   3.430  -5.124
  403    HA   GLU  56           HA       GLU  56   4.080   1.499  -7.072
  404   1HB   GLU  56          HB2       GLU  56   3.378   3.530  -8.322
  405   2HB   GLU  56          HB1       GLU  56   4.458   4.491  -7.322
  406   1HG   GLU  56          HG2       GLU  56   6.368   3.213  -8.174
  407   2HG   GLU  56          HG1       GLU  56   5.274   2.285  -9.200
  408    H    VAL  57           HN       VAL  57   5.731   0.557  -6.072
  409    HA   VAL  57           HA       VAL  57   6.987   1.483  -3.782
  410    HB   VAL  57           HB       VAL  57   7.132  -0.845  -4.395
  411   1HG1  VAL  57          HG11      VAL  57   7.215  -0.556  -6.834
  412   2HG1  VAL  57          HG12      VAL  57   8.469  -1.650  -6.250
  413   3HG1  VAL  57          HG13      VAL  57   8.882   0.005  -6.700
  414   1HG2  VAL  57          HG21      VAL  57   9.862   0.438  -4.390
  415   2HG2  VAL  57          HG22      VAL  57   9.521  -1.253  -4.025
  416   3HG2  VAL  57          HG23      VAL  57   8.903   0.019  -2.971
  417    H    ILE  58           HN       ILE  58   8.331   3.090  -3.429
  418    HA   ILE  58           HA       ILE  58   9.567   4.511  -5.611
  419    HB   ILE  58           HB       ILE  58   9.769   4.972  -2.632
  420   1HG1  ILE  58          HG12      ILE  58   8.114   6.436  -4.699
  421   2HG1  ILE  58          HG11      ILE  58   7.478   5.193  -3.628
  422   1HG2  ILE  58          HG21      ILE  58  10.598   6.711  -4.953
  423   2HG2  ILE  58          HG22      ILE  58  11.668   5.931  -3.787
  424   3HG2  ILE  58          HG23      ILE  58  10.578   7.214  -3.262
  425   1HD1  ILE  58          HD11      ILE  58   8.701   7.796  -2.745
  426   2HD1  ILE  58          HD12      ILE  58   8.000   6.563  -1.697
  427   3HD1  ILE  58          HD13      ILE  58   6.975   7.443  -2.832
  428    H    VAL  59           HN       VAL  59  10.706   2.685  -2.778
  429    HA   VAL  59           HA       VAL  59  13.289   2.371  -4.150
  430    HB   VAL  59           HB       VAL  59  13.706   3.890  -2.356
  431   1HG1  VAL  59          HG11      VAL  59  12.387   1.914  -0.500
  432   2HG1  VAL  59          HG12      VAL  59  11.677   3.431  -1.051
  433   3HG1  VAL  59          HG13      VAL  59  13.125   3.449  -0.044
  434   1HG2  VAL  59          HG21      VAL  59  15.395   2.162  -2.681
  435   2HG2  VAL  59          HG22      VAL  59  14.568   1.120  -1.523
  436   3HG2  VAL  59          HG23      VAL  59  15.295   2.634  -0.986
  437    HA   PRO  60           HA       PRO  60  12.035  -1.900  -3.400
  438   1HB   PRO  60          HB2       PRO  60  13.526  -3.032  -5.311
  439   2HB   PRO  60          HB1       PRO  60  12.081  -2.094  -5.708
  440   1HG   PRO  60          HG2       PRO  60  14.958  -1.301  -5.864
  441   2HG   PRO  60          HG1       PRO  60  13.634  -0.946  -6.988
  442   1HD   PRO  60          HD2       PRO  60  14.591   0.800  -5.064
  443   2HD   PRO  60          HD1       PRO  60  12.983   0.893  -5.808
  Start of MODEL    5
    1   1H    MET   1          HT1       MET   1  15.332   1.111  11.552
    2   2H    MET   1          HT2       MET   1  15.878   0.483  10.079
    3   3H    MET   1          HT3       MET   1  14.576  -0.246  10.876
    4    HA   MET   1           HA       MET   1  13.212   1.683  10.545
    5   1HB   MET   1          HB2       MET   1  15.611   2.781   9.063
    6   2HB   MET   1          HB1       MET   1  14.030   3.546   9.164
    7   1HG   MET   1          HG2       MET   1  14.303   3.730  11.603
    8   2HG   MET   1          HG1       MET   1  15.915   3.033  11.453
    9   1HE   MET   1          HE1       MET   1  17.756   5.768   9.317
   10   2HE   MET   1          HE2       MET   1  16.924   4.322   8.745
   11   3HE   MET   1          HE3       MET   1  17.940   4.244  10.185
   12    H    ASP   2           HN       ASP   2  11.762   1.387   8.955
   13    HA   ASP   2           HA       ASP   2  12.242  -0.595   6.982
   14   1HB   ASP   2          HB2       ASP   2   9.932   1.344   7.237
   15   2HB   ASP   2          HB1       ASP   2   9.957  -0.090   6.215
   16    H    GLN   3           HN       GLN   3  13.278  -0.344   5.131
   17    HA   GLN   3           HA       GLN   3  13.681   2.309   4.025
   18   1HB   GLN   3          HB2       GLN   3  15.597   0.803   4.189
   19   2HB   GLN   3          HB1       GLN   3  14.783  -0.372   3.168
   20   1HG   GLN   3          HG2       GLN   3  16.452   0.859   1.920
   21   2HG   GLN   3          HG1       GLN   3  14.835   1.194   1.304
   22   1HE2  GLN   3          HE21      GLN   3  15.506   3.128   0.373
   23   2HE2  GLN   3          HE22      GLN   3  15.843   4.534   1.317
   24    HA   PRO   4           HA       PRO   4  11.506   0.008   0.269
   25   1HB   PRO   4          HB2       PRO   4   9.805  -1.886   1.787
   26   2HB   PRO   4          HB1       PRO   4  10.672  -2.122   0.267
   27   1HG   PRO   4          HG2       PRO   4  11.535  -3.244   2.528
   28   2HG   PRO   4          HG1       PRO   4  12.671  -2.604   1.327
   29   1HD   PRO   4          HD2       PRO   4  11.784  -1.413   3.923
   30   2HD   PRO   4          HD1       PRO   4  13.396  -1.424   3.179
   31    H    CYS   5           HN       CYS   5  10.045   1.469  -0.352
   32    HA   CYS   5           HA       CYS   5   7.560   1.754   1.138
   33   1HB   CYS   5          HB2       CYS   5   9.431   4.071   0.620
   34   2HB   CYS   5          HB1       CYS   5   7.762   4.245   1.150
   35    HG   CYS   5           HG       CYS   5  10.416   3.912   2.973
   36    H    CYS   6           HN       CYS   6   6.051   3.304  -0.023
   37    HA   CYS   6           HA       CYS   6   6.522   3.572  -2.875
   38   1HB   CYS   6          HB2       CYS   6   4.638   2.315  -3.595
   39   2HB   CYS   6          HB1       CYS   6   5.546   1.275  -2.512
   40    HG   CYS   6           HG       CYS   6   3.672   2.394  -0.374
   41    H    ARG   7           HN       ARG   7   4.398   4.494  -3.898
   42    HA   ARG   7           HA       ARG   7   3.072   6.320  -2.031
   43   1HB   ARG   7          HB2       ARG   7   5.016   7.536  -2.926
   44   2HB   ARG   7          HB1       ARG   7   4.447   7.234  -4.562
   45   1HG   ARG   7          HG2       ARG   7   2.417   8.532  -4.076
   46   2HG   ARG   7          HG1       ARG   7   3.043   8.870  -2.461
   47   1HD   ARG   7          HD2       ARG   7   3.482  10.745  -3.925
   48   2HD   ARG   7          HD1       ARG   7   4.998   9.968  -3.471
   49    HE   ARG   7           HE       ARG   7   4.412   8.776  -5.812
   50   1HH1  ARG   7          HH11      ARG   7   4.523  12.122  -4.845
   51   2HH1  ARG   7          HH12      ARG   7   4.986  12.694  -6.413
   52   1HH2  ARG   7          HH21      ARG   7   5.021   9.520  -7.880
   53   2HH2  ARG   7          HH22      ARG   7   5.267  11.215  -8.138
   54    H    GLY   8           HN       GLY   8   0.955   6.231  -2.337
   55   1HA   GLY   8          HA2       GLY   8  -0.199   4.888  -4.567
   56   2HA   GLY   8          HA1       GLY   8  -1.074   5.741  -3.306
   57    H    LEU   9           HN       LEU   9  -1.075   5.620  -6.402
   58    HA   LEU   9           HA       LEU   9  -0.629   8.390  -7.107
   59   1HB   LEU   9          HB2       LEU   9  -1.587   5.979  -8.628
   60   2HB   LEU   9          HB1       LEU   9  -1.638   7.584  -9.328
   61    HG   LEU   9           HG       LEU   9   0.333   6.392 -10.091
   62   1HD1  LEU   9          HD11      LEU   9   0.498   8.808  -9.802
   63   2HD1  LEU   9          HD12      LEU   9   2.042   8.018  -9.486
   64   3HD1  LEU   9          HD13      LEU   9   1.046   8.576  -8.142
   65   1HD2  LEU   9          HD21      LEU   9   2.103   5.727  -8.543
   66   2HD2  LEU   9          HD22      LEU   9   0.601   4.866  -8.207
   67   3HD2  LEU   9          HD23      LEU   9   1.095   6.210  -7.179
   68    H    TYR  10           HN       TYR  10  -3.283   6.293  -6.322
   69    HA   TYR  10           HA       TYR  10  -5.125   8.581  -6.554
   70   1HB   TYR  10          HB2       TYR  10  -5.862   5.686  -6.995
   71   2HB   TYR  10          HB1       TYR  10  -6.896   7.094  -7.214
   72    HD1  TYR  10           HD1      TYR  10  -4.232   5.070  -8.663
   73    HD2  TYR  10           HD2      TYR  10  -6.595   8.575  -9.138
   74    HE1  TYR  10           HE1      TYR  10  -3.544   5.206 -11.020
   75    HE2  TYR  10           HE2      TYR  10  -5.916   8.722 -11.496
   76    HH   TYR  10           HH       TYR  10  -4.384   6.187 -13.129
   77    H    ASP  11           HN       ASP  11  -6.854   8.645  -5.015
   78    HA   ASP  11           HA       ASP  11  -6.098   7.540  -2.452
   79   1HB   ASP  11          HB2       ASP  11  -8.532   9.080  -2.642
   80   2HB   ASP  11          HB1       ASP  11  -7.191   9.278  -1.543
   81    H    PHE  12           HN       PHE  12  -7.446   6.234  -1.185
   82    HA   PHE  12           HA       PHE  12  -9.923   5.251  -2.340
   83   1HB   PHE  12          HB2       PHE  12  -7.447   3.753  -2.413
   84   2HB   PHE  12          HB1       PHE  12  -8.687   2.908  -1.493
   85    HD1  PHE  12           HD1      PHE  12  -7.850   4.343  -4.780
   86    HD2  PHE  12           HD2      PHE  12 -10.563   1.926  -2.562
   87    HE1  PHE  12           HE1      PHE  12  -8.876   3.573  -6.881
   88    HE2  PHE  12           HE2      PHE  12 -11.592   1.151  -4.659
   89    HZ   PHE  12           HZ       PHE  12 -10.749   1.975  -6.822
   90    H    GLU  13           HN       GLU  13 -11.406   4.802  -0.844
   91    HA   GLU  13           HA       GLU  13 -10.626   5.013   1.959
   92   1HB   GLU  13          HB2       GLU  13 -12.487   6.411   1.152
   93   2HB   GLU  13          HB1       GLU  13 -13.367   4.966   0.678
   94   1HG   GLU  13          HG2       GLU  13 -13.487   4.261   3.006
   95   2HG   GLU  13          HG1       GLU  13 -12.578   5.691   3.491
   96    HA   PRO  14           HA       PRO  14 -10.591   0.606   2.553
   97   1HB   PRO  14          HB2       PRO  14 -11.734   1.327   5.213
   98   2HB   PRO  14          HB1       PRO  14 -10.354   0.294   4.825
   99   1HG   PRO  14          HG2       PRO  14  -9.983   2.757   5.764
  100   2HG   PRO  14          HG1       PRO  14  -8.928   2.093   4.503
  101   1HD   PRO  14          HD2       PRO  14 -11.118   4.102   4.278
  102   2HD   PRO  14          HD1       PRO  14  -9.594   3.985   3.375
  103    H    GLU  15           HN       GLU  15 -12.050  -0.843   1.922
  104    HA   GLU  15           HA       GLU  15 -14.887  -0.348   2.544
  105   1HB   GLU  15          HB2       GLU  15 -14.315   0.017   0.145
  106   2HB   GLU  15          HB1       GLU  15 -13.791  -1.659   0.049
  107   1HG   GLU  15          HG2       GLU  15 -16.001  -1.455  -0.860
  108   2HG   GLU  15          HG1       GLU  15 -16.071  -2.376   0.643
  109    H    ASN  16           HN       ASN  16 -12.318  -2.702   2.148
  110    HA   ASN  16           HA       ASN  16 -14.073  -4.775   3.288
  111   1HB   ASN  16          HB2       ASN  16 -13.063  -5.228   1.030
  112   2HB   ASN  16          HB1       ASN  16 -11.478  -5.197   1.797
  113   1HD2  ASN  16          HD21      ASN  16 -10.866  -6.878   3.138
  114   2HD2  ASN  16          HD22      ASN  16 -11.724  -8.376   3.195
  115    H    GLN  17           HN       GLN  17 -13.077  -6.282   4.801
  116    HA   GLN  17           HA       GLN  17 -11.529  -4.884   6.778
  117   1HB   GLN  17          HB2       GLN  17 -13.359  -6.426   7.394
  118   2HB   GLN  17          HB1       GLN  17 -12.444  -7.765   6.714
  119   1HG   GLN  17          HG2       GLN  17 -10.691  -7.423   8.367
  120   2HG   GLN  17          HG1       GLN  17 -11.580  -6.058   9.037
  121   1HE2  GLN  17          HE21      GLN  17 -13.453  -6.436  10.226
  122   2HE2  GLN  17          HE22      GLN  17 -13.838  -7.995  10.861
  123    H    GLY  18           HN       GLY  18  -9.396  -4.860   6.961
  124   1HA   GLY  18          HA2       GLY  18  -7.305  -6.048   7.137
  125   2HA   GLY  18          HA1       GLY  18  -7.853  -7.112   5.851
  126    H    GLU  19           HN       GLU  19  -8.896  -4.586   4.462
  127    HA   GLU  19           HA       GLU  19  -6.573  -4.178   2.846
  128   1HB   GLU  19          HB2       GLU  19  -9.023  -4.131   2.092
  129   2HB   GLU  19          HB1       GLU  19  -9.079  -2.510   2.771
  130   1HG   GLU  19          HG2       GLU  19  -7.298  -1.807   1.264
  131   2HG   GLU  19          HG1       GLU  19  -7.233  -3.431   0.583
  132    H    LEU  20           HN       LEU  20  -5.808  -1.956   2.294
  133    HA   LEU  20           HA       LEU  20  -5.583  -0.338   4.748
  134   1HB   LEU  20          HB2       LEU  20  -3.490  -1.434   3.973
  135   2HB   LEU  20          HB1       LEU  20  -3.614  -0.542   2.471
  136    HG   LEU  20           HG       LEU  20  -3.434   1.579   3.765
  137   1HD1  LEU  20          HD11      LEU  20  -2.851  -0.280   6.066
  138   2HD1  LEU  20          HD12      LEU  20  -4.257   0.772   5.908
  139   3HD1  LEU  20          HD13      LEU  20  -2.648   1.472   6.079
  140   1HD2  LEU  20          HD21      LEU  20  -1.038   1.372   4.216
  141   2HD2  LEU  20          HD22      LEU  20  -1.478   0.594   2.696
  142   3HD2  LEU  20          HD23      LEU  20  -1.173  -0.384   4.133
  143    H    GLY  21           HN       GLY  21  -6.096   1.775   4.691
  144   1HA   GLY  21          HA2       GLY  21  -7.053   2.841   2.118
  145   2HA   GLY  21          HA1       GLY  21  -7.577   3.390   3.703
  146    H    PHE  22           HN       PHE  22  -6.480   4.904   1.413
  147    HA   PHE  22           HA       PHE  22  -4.770   6.629   2.879
  148   1HB   PHE  22          HB2       PHE  22  -2.749   6.376   1.439
  149   2HB   PHE  22          HB1       PHE  22  -3.071   4.970   2.448
  150    HD1  PHE  22           HD1      PHE  22  -2.916   6.262  -0.952
  151    HD2  PHE  22           HD2      PHE  22  -3.878   2.890   1.461
  152    HE1  PHE  22           HE1      PHE  22  -2.874   4.825  -2.949
  153    HE2  PHE  22           HE2      PHE  22  -3.836   1.448  -0.532
  154    HZ   PHE  22           HZ       PHE  22  -3.334   2.415  -2.739
  155    H    LYS  23           HN       LYS  23  -3.516   8.059   0.996
  156    HA   LYS  23           HA       LYS  23  -5.520   8.698  -1.050
  157   1HB   LYS  23          HB2       LYS  23  -4.826  11.144  -0.626
  158   2HB   LYS  23          HB1       LYS  23  -6.020  10.393   0.433
  159   1HG   LYS  23          HG2       LYS  23  -3.134  10.318   1.156
  160   2HG   LYS  23          HG1       LYS  23  -4.070  11.787   1.440
  161   1HD   LYS  23          HD2       LYS  23  -5.067   9.125   2.380
  162   2HD   LYS  23          HD1       LYS  23  -3.880  10.021   3.330
  163   1HE   LYS  23          HE2       LYS  23  -6.036  10.572   4.179
  164   2HE   LYS  23          HE1       LYS  23  -5.450  11.972   3.283
  165   1HZ   LYS  23          HZ1       LYS  23  -7.357   9.949   2.241
  166   2HZ   LYS  23          HZ2       LYS  23  -6.825  11.328   1.419
  167   3HZ   LYS  23          HZ3       LYS  23  -7.776  11.486   2.808
  168    H    GLU  24           HN       GLU  24  -4.523  10.564  -2.458
  169    HA   GLU  24           HA       GLU  24  -2.332   9.473  -3.851
  170   1HB   GLU  24          HB2       GLU  24  -2.399  11.602  -5.126
  171   2HB   GLU  24          HB1       GLU  24  -3.985  10.854  -4.970
  172   1HG   GLU  24          HG2       GLU  24  -4.717  12.815  -4.245
  173   2HG   GLU  24          HG1       GLU  24  -3.810  12.497  -2.763
  174    H    GLY  25           HN       GLY  25  -0.190   9.960  -3.824
  175   1HA   GLY  25          HA2       GLY  25   1.781  11.014  -3.214
  176   2HA   GLY  25          HA1       GLY  25   0.840  12.210  -2.342
  177    H    ASP  26           HN       ASP  26  -0.540   9.809  -1.010
  178    HA   ASP  26           HA       ASP  26   0.920   9.857   1.384
  179   1HB   ASP  26          HB2       ASP  26  -1.469   9.318   1.305
  180   2HB   ASP  26          HB1       ASP  26  -1.114   7.823   0.444
  181    H    ILE  27           HN       ILE  27   2.669   8.798   2.041
  182    HA   ILE  27           HA       ILE  27   3.770   6.700   0.336
  183    HB   ILE  27           HB       ILE  27   5.025   8.093   2.707
  184   1HG1  ILE  27          HG12      ILE  27   5.488   8.545  -0.250
  185   2HG1  ILE  27          HG11      ILE  27   4.519   9.594   0.780
  186   1HG2  ILE  27          HG21      ILE  27   7.128   7.159   1.844
  187   2HG2  ILE  27          HG22      ILE  27   6.223   6.295   0.601
  188   3HG2  ILE  27          HG23      ILE  27   5.984   5.898   2.302
  189   1HD1  ILE  27          HD11      ILE  27   7.461   9.044   1.093
  190   2HD1  ILE  27          HD12      ILE  27   6.490  10.096   2.122
  191   3HD1  ILE  27          HD13      ILE  27   6.738  10.507   0.426
  192    H    ILE  28           HN       ILE  28   3.690   4.611   0.847
  193    HA   ILE  28           HA       ILE  28   2.907   3.874   3.593
  194    HB   ILE  28           HB       ILE  28   2.465   2.231   1.100
  195   1HG1  ILE  28          HG12      ILE  28   0.413   3.877   2.591
  196   2HG1  ILE  28          HG11      ILE  28   1.213   4.424   1.121
  197   1HG2  ILE  28          HG21      ILE  28   0.919   0.970   2.525
  198   2HG2  ILE  28          HG22      ILE  28   1.350   1.997   3.893
  199   3HG2  ILE  28          HG23      ILE  28   2.564   0.945   3.163
  200   1HD1  ILE  28          HD11      ILE  28  -0.550   2.001   1.390
  201   2HD1  ILE  28          HD12      ILE  28   0.278   2.506  -0.083
  202   3HD1  ILE  28          HD13      ILE  28  -0.974   3.531   0.621
  203    H    THR  29           HN       THR  29   3.988   2.218   4.641
  204    HA   THR  29           HA       THR  29   6.605   1.557   3.526
  205    HB   THR  29           HB       THR  29   7.211   0.785   5.735
  206    HG1  THR  29           HG1      THR  29   5.147  -0.128   6.286
  207   1HG2  THR  29          HG21      THR  29   7.315   3.200   5.362
  208   2HG2  THR  29          HG22      THR  29   6.890   2.842   7.036
  209   3HG2  THR  29          HG23      THR  29   5.644   3.364   5.903
  210    H    LEU  30           HN       LEU  30   7.082  -0.373   2.687
  211    HA   LEU  30           HA       LEU  30   5.039  -2.465   2.785
  212   1HB   LEU  30          HB2       LEU  30   7.421  -1.985   1.017
  213   2HB   LEU  30          HB1       LEU  30   6.572  -3.518   1.029
  214    HG   LEU  30           HG       LEU  30   4.470  -2.221   0.445
  215   1HD1  LEU  30          HD11      LEU  30   6.512  -0.050   0.024
  216   2HD1  LEU  30          HD12      LEU  30   5.102  -0.013   1.084
  217   3HD1  LEU  30          HD13      LEU  30   4.890  -0.029  -0.667
  218   1HD2  LEU  30          HD21      LEU  30   6.764  -2.177  -1.513
  219   2HD2  LEU  30          HD22      LEU  30   5.052  -2.072  -1.925
  220   3HD2  LEU  30          HD23      LEU  30   5.694  -3.543  -1.196
  221    H    THR  31           HN       THR  31   5.308  -4.376   3.787
  222    HA   THR  31           HA       THR  31   7.855  -5.492   4.331
  223    HB   THR  31           HB       THR  31   7.819  -3.728   6.050
  224    HG1  THR  31           HG1      THR  31   7.768  -5.646   7.836
  225   1HG2  THR  31          HG21      THR  31   5.458  -5.257   7.153
  226   2HG2  THR  31          HG22      THR  31   5.407  -3.641   6.451
  227   3HG2  THR  31          HG23      THR  31   6.285  -3.921   7.955
  228    H    ASN  32           HN       ASN  32   4.912  -5.943   3.485
  229    HA   ASN  32           HA       ASN  32   4.739  -8.644   4.509
  230   1HB   ASN  32          HB2       ASN  32   2.606  -6.549   4.880
  231   2HB   ASN  32          HB1       ASN  32   2.289  -8.270   4.994
  232   1HD2  ASN  32          HD21      ASN  32   2.134  -6.044   6.969
  233   2HD2  ASN  32          HD22      ASN  32   3.070  -6.581   8.317
  234    H    GLN  33           HN       GLN  33   2.578  -9.596   3.363
  235    HA   GLN  33           HA       GLN  33   1.771  -8.399   0.945
  236   1HB   GLN  33          HB2       GLN  33   4.285  -9.839   0.865
  237   2HB   GLN  33          HB1       GLN  33   3.106 -10.488  -0.272
  238   1HG   GLN  33          HG2       GLN  33   2.852  -8.447  -1.354
  239   2HG   GLN  33          HG1       GLN  33   3.653  -7.555  -0.046
  240   1HE2  GLN  33          HE21      GLN  33   5.139  -6.629  -1.456
  241   2HE2  GLN  33          HE22      GLN  33   6.434  -7.527  -2.165
  242    H    ILE  34           HN       ILE  34   0.296  -9.563  -0.236
  243    HA   ILE  34           HA       ILE  34  -0.677 -11.976   1.100
  244    HB   ILE  34           HB       ILE  34  -2.201  -9.968  -0.561
  245   1HG1  ILE  34          HG12      ILE  34  -1.640  -9.143   1.672
  246   2HG1  ILE  34          HG11      ILE  34  -3.367  -9.452   1.540
  247   1HG2  ILE  34          HG21      ILE  34  -3.175 -12.470   0.817
  248   2HG2  ILE  34          HG22      ILE  34  -3.105 -12.183  -0.921
  249   3HG2  ILE  34          HG23      ILE  34  -4.211 -11.245   0.082
  250   1HD1  ILE  34          HD11      ILE  34  -2.564 -10.191   3.680
  251   2HD1  ILE  34          HD12      ILE  34  -1.331 -11.191   2.912
  252   3HD1  ILE  34          HD13      ILE  34  -3.038 -11.592   2.718
  253    H    ASP  35           HN       ASP  35   0.191 -10.570  -1.961
  254    HA   ASP  35           HA       ASP  35   0.692 -13.110  -3.134
  255   1HB   ASP  35          HB2       ASP  35  -1.782 -13.045  -3.337
  256   2HB   ASP  35          HB1       ASP  35  -1.644 -11.563  -4.275
  257    H    GLU  36           HN       GLU  36   1.341 -12.861  -5.483
  258    HA   GLU  36           HA       GLU  36   3.227 -10.800  -5.734
  259   1HB   GLU  36          HB2       GLU  36   2.045 -12.596  -7.859
  260   2HB   GLU  36          HB1       GLU  36   3.469 -11.587  -8.076
  261   1HG   GLU  36          HG2       GLU  36   3.208 -13.838  -6.096
  262   2HG   GLU  36          HG1       GLU  36   4.045 -13.920  -7.644
  263    H    ASN  37           HN       ASN  37  -0.087 -10.680  -6.087
  264    HA   ASN  37           HA       ASN  37  -0.051  -8.558  -8.097
  265   1HB   ASN  37          HB2       ASN  37  -1.757 -10.265  -8.381
  266   2HB   ASN  37          HB1       ASN  37  -2.343  -9.995  -6.743
  267   1HD2  ASN  37          HD21      ASN  37  -3.581  -8.198  -6.296
  268   2HD2  ASN  37          HD22      ASN  37  -4.279  -7.215  -7.534
  269    H    TRP  38           HN       TRP  38  -1.313  -9.103  -4.804
  270    HA   TRP  38           HA       TRP  38  -1.153  -6.199  -4.390
  271   1HB   TRP  38          HB2       TRP  38  -2.924  -6.734  -2.526
  272   2HB   TRP  38          HB1       TRP  38  -3.414  -6.606  -4.205
  273    HD1  TRP  38           HD1      TRP  38  -1.895  -9.733  -2.483
  274    HE1  TRP  38           HE1      TRP  38  -3.565 -11.668  -2.765
  275    HE3  TRP  38           HE3      TRP  38  -5.701  -7.192  -4.758
  276    HZ2  TRP  38           HZ2      TRP  38  -6.157 -12.065  -3.811
  277    HZ3  TRP  38           HZ3      TRP  38  -7.743  -8.422  -5.366
  278    HH2  TRP  38           HH2      TRP  38  -7.964 -10.809  -4.902
  279    H    TYR  39           HN       TYR  39  -0.034  -5.393  -2.717
  280    HA   TYR  39           HA       TYR  39   1.510  -7.330  -1.122
  281   1HB   TYR  39          HB2       TYR  39   3.133  -5.597  -0.795
  282   2HB   TYR  39          HB1       TYR  39   2.724  -5.614  -2.507
  283    HD1  TYR  39           HD1      TYR  39   1.550  -3.757  -3.521
  284    HD2  TYR  39           HD2      TYR  39   2.426  -3.747   0.641
  285    HE1  TYR  39           HE1      TYR  39   1.011  -1.361  -3.419
  286    HE2  TYR  39           HE2      TYR  39   1.887  -1.352   0.756
  287    HH   TYR  39           HH       TYR  39   1.720   0.570  -0.670
  288    H    GLU  40           HN       GLU  40   2.262  -6.135   1.033
  289    HA   GLU  40           HA       GLU  40  -0.027  -4.862   2.292
  290   1HB   GLU  40          HB2       GLU  40  -0.458  -7.201   2.684
  291   2HB   GLU  40          HB1       GLU  40   1.174  -7.446   3.281
  292   1HG   GLU  40          HG2       GLU  40   0.710  -6.052   5.207
  293   2HG   GLU  40          HG1       GLU  40  -0.904  -5.704   4.589
  294    H    GLY  41           HN       GLY  41   0.466  -3.438   3.844
  295   1HA   GLY  41          HA2       GLY  41   3.048  -3.465   5.161
  296   2HA   GLY  41          HA1       GLY  41   2.794  -2.126   4.048
  297    H    MET  42           HN       MET  42   3.060  -0.788   6.003
  298    HA   MET  42           HA       MET  42   0.454  -0.357   7.251
  299   1HB   MET  42          HB2       MET  42   1.327  -0.239   9.485
  300   2HB   MET  42          HB1       MET  42   1.769  -1.796   8.794
  301   1HG   MET  42          HG2       MET  42   4.015  -0.997   8.358
  302   2HG   MET  42          HG1       MET  42   3.587   0.596   8.979
  303   1HE   MET  42          HE1       MET  42   4.259  -3.170   9.853
  304   2HE   MET  42          HE2       MET  42   2.570  -2.958  10.313
  305   3HE   MET  42          HE3       MET  42   3.794  -3.228  11.554
  306    H    ILE  43           HN       ILE  43   0.192   1.699   8.206
  307    HA   ILE  43           HA       ILE  43   2.210   3.725   7.645
  308    HB   ILE  43           HB       ILE  43   0.921   3.774   5.613
  309   1HG1  ILE  43          HG12      ILE  43  -0.083   6.082   5.770
  310   2HG1  ILE  43          HG11      ILE  43   0.210   6.020   7.506
  311   1HG2  ILE  43          HG21      ILE  43  -1.074   2.632   6.427
  312   2HG2  ILE  43          HG22      ILE  43  -1.492   4.126   5.589
  313   3HG2  ILE  43          HG23      ILE  43  -1.524   4.065   7.352
  314   1HD1  ILE  43          HD11      ILE  43   2.554   6.008   7.209
  315   2HD1  ILE  43          HD12      ILE  43   1.933   7.245   6.114
  316   3HD1  ILE  43          HD13      ILE  43   2.408   5.666   5.486
  317    H    HIS  44           HN       HIS  44   2.283   5.242   9.191
  318    HA   HIS  44           HA       HIS  44   1.819   6.427  11.066
  319   1HB   HIS  44          HB2       HIS  44  -0.999   5.829  10.183
  320   2HB   HIS  44          HB1       HIS  44  -0.653   6.761  11.635
  321    HD1  HIS  44           HD1      HIS  44   1.426   8.699  10.823
  322    HD2  HIS  44           HD2      HIS  44  -1.654   7.600   8.261
  323    HE1  HIS  44           HE1      HIS  44   1.231  10.577   9.162
  324    HE2  HIS  44           HE2      HIS  44  -0.708   9.937   7.687
  325    H    GLY  45           HN       GLY  45  -0.850   4.082  11.348
  326   1HA   GLY  45          HA2       GLY  45   0.598   2.570  13.353
  327   2HA   GLY  45          HA1       GLY  45  -0.733   3.529  13.981
  328    H    GLU  46           HN       GLU  46  -0.785   1.999  10.814
  329    HA   GLU  46           HA       GLU  46  -2.337  -0.247  11.779
  330   1HB   GLU  46          HB2       GLU  46  -3.997   1.593  11.592
  331   2HB   GLU  46          HB1       GLU  46  -3.593   1.748   9.888
  332   1HG   GLU  46          HG2       GLU  46  -5.635   0.485  10.172
  333   2HG   GLU  46          HG1       GLU  46  -4.366  -0.534   9.491
  334    H    SER  47           HN       SER  47  -2.460  -1.943  10.352
  335    HA   SER  47           HA       SER  47  -0.790  -1.656   7.949
  336   1HB   SER  47          HB2       SER  47   0.098  -3.238   9.574
  337   2HB   SER  47          HB1       SER  47  -1.432  -4.113   9.595
  338    HG   SER  47           HG       SER  47   0.617  -4.499   7.990
  339    H    GLY  48           HN       GLY  48  -1.342  -3.264   6.184
  340   1HA   GLY  48          HA2       GLY  48  -3.831  -4.417   5.814
  341   2HA   GLY  48          HA1       GLY  48  -3.986  -2.749   5.277
  342    H    PHE  49           HN       PHE  49  -4.413  -4.663   3.424
  343    HA   PHE  49           HA       PHE  49  -1.900  -4.773   1.887
  344   1HB   PHE  49          HB2       PHE  49  -3.027  -6.630   0.606
  345   2HB   PHE  49          HB1       PHE  49  -2.657  -6.997   2.286
  346    HD1  PHE  49           HD1      PHE  49  -5.381  -6.035  -0.024
  347    HD2  PHE  49           HD2      PHE  49  -4.344  -7.605   3.794
  348    HE1  PHE  49           HE1      PHE  49  -7.729  -6.670   0.349
  349    HE2  PHE  49           HE2      PHE  49  -6.690  -8.242   4.173
  350    HZ   PHE  49           HZ       PHE  49  -8.386  -7.775   2.450
  351    H    PHE  50           HN       PHE  50  -2.060  -4.524  -0.453
  352    HA   PHE  50           HA       PHE  50  -4.381  -3.534  -1.709
  353   1HB   PHE  50          HB2       PHE  50  -3.363  -1.633  -0.089
  354   2HB   PHE  50          HB1       PHE  50  -2.439  -1.306  -1.551
  355    HD1  PHE  50           HD1      PHE  50  -3.516  -0.470  -3.544
  356    HD2  PHE  50           HD2      PHE  50  -5.763  -1.337  -0.036
  357    HE1  PHE  50           HE1      PHE  50  -5.429   0.776  -4.463
  358    HE2  PHE  50           HE2      PHE  50  -7.678  -0.094  -0.950
  359    HZ   PHE  50           HZ       PHE  50  -7.513   0.965  -3.167
  360    HA   PRO  51           HA       PRO  51  -1.933  -5.094  -5.157
  361   1HB   PRO  51          HB2       PRO  51  -3.813  -3.222  -6.522
  362   2HB   PRO  51          HB1       PRO  51  -3.356  -4.872  -6.958
  363   1HG   PRO  51          HG2       PRO  51  -5.687  -4.297  -5.728
  364   2HG   PRO  51          HG1       PRO  51  -4.816  -5.816  -5.466
  365   1HD   PRO  51          HD2       PRO  51  -5.211  -3.563  -3.631
  366   2HD   PRO  51          HD1       PRO  51  -4.691  -5.230  -3.282
  367    H    ILE  52           HN       ILE  52  -0.178  -4.380  -6.179
  368    HA   ILE  52           HA       ILE  52   0.928  -1.856  -5.623
  369    HB   ILE  52           HB       ILE  52   1.775  -3.657  -7.885
  370   1HG1  ILE  52          HG12      ILE  52   2.634  -3.834  -4.989
  371   2HG1  ILE  52          HG11      ILE  52   1.477  -4.924  -5.746
  372   1HG2  ILE  52          HG21      ILE  52   3.993  -2.737  -7.436
  373   2HG2  ILE  52          HG22      ILE  52   3.323  -1.744  -6.140
  374   3HG2  ILE  52          HG23      ILE  52   2.837  -1.458  -7.811
  375   1HD1  ILE  52          HD11      ILE  52   4.362  -4.580  -6.529
  376   2HD1  ILE  52          HD12      ILE  52   3.207  -5.665  -7.304
  377   3HD1  ILE  52          HD13      ILE  52   3.677  -5.930  -5.624
  378    H    ASN  53           HN       ASN  53  -1.263  -2.872  -8.034
  379    HA   ASN  53           HA       ASN  53  -0.618  -1.145 -10.150
  380   1HB   ASN  53          HB2       ASN  53  -2.114  -3.044 -10.429
  381   2HB   ASN  53          HB1       ASN  53  -3.288  -2.310  -9.341
  382   1HD2  ASN  53          HD21      ASN  53  -4.553  -0.624 -10.058
  383   2HD2  ASN  53          HD22      ASN  53  -4.677  -0.195 -11.727
  384    H    TYR  54           HN       TYR  54  -1.632  -0.296  -7.074
  385    HA   TYR  54           HA       TYR  54  -2.815   2.204  -8.095
  386   1HB   TYR  54          HB2       TYR  54  -3.342   0.848  -5.448
  387   2HB   TYR  54          HB1       TYR  54  -4.051   2.371  -5.979
  388    HD1  TYR  54           HD1      TYR  54  -5.782   2.411  -7.690
  389    HD2  TYR  54           HD2      TYR  54  -4.082  -1.267  -6.390
  390    HE1  TYR  54           HE1      TYR  54  -7.623   1.185  -8.766
  391    HE2  TYR  54           HE2      TYR  54  -5.919  -2.502  -7.463
  392    HH   TYR  54           HH       TYR  54  -8.046  -1.083  -9.669
  393    H    VAL  55           HN       VAL  55   0.048   1.255  -7.178
  394    HA   VAL  55           HA       VAL  55   0.657   3.807  -5.886
  395    HB   VAL  55           HB       VAL  55   2.090   2.821  -4.193
  396   1HG1  VAL  55          HG11      VAL  55  -0.181   3.242  -3.514
  397   2HG1  VAL  55          HG12      VAL  55   0.364   1.738  -2.773
  398   3HG1  VAL  55          HG13      VAL  55  -0.709   1.693  -4.172
  399   1HG2  VAL  55          HG21      VAL  55   2.827   0.824  -5.257
  400   2HG2  VAL  55          HG22      VAL  55   1.182   0.202  -5.359
  401   3HG2  VAL  55          HG23      VAL  55   1.970   0.348  -3.790
  402    H    GLU  56           HN       GLU  56   3.131   3.952  -5.589
  403    HA   GLU  56           HA       GLU  56   4.530   2.726  -7.861
  404   1HB   GLU  56          HB2       GLU  56   3.831   5.005  -8.502
  405   2HB   GLU  56          HB1       GLU  56   4.651   5.650  -7.087
  406   1HG   GLU  56          HG2       GLU  56   5.994   5.983  -9.063
  407   2HG   GLU  56          HG1       GLU  56   6.789   4.854  -7.968
  408    H    VAL  57           HN       VAL  57   5.741   1.365  -6.608
  409    HA   VAL  57           HA       VAL  57   6.867   1.915  -4.136
  410    HB   VAL  57           HB       VAL  57   6.755  -0.349  -4.966
  411   1HG1  VAL  57          HG11      VAL  57   8.872   0.402  -6.976
  412   2HG1  VAL  57          HG12      VAL  57   7.164   0.170  -7.348
  413   3HG1  VAL  57          HG13      VAL  57   8.130  -1.184  -6.760
  414   1HG2  VAL  57          HG21      VAL  57   9.617   0.516  -4.567
  415   2HG2  VAL  57          HG22      VAL  57   9.004  -1.129  -4.395
  416   3HG2  VAL  57          HG23      VAL  57   8.457   0.136  -3.295
  417    H    ILE  58           HN       ILE  58   8.314   3.366  -3.551
  418    HA   ILE  58           HA       ILE  58   9.904   4.799  -5.440
  419    HB   ILE  58           HB       ILE  58  10.057   4.806  -2.422
  420   1HG1  ILE  58          HG12      ILE  58   8.622   6.692  -4.306
  421   2HG1  ILE  58          HG11      ILE  58   7.839   5.450  -3.336
  422   1HG2  ILE  58          HG21      ILE  58  11.180   6.965  -2.691
  423   2HG2  ILE  58          HG22      ILE  58  11.137   6.767  -4.444
  424   3HG2  ILE  58          HG23      ILE  58  12.091   5.662  -3.455
  425   1HD1  ILE  58          HD11      ILE  58   8.612   6.581  -1.301
  426   2HD1  ILE  58          HD12      ILE  58   7.590   7.614  -2.300
  427   3HD1  ILE  58          HD13      ILE  58   9.338   7.843  -2.296
  428    H    VAL  59           HN       VAL  59  10.501   2.208  -3.137
  429    HA   VAL  59           HA       VAL  59  12.993   1.598  -4.494
  430    HB   VAL  59           HB       VAL  59  13.751   3.123  -2.756
  431   1HG1  VAL  59          HG11      VAL  59  12.459   1.228  -0.797
  432   2HG1  VAL  59          HG12      VAL  59  11.889   2.849  -1.195
  433   3HG1  VAL  59          HG13      VAL  59  13.443   2.634  -0.389
  434   1HG2  VAL  59          HG21      VAL  59  15.200   1.258  -3.338
  435   2HG2  VAL  59          HG22      VAL  59  14.417   0.250  -2.121
  436   3HG2  VAL  59          HG23      VAL  59  15.360   1.656  -1.627
  437    HA   PRO  60           HA       PRO  60  11.276  -2.441  -3.681
  438   1HB   PRO  60          HB2       PRO  60  13.354  -3.941  -4.563
  439   2HB   PRO  60          HB1       PRO  60  12.247  -3.103  -5.657
  440   1HG   PRO  60          HG2       PRO  60  14.977  -2.288  -4.734
  441   2HG   PRO  60          HG1       PRO  60  14.276  -2.208  -6.362
  442   1HD   PRO  60          HD2       PRO  60  14.436  -0.050  -4.733
  443   2HD   PRO  60          HD1       PRO  60  13.121  -0.268  -5.906
  Start of MODEL    6
    1   1H    MET   1          HT1       MET   1  15.550  -2.780   5.620
    2   2H    MET   1          HT2       MET   1  16.324  -3.988   6.515
    3   3H    MET   1          HT3       MET   1  16.217  -2.416   7.132
    4    HA   MET   1           HA       MET   1  13.932  -4.230   6.621
    5   1HB   MET   1          HB2       MET   1  15.317  -4.941   8.525
    6   2HB   MET   1          HB1       MET   1  15.184  -3.334   9.225
    7   1HG   MET   1          HG2       MET   1  12.776  -3.627   9.463
    8   2HG   MET   1          HG1       MET   1  12.897  -5.231   8.742
    9   1HE   MET   1          HE1       MET   1  15.429  -3.551  11.252
   10   2HE   MET   1          HE2       MET   1  14.776  -4.089  12.800
   11   3HE   MET   1          HE3       MET   1  13.854  -2.969  11.796
   12    H    ASP   2           HN       ASP   2  11.959  -3.332   6.714
   13    HA   ASP   2           HA       ASP   2  10.340  -1.739   6.686
   14   1HB   ASP   2          HB2       ASP   2  10.938  -1.781   9.142
   15   2HB   ASP   2          HB1       ASP   2  11.954  -0.374   8.846
   16    H    GLN   3           HN       GLN   3  12.808  -1.393   5.047
   17    HA   GLN   3           HA       GLN   3  12.983   1.512   4.826
   18   1HB   GLN   3          HB2       GLN   3  14.542  -0.663   3.421
   19   2HB   GLN   3          HB1       GLN   3  14.805   1.062   3.205
   20   1HG   GLN   3          HG2       GLN   3  15.129  -0.452   5.786
   21   2HG   GLN   3          HG1       GLN   3  16.434   0.070   4.723
   22   1HE2  GLN   3          HE21      GLN   3  15.112   2.603   4.100
   23   2HE2  GLN   3          HE22      GLN   3  15.308   3.598   5.498
   24    HA   PRO   4           HA       PRO   4  11.529   0.079   0.321
   25   1HB   PRO   4          HB2       PRO   4   9.884  -2.231   1.221
   26   2HB   PRO   4          HB1       PRO   4  10.819  -2.026  -0.264
   27   1HG   PRO   4          HG2       PRO   4  11.709  -3.598   1.687
   28   2HG   PRO   4          HG1       PRO   4  12.824  -2.569   0.768
   29   1HD   PRO   4          HD2       PRO   4  11.729  -2.194   3.523
   30   2HD   PRO   4          HD1       PRO   4  13.348  -1.832   2.892
   31    H    CYS   5           HN       CYS   5   9.889   1.349  -0.295
   32    HA   CYS   5           HA       CYS   5   7.359   1.276   1.159
   33   1HB   CYS   5          HB2       CYS   5   8.945   3.818   0.737
   34   2HB   CYS   5          HB1       CYS   5   7.303   3.736   1.366
   35    HG   CYS   5           HG       CYS   5   9.875   3.941   3.128
   36    H    CYS   6           HN       CYS   6   5.861   3.050   0.052
   37    HA   CYS   6           HA       CYS   6   6.296   3.337  -2.787
   38   1HB   CYS   6          HB2       CYS   6   4.392   2.078  -3.525
   39   2HB   CYS   6          HB1       CYS   6   5.391   1.021  -2.547
   40    HG   CYS   6           HG       CYS   6   3.687   0.542  -0.633
   41    H    ARG   7           HN       ARG   7   4.170   4.279  -3.790
   42    HA   ARG   7           HA       ARG   7   2.764   5.972  -1.865
   43   1HB   ARG   7          HB2       ARG   7   3.172   7.986  -3.307
   44   2HB   ARG   7          HB1       ARG   7   4.585   7.397  -2.445
   45   1HG   ARG   7          HG2       ARG   7   5.493   6.435  -4.417
   46   2HG   ARG   7          HG1       ARG   7   3.993   6.702  -5.309
   47   1HD   ARG   7          HD2       ARG   7   5.791   8.336  -5.843
   48   2HD   ARG   7          HD1       ARG   7   4.305   9.075  -5.249
   49    HE   ARG   7           HE       ARG   7   5.946   8.697  -3.048
   50   1HH1  ARG   7          HH11      ARG   7   6.016  10.491  -6.035
   51   2HH1  ARG   7          HH12      ARG   7   6.979  11.777  -5.389
   52   1HH2  ARG   7          HH21      ARG   7   7.213  10.389  -2.190
   53   2HH2  ARG   7          HH22      ARG   7   7.662  11.718  -3.205
   54    H    GLY   8           HN       GLY   8   0.684   6.303  -2.360
   55   1HA   GLY   8          HA2       GLY   8  -0.448   4.908  -4.586
   56   2HA   GLY   8          HA1       GLY   8  -1.321   5.896  -3.426
   57    H    LEU   9           HN       LEU   9  -1.218   5.616  -6.484
   58    HA   LEU   9           HA       LEU   9  -0.502   8.310  -7.294
   59   1HB   LEU   9          HB2       LEU   9  -1.379   5.829  -8.717
   60   2HB   LEU   9          HB1       LEU   9  -1.516   7.378  -9.528
   61    HG   LEU   9           HG       LEU   9   0.535   6.269 -10.180
   62   1HD1  LEU   9          HD11      LEU   9   2.128   8.026  -9.680
   63   2HD1  LEU   9          HD12      LEU   9   1.120   8.588  -8.345
   64   3HD1  LEU   9          HD13      LEU   9   0.537   8.717 -10.004
   65   1HD2  LEU   9          HD21      LEU   9   0.885   4.861  -8.247
   66   2HD2  LEU   9          HD22      LEU   9   1.200   6.275  -7.240
   67   3HD2  LEU   9          HD23      LEU   9   2.318   5.847  -8.535
   68    H    TYR  10           HN       TYR  10  -3.319   6.448  -6.528
   69    HA   TYR  10           HA       TYR  10  -4.966   8.853  -6.854
   70   1HB   TYR  10          HB2       TYR  10  -5.874   6.101  -7.702
   71   2HB   TYR  10          HB1       TYR  10  -6.781   7.604  -7.829
   72    HD1  TYR  10           HD1      TYR  10  -4.383   5.440  -9.406
   73    HD2  TYR  10           HD2      TYR  10  -5.963   9.390  -9.410
   74    HE1  TYR  10           HE1      TYR  10  -3.469   5.797 -11.662
   75    HE2  TYR  10           HE2      TYR  10  -5.055   9.757 -11.666
   76    HH   TYR  10           HH       TYR  10  -3.239   8.845 -13.092
   77    H    ASP  11           HN       ASP  11  -6.659   9.058  -5.393
   78    HA   ASP  11           HA       ASP  11  -6.270   7.823  -2.886
   79   1HB   ASP  11          HB2       ASP  11  -7.130   9.972  -2.783
   80   2HB   ASP  11          HB1       ASP  11  -8.349   9.670  -4.010
   81    H    PHE  12           HN       PHE  12  -7.887   6.699  -1.660
   82    HA   PHE  12           HA       PHE  12  -9.989   5.263  -2.954
   83   1HB   PHE  12          HB2       PHE  12  -7.382   4.101  -3.009
   84   2HB   PHE  12          HB1       PHE  12  -8.405   3.162  -1.928
   85    HD1  PHE  12           HD1      PHE  12  -7.725   4.079  -5.361
   86    HD2  PHE  12           HD2      PHE  12 -10.468   2.111  -2.772
   87    HE1  PHE  12           HE1      PHE  12  -8.746   2.962  -7.301
   88    HE2  PHE  12           HE2      PHE  12 -11.494   0.988  -4.706
   89    HZ   PHE  12           HZ       PHE  12 -10.634   1.413  -6.975
   90    H    GLU  13           HN       GLU  13 -11.506   5.173  -1.445
   91    HA   GLU  13           HA       GLU  13 -10.823   5.358   1.350
   92   1HB   GLU  13          HB2       GLU  13 -13.293   5.341   1.687
   93   2HB   GLU  13          HB1       GLU  13 -12.741   6.600   0.592
   94   1HG   GLU  13          HG2       GLU  13 -13.426   5.258  -1.318
   95   2HG   GLU  13          HG1       GLU  13 -13.949   3.970  -0.234
   96    HA   PRO  14           HA       PRO  14 -10.723   0.966   1.968
   97   1HB   PRO  14          HB2       PRO  14 -10.983   0.902   4.674
   98   2HB   PRO  14          HB1       PRO  14  -9.483   1.351   3.856
   99   1HG   PRO  14          HG2       PRO  14 -11.572   3.101   5.082
  100   2HG   PRO  14          HG1       PRO  14  -9.807   3.260   5.125
  101   1HD   PRO  14          HD2       PRO  14 -11.392   4.717   3.462
  102   2HD   PRO  14          HD1       PRO  14  -9.722   4.267   3.063
  103    H    GLU  15           HN       GLU  15 -12.183  -0.648   1.982
  104    HA   GLU  15           HA       GLU  15 -14.869  -0.079   3.048
  105   1HB   GLU  15          HB2       GLU  15 -14.821   0.045   0.573
  106   2HB   GLU  15          HB1       GLU  15 -14.229  -1.608   0.519
  107   1HG   GLU  15          HG2       GLU  15 -16.818  -0.933   1.861
  108   2HG   GLU  15          HG1       GLU  15 -16.722  -1.177   0.118
  109    H    ASN  16           HN       ASN  16 -12.584  -2.626   2.095
  110    HA   ASN  16           HA       ASN  16 -14.010  -4.573   3.720
  111   1HB   ASN  16          HB2       ASN  16 -13.165  -5.240   1.504
  112   2HB   ASN  16          HB1       ASN  16 -11.521  -4.892   2.031
  113   1HD2  ASN  16          HD21      ASN  16 -14.244  -7.030   2.346
  114   2HD2  ASN  16          HD22      ASN  16 -13.399  -8.319   3.124
  115    H    GLN  17           HN       GLN  17 -13.002  -5.788   5.384
  116    HA   GLN  17           HA       GLN  17 -11.338  -4.193   7.095
  117   1HB   GLN  17          HB2       GLN  17 -12.222  -7.060   7.461
  118   2HB   GLN  17          HB1       GLN  17 -11.614  -5.981   8.708
  119   1HG   GLN  17          HG2       GLN  17 -13.564  -4.598   8.547
  120   2HG   GLN  17          HG1       GLN  17 -14.147  -5.511   7.155
  121   1HE2  GLN  17          HE21      GLN  17 -15.424  -5.017   9.730
  122   2HE2  GLN  17          HE22      GLN  17 -15.756  -6.572  10.406
  123    H    GLY  18           HN       GLY  18  -9.185  -4.207   7.200
  124   1HA   GLY  18          HA2       GLY  18  -7.126  -5.447   7.445
  125   2HA   GLY  18          HA1       GLY  18  -7.753  -6.622   6.300
  126    H    GLU  19           HN       GLU  19  -8.634  -3.750   5.041
  127    HA   GLU  19           HA       GLU  19  -6.327  -3.730   3.244
  128   1HB   GLU  19          HB2       GLU  19  -8.772  -3.828   2.452
  129   2HB   GLU  19          HB1       GLU  19  -8.850  -2.130   2.900
  130   1HG   GLU  19          HG2       GLU  19  -6.993  -1.660   1.358
  131   2HG   GLU  19          HG1       GLU  19  -7.002  -3.353   0.868
  132    H    LEU  20           HN       LEU  20  -5.603  -1.565   2.435
  133    HA   LEU  20           HA       LEU  20  -5.391   0.293   4.705
  134   1HB   LEU  20          HB2       LEU  20  -3.512  -0.649   2.671
  135   2HB   LEU  20          HB1       LEU  20  -3.462   1.082   2.934
  136    HG   LEU  20           HG       LEU  20  -3.135  -0.992   5.103
  137   1HD1  LEU  20          HD11      LEU  20  -1.270  -1.049   3.533
  138   2HD1  LEU  20          HD12      LEU  20  -0.776  -0.371   5.084
  139   3HD1  LEU  20          HD13      LEU  20  -1.063   0.694   3.707
  140   1HD2  LEU  20          HD21      LEU  20  -2.733   1.996   5.125
  141   2HD2  LEU  20          HD22      LEU  20  -2.395   0.896   6.462
  142   3HD2  LEU  20          HD23      LEU  20  -4.052   1.123   5.904
  143    H    GLY  21           HN       GLY  21  -6.509   2.110   4.581
  144   1HA   GLY  21          HA2       GLY  21  -7.331   3.081   1.924
  145   2HA   GLY  21          HA1       GLY  21  -8.164   3.423   3.430
  146    H    PHE  22           HN       PHE  22  -6.764   5.037   1.179
  147    HA   PHE  22           HA       PHE  22  -6.052   7.246   2.768
  148   1HB   PHE  22          HB2       PHE  22  -3.951   5.354   2.433
  149   2HB   PHE  22          HB1       PHE  22  -3.549   6.777   1.476
  150    HD1  PHE  22           HD1      PHE  22  -3.962   9.072   2.746
  151    HD2  PHE  22           HD2      PHE  22  -3.294   5.314   4.629
  152    HE1  PHE  22           HE1      PHE  22  -3.206  10.229   4.781
  153    HE2  PHE  22           HE2      PHE  22  -2.538   6.465   6.667
  154    HZ   PHE  22           HZ       PHE  22  -2.509   8.931   6.747
  155    H    LYS  23           HN       LYS  23  -4.474   8.746   1.205
  156    HA   LYS  23           HA       LYS  23  -5.788   8.688  -1.420
  157   1HB   LYS  23          HB2       LYS  23  -5.439  11.225  -1.359
  158   2HB   LYS  23          HB1       LYS  23  -6.759  10.537  -0.417
  159   1HG   LYS  23          HG2       LYS  23  -4.111  10.936   0.868
  160   2HG   LYS  23          HG1       LYS  23  -5.174  12.325   0.629
  161   1HD   LYS  23          HD2       LYS  23  -6.164   9.794   1.896
  162   2HD   LYS  23          HD1       LYS  23  -5.333  11.026   2.851
  163   1HE   LYS  23          HE2       LYS  23  -7.826  11.438   1.200
  164   2HE   LYS  23          HE1       LYS  23  -7.762  11.298   2.956
  165   1HZ   LYS  23          HZ1       LYS  23  -6.437  13.429   1.367
  166   2HZ   LYS  23          HZ2       LYS  23  -6.455  13.309   3.053
  167   3HZ   LYS  23          HZ3       LYS  23  -7.891  13.608   2.213
  168    H    GLU  24           HN       GLU  24  -4.619  10.221  -2.988
  169    HA   GLU  24           HA       GLU  24  -2.153   9.146  -3.653
  170   1HB   GLU  24          HB2       GLU  24  -1.959  11.045  -5.220
  171   2HB   GLU  24          HB1       GLU  24  -3.554  10.302  -5.266
  172   1HG   GLU  24          HG2       GLU  24  -4.250  12.432  -5.151
  173   2HG   GLU  24          HG1       GLU  24  -3.985  12.192  -3.421
  174    H    GLY  25           HN       GLY  25  -0.045   9.938  -3.553
  175   1HA   GLY  25          HA2       GLY  25   1.712  11.260  -2.787
  176   2HA   GLY  25          HA1       GLY  25   0.552  12.272  -1.942
  177    H    ASP  26           HN       ASP  26  -0.458   9.440  -0.960
  178    HA   ASP  26           HA       ASP  26   0.929   9.604   1.550
  179   1HB   ASP  26          HB2       ASP  26  -1.450   9.041   1.488
  180   2HB   ASP  26          HB1       ASP  26  -1.099   7.593   0.551
  181    H    ILE  27           HN       ILE  27   2.694   8.538   2.150
  182    HA   ILE  27           HA       ILE  27   3.736   6.460   0.368
  183    HB   ILE  27           HB       ILE  27   5.194   7.885   2.590
  184   1HG1  ILE  27          HG12      ILE  27   5.253   8.468  -0.380
  185   2HG1  ILE  27          HG11      ILE  27   4.398   9.439   0.813
  186   1HG2  ILE  27          HG21      ILE  27   6.185   6.228   0.272
  187   2HG2  ILE  27          HG22      ILE  27   6.166   5.743   1.967
  188   3HG2  ILE  27          HG23      ILE  27   7.203   7.069   1.441
  189   1HD1  ILE  27          HD11      ILE  27   7.369   9.007   0.647
  190   2HD1  ILE  27          HD12      ILE  27   6.548   9.904   1.924
  191   3HD1  ILE  27          HD13      ILE  27   6.487  10.485   0.260
  192    H    ILE  28           HN       ILE  28   3.118   4.475   0.943
  193    HA   ILE  28           HA       ILE  28   2.852   3.788   3.774
  194    HB   ILE  28           HB       ILE  28   2.109   2.191   1.318
  195   1HG1  ILE  28          HG12      ILE  28   0.308   3.632   3.274
  196   2HG1  ILE  28          HG11      ILE  28   0.778   4.283   1.708
  197   1HG2  ILE  28          HG21      ILE  28   0.898   0.739   2.874
  198   2HG2  ILE  28          HG22      ILE  28   1.518   1.680   4.230
  199   3HG2  ILE  28          HG23      ILE  28   2.628   0.759   3.216
  200   1HD1  ILE  28          HD11      ILE  28  -0.776   1.747   2.169
  201   2HD1  ILE  28          HD12      ILE  28  -0.311   2.405   0.600
  202   3HD1  ILE  28          HD13      ILE  28  -1.436   3.290   1.631
  203    H    THR  29           HN       THR  29   4.103   2.276   4.796
  204    HA   THR  29           HA       THR  29   6.566   1.506   3.437
  205    HB   THR  29           HB       THR  29   7.408   0.867   5.610
  206    HG1  THR  29           HG1      THR  29   6.118   0.660   7.363
  207   1HG2  THR  29          HG21      THR  29   7.450   3.260   5.085
  208   2HG2  THR  29          HG22      THR  29   7.234   2.994   6.813
  209   3HG2  THR  29          HG23      THR  29   5.856   3.451   5.813
  210    H    LEU  30           HN       LEU  30   6.745  -0.421   2.473
  211    HA   LEU  30           HA       LEU  30   4.819  -2.502   3.118
  212   1HB   LEU  30          HB2       LEU  30   5.517  -3.553   1.100
  213   2HB   LEU  30          HB1       LEU  30   5.176  -1.857   0.790
  214    HG   LEU  30           HG       LEU  30   7.866  -1.800   1.256
  215   1HD1  LEU  30          HD11      LEU  30   8.853  -3.622  -0.043
  216   2HD1  LEU  30          HD12      LEU  30   7.263  -4.365  -0.208
  217   3HD1  LEU  30          HD13      LEU  30   8.011  -4.226   1.383
  218   1HD2  LEU  30          HD21      LEU  30   8.087  -1.562  -1.167
  219   2HD2  LEU  30          HD22      LEU  30   6.681  -0.685  -0.560
  220   3HD2  LEU  30          HD23      LEU  30   6.469  -2.230  -1.382
  221    H    THR  31           HN       THR  31   5.302  -4.504   3.800
  222    HA   THR  31           HA       THR  31   7.919  -5.548   3.959
  223    HB   THR  31           HB       THR  31   7.951  -3.860   5.785
  224    HG1  THR  31           HG1      THR  31   8.572  -6.531   5.956
  225   1HG2  THR  31          HG21      THR  31   5.602  -4.147   6.507
  226   2HG2  THR  31          HG22      THR  31   6.746  -4.287   7.841
  227   3HG2  THR  31          HG23      THR  31   6.019  -5.736   7.149
  228    H    ASN  32           HN       ASN  32   4.984  -6.040   3.334
  229    HA   ASN  32           HA       ASN  32   4.911  -8.798   4.216
  230   1HB   ASN  32          HB2       ASN  32   2.728  -6.783   4.741
  231   2HB   ASN  32          HB1       ASN  32   2.489  -8.519   4.826
  232   1HD2  ASN  32          HD21      ASN  32   3.770  -5.738   6.379
  233   2HD2  ASN  32          HD22      ASN  32   4.224  -6.502   7.861
  234    H    GLN  33           HN       GLN  33   2.803  -9.787   3.073
  235    HA   GLN  33           HA       GLN  33   1.822  -8.492   0.762
  236   1HB   GLN  33          HB2       GLN  33   4.417  -9.767   0.510
  237   2HB   GLN  33          HB1       GLN  33   3.236 -10.418  -0.626
  238   1HG   GLN  33          HG2       GLN  33   2.818  -8.332  -1.564
  239   2HG   GLN  33          HG1       GLN  33   3.629  -7.475  -0.239
  240   1HE2  GLN  33          HE21      GLN  33   5.887  -7.435  -0.191
  241   2HE2  GLN  33          HE22      GLN  33   6.849  -7.816  -1.574
  242    H    ILE  34           HN       ILE  34   0.357  -9.693  -0.416
  243    HA   ILE  34           HA       ILE  34  -0.354 -12.264   0.789
  244    HB   ILE  34           HB       ILE  34  -2.099 -10.251  -0.633
  245   1HG1  ILE  34          HG12      ILE  34  -3.335 -10.454   1.635
  246   2HG1  ILE  34          HG11      ILE  34  -1.837 -11.169   2.221
  247   1HG2  ILE  34          HG21      ILE  34  -2.822 -12.990   0.403
  248   2HG2  ILE  34          HG22      ILE  34  -2.810 -12.468  -1.283
  249   3HG2  ILE  34          HG23      ILE  34  -3.976 -11.778  -0.154
  250   1HD1  ILE  34          HD11      ILE  34  -2.003  -8.774   2.708
  251   2HD1  ILE  34          HD12      ILE  34  -2.079  -8.442   0.978
  252   3HD1  ILE  34          HD13      ILE  34  -0.626  -9.155   1.677
  253    H    ASP  35           HN       ASP  35   0.399 -10.610  -2.145
  254    HA   ASP  35           HA       ASP  35   0.897 -13.060  -3.526
  255   1HB   ASP  35          HB2       ASP  35  -1.552 -12.905  -3.805
  256   2HB   ASP  35          HB1       ASP  35  -1.361 -11.314  -4.536
  257    H    GLU  36           HN       GLU  36   1.646 -12.614  -5.807
  258    HA   GLU  36           HA       GLU  36   3.638 -10.660  -5.799
  259   1HB   GLU  36          HB2       GLU  36   3.900 -11.181  -8.200
  260   2HB   GLU  36          HB1       GLU  36   3.791 -12.628  -7.207
  261   1HG   GLU  36          HG2       GLU  36   1.437 -12.872  -7.836
  262   2HG   GLU  36          HG1       GLU  36   1.570 -11.436  -8.851
  263    H    ASN  37           HN       ASN  37   0.324 -10.305  -6.274
  264    HA   ASN  37           HA       ASN  37   0.653  -7.834  -7.825
  265   1HB   ASN  37          HB2       ASN  37  -0.961  -9.421  -8.744
  266   2HB   ASN  37          HB1       ASN  37  -1.835  -9.445  -7.216
  267   1HD2  ASN  37          HD21      ASN  37  -3.737  -8.735  -8.134
  268   2HD2  ASN  37          HD22      ASN  37  -3.955  -7.113  -8.689
  269    H    TRP  38           HN       TRP  38  -1.275  -9.032  -5.062
  270    HA   TRP  38           HA       TRP  38  -1.593  -6.316  -4.090
  271   1HB   TRP  38          HB2       TRP  38  -2.554  -8.807  -2.693
  272   2HB   TRP  38          HB1       TRP  38  -3.157  -7.159  -2.525
  273    HD1  TRP  38           HD1      TRP  38  -2.816  -9.483  -5.644
  274    HE1  TRP  38           HE1      TRP  38  -5.076  -9.462  -6.874
  275    HE3  TRP  38           HE3      TRP  38  -5.430  -6.420  -2.492
  276    HZ2  TRP  38           HZ2      TRP  38  -7.630  -8.307  -6.548
  277    HZ3  TRP  38           HZ3      TRP  38  -7.777  -5.911  -3.022
  278    HH2  TRP  38           HH2      TRP  38  -8.854  -6.834  -5.009
  279    H    TYR  39           HN       TYR  39  -0.321  -5.379  -2.609
  280    HA   TYR  39           HA       TYR  39   1.610  -7.093  -1.180
  281   1HB   TYR  39          HB2       TYR  39   1.626  -4.186  -1.968
  282   2HB   TYR  39          HB1       TYR  39   2.710  -4.798  -0.727
  283    HD1  TYR  39           HD1      TYR  39   1.632  -6.320  -3.955
  284    HD2  TYR  39           HD2      TYR  39   4.852  -4.758  -1.653
  285    HE1  TYR  39           HE1      TYR  39   3.215  -7.017  -5.703
  286    HE2  TYR  39           HE2      TYR  39   6.442  -5.450  -3.396
  287    HH   TYR  39           HH       TYR  39   5.459  -6.435  -6.496
  288    H    GLU  40           HN       GLU  40   2.314  -5.930   0.975
  289    HA   GLU  40           HA       GLU  40   0.047  -4.816   2.377
  290   1HB   GLU  40          HB2       GLU  40  -0.441  -7.141   2.637
  291   2HB   GLU  40          HB1       GLU  40   1.211  -7.494   3.119
  292   1HG   GLU  40          HG2       GLU  40   0.908  -6.278   5.182
  293   2HG   GLU  40          HG1       GLU  40  -0.707  -5.778   4.682
  294    H    GLY  41           HN       GLY  41   0.559  -3.591   4.101
  295   1HA   GLY  41          HA2       GLY  41   3.077  -3.746   5.455
  296   2HA   GLY  41          HA1       GLY  41   3.006  -2.388   4.338
  297    H    MET  42           HN       MET  42   3.232  -1.019   6.240
  298    HA   MET  42           HA       MET  42   0.611  -0.477   7.428
  299   1HB   MET  42          HB2       MET  42   3.059  -0.356   9.163
  300   2HB   MET  42          HB1       MET  42   1.367  -0.393   9.644
  301   1HG   MET  42          HG2       MET  42   2.154  -2.500  10.200
  302   2HG   MET  42          HG1       MET  42   1.329  -2.750   8.663
  303   1HE   MET  42          HE1       MET  42   4.784  -2.395  10.473
  304   2HE   MET  42          HE2       MET  42   4.871  -1.108   9.271
  305   3HE   MET  42          HE3       MET  42   5.917  -2.520   9.128
  306    H    ILE  43           HN       ILE  43   0.372   1.623   8.293
  307    HA   ILE  43           HA       ILE  43   2.407   3.603   7.637
  308    HB   ILE  43           HB       ILE  43   1.094   3.587   5.616
  309   1HG1  ILE  43          HG12      ILE  43   0.114   5.915   5.700
  310   2HG1  ILE  43          HG11      ILE  43   0.451   5.919   7.428
  311   1HG2  ILE  43          HG21      ILE  43  -0.909   2.510   6.453
  312   2HG2  ILE  43          HG22      ILE  43  -1.324   4.014   5.628
  313   3HG2  ILE  43          HG23      ILE  43  -1.316   3.946   7.391
  314   1HD1  ILE  43          HD11      ILE  43   2.158   7.073   5.994
  315   2HD1  ILE  43          HD12      ILE  43   2.573   5.489   5.337
  316   3HD1  ILE  43          HD13      ILE  43   2.798   5.818   7.054
  317    H    HIS  44           HN       HIS  44   2.562   5.082   9.197
  318    HA   HIS  44           HA       HIS  44   2.132   6.331  11.042
  319   1HB   HIS  44          HB2       HIS  44   0.132   7.084   9.778
  320   2HB   HIS  44          HB1       HIS  44  -0.786   5.756  10.481
  321    HD1  HIS  44           HD1      HIS  44  -1.996   6.292  12.578
  322    HD2  HIS  44           HD2      HIS  44   1.144   8.921  11.879
  323    HE1  HIS  44           HE1      HIS  44  -2.151   8.023  14.396
  324    HE2  HIS  44           HE2      HIS  44  -0.302   9.659  13.891
  325    H    GLY  45           HN       GLY  45  -0.599   4.058  11.332
  326   1HA   GLY  45          HA2       GLY  45   0.796   2.494  13.326
  327   2HA   GLY  45          HA1       GLY  45  -0.486   3.507  13.973
  328    H    GLU  46           HN       GLU  46  -0.676   2.049  10.790
  329    HA   GLU  46           HA       GLU  46  -2.410  -0.077  11.781
  330   1HB   GLU  46          HB2       GLU  46  -3.297   2.073   9.860
  331   2HB   GLU  46          HB1       GLU  46  -4.136   0.539  10.036
  332   1HG   GLU  46          HG2       GLU  46  -3.685   2.496  12.276
  333   2HG   GLU  46          HG1       GLU  46  -5.155   2.402  11.306
  334    H    SER  47           HN       SER  47  -2.663  -1.816  10.400
  335    HA   SER  47           HA       SER  47  -0.787  -1.857   8.133
  336   1HB   SER  47          HB2       SER  47  -0.713  -4.308   8.460
  337   2HB   SER  47          HB1       SER  47  -0.212  -3.436   9.909
  338    HG   SER  47           HG       SER  47  -2.463  -3.711  10.607
  339    H    GLY  48           HN       GLY  48  -1.384  -3.311   6.322
  340   1HA   GLY  48          HA2       GLY  48  -3.915  -4.332   5.839
  341   2HA   GLY  48          HA1       GLY  48  -3.964  -2.650   5.329
  342    H    PHE  49           HN       PHE  49  -4.454  -4.417   3.404
  343    HA   PHE  49           HA       PHE  49  -1.909  -4.806   1.985
  344   1HB   PHE  49          HB2       PHE  49  -3.143  -6.367   0.528
  345   2HB   PHE  49          HB1       PHE  49  -3.215  -6.844   2.219
  346    HD1  PHE  49           HD1      PHE  49  -5.114  -5.580  -0.637
  347    HD2  PHE  49           HD2      PHE  49  -5.291  -6.768   3.446
  348    HE1  PHE  49           HE1      PHE  49  -7.568  -5.689  -0.779
  349    HE2  PHE  49           HE2      PHE  49  -7.745  -6.876   3.312
  350    HZ   PHE  49           HZ       PHE  49  -8.887  -6.337   1.197
  351    H    PHE  50           HN       PHE  50  -1.941  -4.454  -0.377
  352    HA   PHE  50           HA       PHE  50  -3.849  -2.911  -1.704
  353   1HB   PHE  50          HB2       PHE  50  -2.521  -1.372   0.164
  354   2HB   PHE  50          HB1       PHE  50  -1.622  -1.050  -1.315
  355    HD1  PHE  50           HD1      PHE  50  -2.271   0.857  -2.394
  356    HD2  PHE  50           HD2      PHE  50  -5.222  -1.464  -0.391
  357    HE1  PHE  50           HE1      PHE  50  -4.002   2.459  -3.094
  358    HE2  PHE  50           HE2      PHE  50  -6.958   0.131  -1.089
  359    HZ   PHE  50           HZ       PHE  50  -6.350   2.097  -2.441
  360    HA   PRO  51           HA       PRO  51  -0.920  -4.824  -4.629
  361   1HB   PRO  51          HB2       PRO  51  -2.553  -4.274  -6.803
  362   2HB   PRO  51          HB1       PRO  51  -2.617  -5.744  -5.826
  363   1HG   PRO  51          HG2       PRO  51  -4.306  -3.282  -5.660
  364   2HG   PRO  51          HG1       PRO  51  -4.784  -4.984  -5.507
  365   1HD   PRO  51          HD2       PRO  51  -4.520  -3.438  -3.349
  366   2HD   PRO  51          HD1       PRO  51  -3.992  -5.139  -3.321
  367    H    ILE  52           HN       ILE  52   0.290  -4.087  -6.428
  368    HA   ILE  52           HA       ILE  52   1.153  -1.415  -6.253
  369    HB   ILE  52           HB       ILE  52   1.621  -3.315  -8.552
  370   1HG1  ILE  52          HG12      ILE  52   3.273  -2.931  -6.046
  371   2HG1  ILE  52          HG11      ILE  52   2.213  -4.304  -6.345
  372   1HG2  ILE  52          HG21      ILE  52   3.164  -0.914  -7.577
  373   2HG2  ILE  52          HG22      ILE  52   2.243  -1.037  -9.075
  374   3HG2  ILE  52          HG23      ILE  52   3.695  -2.013  -8.852
  375   1HD1  ILE  52          HD11      ILE  52   4.608  -3.562  -8.009
  376   2HD1  ILE  52          HD12      ILE  52   3.572  -4.970  -8.235
  377   3HD1  ILE  52          HD13      ILE  52   4.560  -4.826  -6.783
  378    H    ASN  53           HN       ASN  53  -1.435  -2.845  -7.951
  379    HA   ASN  53           HA       ASN  53  -1.616  -1.167 -10.195
  380   1HB   ASN  53          HB2       ASN  53  -2.866  -3.314  -9.841
  381   2HB   ASN  53          HB1       ASN  53  -3.921  -2.453  -8.725
  382   1HD2  ASN  53          HD21      ASN  53  -2.571  -1.056 -11.633
  383   2HD2  ASN  53          HD22      ASN  53  -4.065  -0.917 -12.491
  384    H    TYR  54           HN       TYR  54  -1.757  -0.243  -7.021
  385    HA   TYR  54           HA       TYR  54  -3.346   2.128  -7.733
  386   1HB   TYR  54          HB2       TYR  54  -3.456   0.657  -5.096
  387   2HB   TYR  54          HB1       TYR  54  -4.273   2.177  -5.448
  388    HD1  TYR  54           HD1      TYR  54  -5.719   2.015  -7.750
  389    HD2  TYR  54           HD2      TYR  54  -4.781  -1.222  -5.152
  390    HE1  TYR  54           HE1      TYR  54  -7.669   0.779  -8.596
  391    HE2  TYR  54           HE2      TYR  54  -6.728  -2.467  -5.991
  392    HH   TYR  54           HH       TYR  54  -8.427  -1.572  -8.773
  393    H    VAL  55           HN       VAL  55  -0.400   0.979  -6.750
  394    HA   VAL  55           HA       VAL  55   0.376   3.634  -5.784
  395    HB   VAL  55           HB       VAL  55   1.829   2.676  -4.043
  396   1HG1  VAL  55          HG11      VAL  55  -1.113   2.052  -3.863
  397   2HG1  VAL  55          HG12      VAL  55  -0.261   3.475  -3.267
  398   3HG1  VAL  55          HG13      VAL  55  -0.014   1.914  -2.490
  399   1HG2  VAL  55          HG21      VAL  55   2.112   0.451  -5.059
  400   2HG2  VAL  55          HG22      VAL  55   0.443   0.065  -4.638
  401   3HG2  VAL  55          HG23      VAL  55   1.626   0.361  -3.366
  402    H    GLU  56           HN       GLU  56   2.863   3.693  -5.566
  403    HA   GLU  56           HA       GLU  56   4.141   2.135  -7.698
  404   1HB   GLU  56          HB2       GLU  56   3.504   4.359  -8.600
  405   2HB   GLU  56          HB1       GLU  56   4.448   5.123  -7.329
  406   1HG   GLU  56          HG2       GLU  56   5.688   5.104  -9.395
  407   2HG   GLU  56          HG1       GLU  56   6.473   4.064  -8.207
  408    H    VAL  57           HN       VAL  57   5.535   0.950  -6.550
  409    HA   VAL  57           HA       VAL  57   6.641   1.586  -4.086
  410    HB   VAL  57           HB       VAL  57   7.896  -0.183  -6.193
  411   1HG1  VAL  57          HG11      VAL  57   8.200  -0.153  -3.193
  412   2HG1  VAL  57          HG12      VAL  57   9.413   0.361  -4.366
  413   3HG1  VAL  57          HG13      VAL  57   8.921  -1.330  -4.289
  414   1HG2  VAL  57          HG21      VAL  57   5.638  -0.907  -5.841
  415   2HG2  VAL  57          HG22      VAL  57   5.821  -0.790  -4.091
  416   3HG2  VAL  57          HG23      VAL  57   6.710  -2.018  -4.991
  417    H    ILE  58           HN       ILE  58   8.097   3.040  -3.490
  418    HA   ILE  58           HA       ILE  58   9.640   4.473  -5.479
  419    HB   ILE  58           HB       ILE  58   9.619   4.835  -2.480
  420   1HG1  ILE  58          HG12      ILE  58   8.077   6.351  -4.599
  421   2HG1  ILE  58          HG11      ILE  58   7.380   5.136  -3.532
  422   1HG2  ILE  58          HG21      ILE  58  11.590   5.772  -3.561
  423   2HG2  ILE  58          HG22      ILE  58  10.527   7.054  -2.979
  424   3HG2  ILE  58          HG23      ILE  58  10.564   6.651  -4.696
  425   1HD1  ILE  58          HD11      ILE  58   8.577   7.770  -2.713
  426   2HD1  ILE  58          HD12      ILE  58   7.980   6.540  -1.600
  427   3HD1  ILE  58          HD13      ILE  58   6.868   7.336  -2.715
  428    H    VAL  59           HN       VAL  59  10.224   2.251  -2.800
  429    HA   VAL  59           HA       VAL  59  13.080   2.206  -3.507
  430    HB   VAL  59           HB       VAL  59  11.803   1.232  -0.951
  431   1HG1  VAL  59          HG11      VAL  59  13.888   0.101  -1.472
  432   2HG1  VAL  59          HG12      VAL  59  14.110   1.198  -0.109
  433   3HG1  VAL  59          HG13      VAL  59  14.690   1.652  -1.710
  434   1HG2  VAL  59          HG21      VAL  59  11.556   3.639  -1.136
  435   2HG2  VAL  59          HG22      VAL  59  13.271   3.806  -1.511
  436   3HG2  VAL  59          HG23      VAL  59  12.767   3.242   0.082
  437    HA   PRO  60           HA       PRO  60  12.084  -1.777  -5.382
  438   1HB   PRO  60          HB2       PRO  60  15.047  -1.989  -5.400
  439   2HB   PRO  60          HB1       PRO  60  13.896  -2.189  -6.725
  440   1HG   PRO  60          HG2       PRO  60  15.407  -0.003  -6.553
  441   2HG   PRO  60          HG1       PRO  60  13.721   0.093  -7.095
  442   1HD   PRO  60          HD2       PRO  60  14.904   0.794  -4.440
  443   2HD   PRO  60          HD1       PRO  60  13.623   1.615  -5.356
  Start of MODEL    7
    1   1H    MET   1          HT1       MET   1  13.111   5.709   8.729
    2   2H    MET   1          HT2       MET   1  12.788   4.059   8.912
    3   3H    MET   1          HT3       MET   1  12.624   4.789   7.395
    4    HA   MET   1           HA       MET   1  14.996   5.257   7.347
    5   1HB   MET   1          HB2       MET   1  14.963   3.674   9.923
    6   2HB   MET   1          HB1       MET   1  16.421   4.057   9.020
    7   1HG   MET   1          HG2       MET   1  16.313   5.640  10.737
    8   2HG   MET   1          HG1       MET   1  15.786   6.490   9.286
    9   1HE   MET   1          HE1       MET   1  14.732   4.930  12.713
   10   2HE   MET   1          HE2       MET   1  13.835   3.930  11.570
   11   3HE   MET   1          HE3       MET   1  12.973   5.034  12.642
   12    H    ASP   2           HN       ASP   2  15.686   4.060   5.718
   13    HA   ASP   2           HA       ASP   2  15.992   2.320   4.287
   14   1HB   ASP   2          HB2       ASP   2  15.983   0.706   6.846
   15   2HB   ASP   2          HB1       ASP   2  16.575   0.144   5.286
   16    H    GLN   3           HN       GLN   3  15.109  -0.352   4.411
   17    HA   GLN   3           HA       GLN   3  13.338  -1.688   3.943
   18   1HB   GLN   3          HB2       GLN   3  11.709   0.347   5.477
   19   2HB   GLN   3          HB1       GLN   3  11.190  -1.275   5.039
   20   1HG   GLN   3          HG2       GLN   3  13.438  -0.563   6.909
   21   2HG   GLN   3          HG1       GLN   3  11.855  -1.195   7.359
   22   1HE2  GLN   3          HE21      GLN   3  14.946  -1.927   5.957
   23   2HE2  GLN   3          HE22      GLN   3  14.793  -3.648   6.009
   24    HA   PRO   4           HA       PRO   4  11.790   0.020   0.172
   25   1HB   PRO   4          HB2       PRO   4   9.852  -1.805  -0.410
   26   2HB   PRO   4          HB1       PRO   4  11.577  -2.121  -0.619
   27   1HG   PRO   4          HG2       PRO   4   9.765  -2.919   1.625
   28   2HG   PRO   4          HG1       PRO   4  11.016  -3.870   0.803
   29   1HD   PRO   4          HD2       PRO   4  11.434  -2.712   3.205
   30   2HD   PRO   4          HD1       PRO   4  12.727  -2.887   2.000
   31    H    CYS   5           HN       CYS   5  10.406   1.622  -0.259
   32    HA   CYS   5           HA       CYS   5   7.875   1.720   1.251
   33   1HB   CYS   5          HB2       CYS   5   8.052   4.180   1.200
   34   2HB   CYS   5          HB1       CYS   5   9.402   3.441   2.055
   35    HG   CYS   5           HG       CYS   5   9.942   5.767   0.274
   36    H    CYS   6           HN       CYS   6   6.415   3.518   0.097
   37    HA   CYS   6           HA       CYS   6   6.574   3.566  -2.758
   38   1HB   CYS   6          HB2       CYS   6   4.721   2.203  -3.323
   39   2HB   CYS   6          HB1       CYS   6   5.722   1.240  -2.252
   40    HG   CYS   6           HG       CYS   6   3.762   0.585  -0.744
   41    H    ARG   7           HN       ARG   7   4.368   4.382  -3.658
   42    HA   ARG   7           HA       ARG   7   3.048   6.172  -1.754
   43   1HB   ARG   7          HB2       ARG   7   3.311   8.102  -3.282
   44   2HB   ARG   7          HB1       ARG   7   4.843   7.534  -2.628
   45   1HG   ARG   7          HG2       ARG   7   5.293   6.346  -4.721
   46   2HG   ARG   7          HG1       ARG   7   3.768   6.944  -5.377
   47   1HD   ARG   7          HD2       ARG   7   6.054   8.671  -4.440
   48   2HD   ARG   7          HD1       ARG   7   5.714   8.265  -6.121
   49    HE   ARG   7           HE       ARG   7   3.404   9.385  -5.051
   50   1HH1  ARG   7          HH11      ARG   7   6.684  10.337  -5.740
   51   2HH1  ARG   7          HH12      ARG   7   6.279  11.996  -6.029
   52   1HH2  ARG   7          HH21      ARG   7   2.861  11.569  -5.430
   53   2HH2  ARG   7          HH22      ARG   7   4.106  12.697  -5.851
   54    H    GLY   8           HN       GLY   8   0.920   6.433  -2.140
   55   1HA   GLY   8          HA2       GLY   8  -0.298   4.854  -4.204
   56   2HA   GLY   8          HA1       GLY   8  -1.135   5.846  -3.021
   57    H    LEU   9           HN       LEU   9  -1.280   5.467  -6.055
   58    HA   LEU   9           HA       LEU   9  -0.823   8.222  -6.925
   59   1HB   LEU   9          HB2       LEU   9  -1.401   5.666  -8.397
   60   2HB   LEU   9          HB1       LEU   9  -1.532   7.225  -9.186
   61    HG   LEU   9           HG       LEU   9   0.605   6.179  -9.688
   62   1HD1  LEU   9          HD11      LEU   9   0.526   8.605  -9.572
   63   2HD1  LEU   9          HD12      LEU   9   2.091   8.001  -9.030
   64   3HD1  LEU   9          HD13      LEU   9   0.902   8.549  -7.850
   65   1HD2  LEU   9          HD21      LEU   9   2.280   5.841  -7.917
   66   2HD2  LEU   9          HD22      LEU   9   0.875   4.795  -7.723
   67   3HD2  LEU   9          HD23      LEU   9   1.057   6.225  -6.707
   68    H    TYR  10           HN       TYR  10  -3.360   5.921  -6.310
   69    HA   TYR  10           HA       TYR  10  -5.351   8.022  -6.871
   70   1HB   TYR  10          HB2       TYR  10  -5.820   5.050  -7.120
   71   2HB   TYR  10          HB1       TYR  10  -6.928   6.347  -7.556
   72    HD1  TYR  10           HD1      TYR  10  -3.907   4.515  -8.542
   73    HD2  TYR  10           HD2      TYR  10  -6.639   7.598  -9.607
   74    HE1  TYR  10           HE1      TYR  10  -3.005   4.515 -10.829
   75    HE2  TYR  10           HE2      TYR  10  -5.747   7.604 -11.898
   76    HH   TYR  10           HH       TYR  10  -3.653   6.969 -13.059
   77    H    ASP  11           HN       ASP  11  -7.059   8.246  -5.430
   78    HA   ASP  11           HA       ASP  11  -6.479   7.455  -2.745
   79   1HB   ASP  11          HB2       ASP  11  -8.654   8.656  -2.257
   80   2HB   ASP  11          HB1       ASP  11  -7.385   9.609  -3.004
   81    H    PHE  12           HN       PHE  12  -8.225   6.637  -1.332
   82    HA   PHE  12           HA       PHE  12 -10.236   4.923  -2.403
   83   1HB   PHE  12          HB2       PHE  12  -7.673   3.793  -2.262
   84   2HB   PHE  12          HB1       PHE  12  -8.564   3.156  -0.883
   85    HD1  PHE  12           HD1      PHE  12  -8.203   3.130  -4.483
   86    HD2  PHE  12           HD2      PHE  12 -10.643   1.885  -1.226
   87    HE1  PHE  12           HE1      PHE  12  -9.339   1.518  -5.955
   88    HE2  PHE  12           HE2      PHE  12 -11.783   0.271  -2.690
   89    HZ   PHE  12           HZ       PHE  12 -11.132   0.085  -5.059
   90    H    GLU  13           HN       GLU  13 -11.825   5.092  -0.982
   91    HA   GLU  13           HA       GLU  13 -11.295   5.866   1.745
   92   1HB   GLU  13          HB2       GLU  13 -13.876   5.281   0.285
   93   2HB   GLU  13          HB1       GLU  13 -13.787   5.850   1.947
   94   1HG   GLU  13          HG2       GLU  13 -12.774   7.327  -0.472
   95   2HG   GLU  13          HG1       GLU  13 -14.277   7.658   0.387
   96    HA   PRO  14           HA       PRO  14 -11.009   1.690   3.270
   97   1HB   PRO  14          HB2       PRO  14 -11.856   2.887   5.844
   98   2HB   PRO  14          HB1       PRO  14 -10.412   1.945   5.462
   99   1HG   PRO  14          HG2       PRO  14 -10.276   4.582   5.873
  100   2HG   PRO  14          HG1       PRO  14  -9.262   3.781   4.660
  101   1HD   PRO  14          HD2       PRO  14 -11.735   5.418   4.286
  102   2HD   PRO  14          HD1       PRO  14 -10.262   5.356   3.296
  103    H    GLU  15           HN       GLU  15 -12.475   0.118   3.185
  104    HA   GLU  15           HA       GLU  15 -15.063   0.418   4.456
  105   1HB   GLU  15          HB2       GLU  15 -16.307  -0.237   2.418
  106   2HB   GLU  15          HB1       GLU  15 -15.538   1.338   2.269
  107   1HG   GLU  15          HG2       GLU  15 -13.704   0.293   1.001
  108   2HG   GLU  15          HG1       GLU  15 -14.548  -1.252   1.100
  109    H    ASN  16           HN       ASN  16 -12.773  -1.544   2.652
  110    HA   ASN  16           HA       ASN  16 -14.053  -4.012   3.484
  111   1HB   ASN  16          HB2       ASN  16 -11.739  -3.329   1.688
  112   2HB   ASN  16          HB1       ASN  16 -12.034  -4.979   2.208
  113   1HD2  ASN  16          HD21      ASN  16 -13.152  -2.342   0.270
  114   2HD2  ASN  16          HD22      ASN  16 -14.343  -3.225  -0.616
  115    H    GLN  17           HN       GLN  17 -13.293  -5.366   5.033
  116    HA   GLN  17           HA       GLN  17 -11.454  -4.321   6.955
  117   1HB   GLN  17          HB2       GLN  17 -13.361  -5.666   7.657
  118   2HB   GLN  17          HB1       GLN  17 -12.761  -7.039   6.738
  119   1HG   GLN  17          HG2       GLN  17 -10.829  -7.202   8.188
  120   2HG   GLN  17          HG1       GLN  17 -11.354  -5.777   9.082
  121   1HE2  GLN  17          HE21      GLN  17 -11.460  -6.905  11.018
  122   2HE2  GLN  17          HE22      GLN  17 -12.710  -8.050  11.352
  123    H    GLY  18           HN       GLY  18  -9.318  -4.482   6.924
  124   1HA   GLY  18          HA2       GLY  18  -7.361  -5.909   6.909
  125   2HA   GLY  18          HA1       GLY  18  -8.103  -6.823   5.603
  126    H    GLU  19           HN       GLU  19  -8.969  -4.296   4.278
  127    HA   GLU  19           HA       GLU  19  -6.557  -3.888   2.750
  128   1HB   GLU  19          HB2       GLU  19  -8.941  -4.052   1.824
  129   2HB   GLU  19          HB1       GLU  19  -9.156  -2.408   2.405
  130   1HG   GLU  19          HG2       GLU  19  -7.302  -1.668   0.991
  131   2HG   GLU  19          HG1       GLU  19  -7.109  -3.316   0.395
  132    H    LEU  20           HN       LEU  20  -5.976  -1.595   2.097
  133    HA   LEU  20           HA       LEU  20  -6.036   0.143   4.480
  134   1HB   LEU  20          HB2       LEU  20  -3.815  -0.857   3.910
  135   2HB   LEU  20          HB1       LEU  20  -3.874  -0.004   2.379
  136    HG   LEU  20           HG       LEU  20  -3.964   2.148   3.654
  137   1HD1  LEU  20          HD11      LEU  20  -3.362   0.353   6.000
  138   2HD1  LEU  20          HD12      LEU  20  -4.835   1.292   5.757
  139   3HD1  LEU  20          HD13      LEU  20  -3.295   2.114   6.008
  140   1HD2  LEU  20          HD21      LEU  20  -1.882   1.283   2.699
  141   2HD2  LEU  20          HD22      LEU  20  -1.571   0.391   4.190
  142   3HD2  LEU  20          HD23      LEU  20  -1.594   2.155   4.204
  143    H    GLY  21           HN       GLY  21  -6.756   2.186   4.245
  144   1HA   GLY  21          HA2       GLY  21  -7.334   3.090   1.491
  145   2HA   GLY  21          HA1       GLY  21  -8.358   3.457   2.870
  146    H    PHE  22           HN       PHE  22  -6.842   5.132   0.870
  147    HA   PHE  22           HA       PHE  22  -6.165   7.265   2.571
  148   1HB   PHE  22          HB2       PHE  22  -4.077   5.376   2.293
  149   2HB   PHE  22          HB1       PHE  22  -3.624   6.769   1.315
  150    HD1  PHE  22           HD1      PHE  22  -3.706   9.065   2.433
  151    HD2  PHE  22           HD2      PHE  22  -3.775   5.403   4.599
  152    HE1  PHE  22           HE1      PHE  22  -2.966  10.252   4.456
  153    HE2  PHE  22           HE2      PHE  22  -3.036   6.583   6.626
  154    HZ   PHE  22           HZ       PHE  22  -2.647   9.005   6.566
  155    H    LYS  23           HN       LYS  23  -4.603   8.867   1.125
  156    HA   LYS  23           HA       LYS  23  -5.825   8.853  -1.544
  157   1HB   LYS  23          HB2       LYS  23  -5.471  11.399  -1.391
  158   2HB   LYS  23          HB1       LYS  23  -6.848  10.669  -0.573
  159   1HG   LYS  23          HG2       LYS  23  -4.300  11.032   0.911
  160   2HG   LYS  23          HG1       LYS  23  -5.357  12.424   0.650
  161   1HD   LYS  23          HD2       LYS  23  -6.342   9.824   1.790
  162   2HD   LYS  23          HD1       LYS  23  -5.694  11.115   2.808
  163   1HE   LYS  23          HE2       LYS  23  -8.059  11.310   0.942
  164   2HE   LYS  23          HE1       LYS  23  -8.123  11.241   2.702
  165   1HZ   LYS  23          HZ1       LYS  23  -8.357  13.505   1.878
  166   2HZ   LYS  23          HZ2       LYS  23  -6.852  13.405   1.113
  167   3HZ   LYS  23          HZ3       LYS  23  -6.947  13.341   2.800
  168    H    GLU  24           HN       GLU  24  -4.656  10.287  -3.112
  169    HA   GLU  24           HA       GLU  24  -2.193   9.296  -3.763
  170   1HB   GLU  24          HB2       GLU  24  -1.964  11.232  -5.254
  171   2HB   GLU  24          HB1       GLU  24  -3.596  10.574  -5.303
  172   1HG   GLU  24          HG2       GLU  24  -3.998  12.370  -3.425
  173   2HG   GLU  24          HG1       GLU  24  -2.616  13.145  -4.199
  174    H    GLY  25           HN       GLY  25  -0.075  10.042  -3.614
  175   1HA   GLY  25          HA2       GLY  25   1.720  11.246  -2.771
  176   2HA   GLY  25          HA1       GLY  25   0.585  12.315  -1.963
  177    H    ASP  26           HN       ASP  26  -0.471   9.400  -1.054
  178    HA   ASP  26           HA       ASP  26   0.689   9.620   1.549
  179   1HB   ASP  26          HB2       ASP  26  -0.724   7.782   2.160
  180   2HB   ASP  26          HB1       ASP  26  -1.649   8.832   1.093
  181    H    ILE  27           HN       ILE  27   2.512   8.759   2.263
  182    HA   ILE  27           HA       ILE  27   3.919   6.812   0.605
  183    HB   ILE  27           HB       ILE  27   4.860   8.273   3.080
  184   1HG1  ILE  27          HG12      ILE  27   5.544   8.782   0.177
  185   2HG1  ILE  27          HG11      ILE  27   4.376   9.724   1.096
  186   1HG2  ILE  27          HG21      ILE  27   6.372   6.596   1.081
  187   2HG2  ILE  27          HG22      ILE  27   6.047   6.181   2.764
  188   3HG2  ILE  27          HG23      ILE  27   7.102   7.542   2.377
  189   1HD1  ILE  27          HD11      ILE  27   6.536  10.841   0.945
  190   2HD1  ILE  27          HD12      ILE  27   7.306   9.464   1.735
  191   3HD1  ILE  27          HD13      ILE  27   6.131  10.442   2.614
  192    H    ILE  28           HN       ILE  28   3.949   4.712   1.055
  193    HA   ILE  28           HA       ILE  28   3.257   3.847   3.787
  194    HB   ILE  28           HB       ILE  28   2.525   2.431   1.222
  195   1HG1  ILE  28          HG12      ILE  28   0.679   3.799   3.186
  196   2HG1  ILE  28          HG11      ILE  28   1.257   4.563   1.710
  197   1HG2  ILE  28          HG21      ILE  28   2.879   0.827   2.940
  198   2HG2  ILE  28          HG22      ILE  28   1.135   1.033   2.775
  199   3HG2  ILE  28          HG23      ILE  28   1.991   1.795   4.116
  200   1HD1  ILE  28          HD11      ILE  28  -0.322   2.005   1.805
  201   2HD1  ILE  28          HD12      ILE  28   0.154   2.905   0.365
  202   3HD1  ILE  28          HD13      ILE  28  -1.001   3.604   1.500
  203    H    THR  29           HN       THR  29   4.553   2.367   4.718
  204    HA   THR  29           HA       THR  29   6.889   1.472   3.201
  205    HB   THR  29           HB       THR  29   7.778   0.768   5.426
  206    HG1  THR  29           HG1      THR  29   5.252   1.738   6.229
  207   1HG2  THR  29          HG21      THR  29   8.340   2.967   4.529
  208   2HG2  THR  29          HG22      THR  29   8.162   3.043   6.281
  209   3HG2  THR  29          HG23      THR  29   6.874   3.645   5.238
  210    H    LEU  30           HN       LEU  30   6.795  -0.474   2.276
  211    HA   LEU  30           HA       LEU  30   4.890  -2.432   3.266
  212   1HB   LEU  30          HB2       LEU  30   5.284  -3.591   1.208
  213   2HB   LEU  30          HB1       LEU  30   4.934  -1.897   0.896
  214    HG   LEU  30           HG       LEU  30   7.641  -1.835   0.953
  215   1HD1  LEU  30          HD11      LEU  30   7.852  -4.238   1.239
  216   2HD1  LEU  30          HD12      LEU  30   8.463  -3.746  -0.341
  217   3HD1  LEU  30          HD13      LEU  30   6.880  -4.512  -0.207
  218   1HD2  LEU  30          HD21      LEU  30   5.911  -2.478  -1.433
  219   2HD2  LEU  30          HD22      LEU  30   7.528  -1.774  -1.485
  220   3HD2  LEU  30          HD23      LEU  30   6.196  -0.872  -0.762
  221    H    THR  31           HN       THR  31   5.391  -4.544   3.740
  222    HA   THR  31           HA       THR  31   8.027  -5.567   3.729
  223    HB   THR  31           HB       THR  31   8.131  -3.956   5.623
  224    HG1  THR  31           HG1      THR  31   8.608  -6.069   7.118
  225   1HG2  THR  31          HG21      THR  31   6.189  -5.874   6.915
  226   2HG2  THR  31          HG22      THR  31   5.851  -4.206   6.456
  227   3HG2  THR  31          HG23      THR  31   7.020  -4.550   7.731
  228    H    ASN  32           HN       ASN  32   5.063  -6.069   3.227
  229    HA   ASN  32           HA       ASN  32   5.046  -8.848   4.068
  230   1HB   ASN  32          HB2       ASN  32   2.918  -6.817   4.726
  231   2HB   ASN  32          HB1       ASN  32   2.613  -8.546   4.730
  232   1HD2  ASN  32          HD21      ASN  32   5.149  -9.314   5.782
  233   2HD2  ASN  32          HD22      ASN  32   5.181  -8.844   7.444
  234    H    GLN  33           HN       GLN  33   2.814  -9.766   3.028
  235    HA   GLN  33           HA       GLN  33   1.819  -8.457   0.734
  236   1HB   GLN  33          HB2       GLN  33   4.337  -9.873   0.412
  237   2HB   GLN  33          HB1       GLN  33   3.084 -10.454  -0.685
  238   1HG   GLN  33          HG2       GLN  33   2.772  -8.366  -1.632
  239   2HG   GLN  33          HG1       GLN  33   3.619  -7.535  -0.311
  240   1HE2  GLN  33          HE21      GLN  33   4.761 -10.462  -1.874
  241   2HE2  GLN  33          HE22      GLN  33   6.138  -9.753  -2.637
  242    H    ILE  34           HN       ILE  34   0.262  -9.607  -0.377
  243    HA   ILE  34           HA       ILE  34  -0.508 -12.128   0.897
  244    HB   ILE  34           HB       ILE  34  -2.301 -10.134  -0.497
  245   1HG1  ILE  34          HG12      ILE  34  -1.464  -9.266   1.632
  246   2HG1  ILE  34          HG11      ILE  34  -3.174  -9.659   1.758
  247   1HG2  ILE  34          HG21      ILE  34  -3.144 -12.395  -0.711
  248   2HG2  ILE  34          HG22      ILE  34  -4.140 -11.487   0.427
  249   3HG2  ILE  34          HG23      ILE  34  -2.961 -12.656   1.024
  250   1HD1  ILE  34          HD11      ILE  34  -2.010 -10.345   3.752
  251   2HD1  ILE  34          HD12      ILE  34  -0.881 -11.305   2.798
  252   3HD1  ILE  34          HD13      ILE  34  -2.581 -11.766   2.878
  253    H    ASP  35           HN       ASP  35   0.286 -10.587  -2.064
  254    HA   ASP  35           HA       ASP  35   0.456 -13.066  -3.455
  255   1HB   ASP  35          HB2       ASP  35  -1.976 -12.718  -3.620
  256   2HB   ASP  35          HB1       ASP  35  -1.703 -11.133  -4.336
  257    H    GLU  36           HN       GLU  36   1.173 -12.720  -5.750
  258    HA   GLU  36           HA       GLU  36   3.259 -10.849  -5.844
  259   1HB   GLU  36          HB2       GLU  36   3.513 -11.517  -8.199
  260   2HB   GLU  36          HB1       GLU  36   3.334 -12.906  -7.137
  261   1HG   GLU  36          HG2       GLU  36   1.962 -13.505  -8.854
  262   2HG   GLU  36          HG1       GLU  36   0.810 -12.700  -7.792
  263    H    ASN  37           HN       ASN  37  -0.004 -10.342  -6.157
  264    HA   ASN  37           HA       ASN  37   0.376  -7.962  -7.844
  265   1HB   ASN  37          HB2       ASN  37  -1.303  -9.647  -8.628
  266   2HB   ASN  37          HB1       ASN  37  -2.227  -9.345  -7.162
  267   1HD2  ASN  37          HD21      ASN  37  -2.956  -8.955  -9.957
  268   2HD2  ASN  37          HD22      ASN  37  -3.387  -7.288 -10.111
  269    H    TRP  38           HN       TRP  38  -1.413  -9.098  -4.967
  270    HA   TRP  38           HA       TRP  38  -1.706  -6.341  -4.067
  271   1HB   TRP  38          HB2       TRP  38  -2.695  -8.736  -2.544
  272   2HB   TRP  38          HB1       TRP  38  -3.310  -7.084  -2.529
  273    HD1  TRP  38           HD1      TRP  38  -2.964  -9.813  -5.301
  274    HE1  TRP  38           HE1      TRP  38  -5.175  -9.866  -6.616
  275    HE3  TRP  38           HE3      TRP  38  -5.508  -6.165  -2.773
  276    HZ2  TRP  38           HZ2      TRP  38  -7.667  -8.547  -6.583
  277    HZ3  TRP  38           HZ3      TRP  38  -7.802  -5.626  -3.476
  278    HH2  TRP  38           HH2      TRP  38  -8.859  -6.793  -5.342
  279    H    TYR  39           HN       TYR  39  -0.399  -5.423  -2.613
  280    HA   TYR  39           HA       TYR  39   1.565  -7.131  -1.240
  281   1HB   TYR  39          HB2       TYR  39   1.501  -4.194  -1.920
  282   2HB   TYR  39          HB1       TYR  39   2.649  -4.848  -0.761
  283    HD1  TYR  39           HD1      TYR  39   1.666  -6.846  -3.641
  284    HD2  TYR  39           HD2      TYR  39   4.543  -4.084  -2.158
  285    HE1  TYR  39           HE1      TYR  39   3.176  -7.432  -5.491
  286    HE2  TYR  39           HE2      TYR  39   6.058  -4.661  -4.004
  287    HH   TYR  39           HH       TYR  39   5.055  -6.458  -6.712
  288    H    GLU  40           HN       GLU  40   2.301  -6.050   0.924
  289    HA   GLU  40           HA       GLU  40   0.045  -5.017   2.422
  290   1HB   GLU  40          HB2       GLU  40  -0.268  -7.398   2.653
  291   2HB   GLU  40          HB1       GLU  40   1.408  -7.612   3.134
  292   1HG   GLU  40          HG2       GLU  40   0.925  -6.192   5.136
  293   2HG   GLU  40          HG1       GLU  40  -0.776  -6.228   4.672
  294    H    GLY  41           HN       GLY  41   0.590  -3.707   4.067
  295   1HA   GLY  41          HA2       GLY  41   3.115  -3.762   5.389
  296   2HA   GLY  41          HA1       GLY  41   3.064  -2.487   4.177
  297    H    MET  42           HN       MET  42   3.311  -0.984   5.976
  298    HA   MET  42           HA       MET  42   0.698  -0.315   7.112
  299   1HB   MET  42          HB2       MET  42   3.163  -0.196   8.835
  300   2HB   MET  42          HB1       MET  42   1.479  -0.060   9.327
  301   1HG   MET  42          HG2       MET  42   1.153  -2.430   8.725
  302   2HG   MET  42          HG1       MET  42   2.870  -2.544   8.347
  303   1HE   MET  42          HE1       MET  42   4.476  -1.826  11.872
  304   2HE   MET  42          HE2       MET  42   4.060  -0.616  10.659
  305   3HE   MET  42          HE3       MET  42   4.797  -2.141  10.165
  306    H    ILE  43           HN       ILE  43   0.378   1.847   7.588
  307    HA   ILE  43           HA       ILE  43   2.493   3.705   6.723
  308    HB   ILE  43           HB       ILE  43   0.849   3.667   4.958
  309   1HG1  ILE  43          HG12      ILE  43   0.348   6.130   6.641
  310   2HG1  ILE  43          HG11      ILE  43   1.809   5.867   5.691
  311   1HG2  ILE  43          HG21      ILE  43  -1.235   4.302   7.039
  312   2HG2  ILE  43          HG22      ILE  43  -1.003   2.727   6.281
  313   3HG2  ILE  43          HG23      ILE  43  -1.498   4.110   5.305
  314   1HD1  ILE  43          HD11      ILE  43   0.195   7.324   4.544
  315   2HD1  ILE  43          HD12      ILE  43  -0.989   6.016   4.571
  316   3HD1  ILE  43          HD13      ILE  43   0.500   5.837   3.644
  317    H    HIS  44           HN       HIS  44   3.089   4.983   8.329
  318    HA   HIS  44           HA       HIS  44   3.065   6.303  10.176
  319   1HB   HIS  44          HB2       HIS  44   1.085   7.360   9.072
  320   2HB   HIS  44          HB1       HIS  44   0.048   6.246   9.954
  321    HD1  HIS  44           HD1      HIS  44   1.750   9.469  10.243
  322    HD2  HIS  44           HD2      HIS  44   0.122   6.659  12.836
  323    HE1  HIS  44           HE1      HIS  44   1.488  10.656  12.445
  324    HE2  HIS  44           HE2      HIS  44   0.590   8.908  14.021
  325    H    GLY  45           HN       GLY  45   0.046   4.478  10.721
  326   1HA   GLY  45          HA2       GLY  45   1.358   2.778  12.669
  327   2HA   GLY  45          HA1       GLY  45   0.228   3.940  13.345
  328    H    GLU  46           HN       GLU  46  -0.316   2.507  10.203
  329    HA   GLU  46           HA       GLU  46  -2.276   0.657  11.358
  330   1HB   GLU  46          HB2       GLU  46  -2.897   2.489   9.036
  331   2HB   GLU  46          HB1       GLU  46  -3.990   1.330   9.780
  332   1HG   GLU  46          HG2       GLU  46  -4.683   3.344  10.665
  333   2HG   GLU  46          HG1       GLU  46  -3.634   2.704  11.927
  334    H    SER  47           HN       SER  47  -2.597  -1.225  10.237
  335    HA   SER  47           HA       SER  47  -0.769  -1.680   7.980
  336   1HB   SER  47          HB2       SER  47  -0.941  -4.076   8.553
  337   2HB   SER  47          HB1       SER  47  -0.374  -3.121   9.922
  338    HG   SER  47           HG       SER  47  -2.090  -3.680  10.993
  339    H    GLY  48           HN       GLY  48  -1.480  -3.006   6.204
  340   1HA   GLY  48          HA2       GLY  48  -4.094  -3.916   5.812
  341   2HA   GLY  48          HA1       GLY  48  -4.019  -2.266   5.212
  342    H    PHE  49           HN       PHE  49  -4.652  -4.199   3.449
  343    HA   PHE  49           HA       PHE  49  -2.200  -4.915   2.016
  344   1HB   PHE  49          HB2       PHE  49  -4.987  -5.681   1.175
  345   2HB   PHE  49          HB1       PHE  49  -3.469  -6.495   0.816
  346    HD1  PHE  49           HD1      PHE  49  -6.364  -6.966   2.475
  347    HD2  PHE  49           HD2      PHE  49  -2.180  -7.006   3.248
  348    HE1  PHE  49           HE1      PHE  49  -6.733  -8.482   4.378
  349    HE2  PHE  49           HE2      PHE  49  -2.543  -8.523   5.151
  350    HZ   PHE  49           HZ       PHE  49  -4.835  -9.270   5.709
  351    H    PHE  50           HN       PHE  50  -1.907  -4.370  -0.206
  352    HA   PHE  50           HA       PHE  50  -3.719  -2.687  -1.596
  353   1HB   PHE  50          HB2       PHE  50  -2.254  -0.656  -1.648
  354   2HB   PHE  50          HB1       PHE  50  -3.000  -0.972  -0.085
  355    HD1  PHE  50           HD1      PHE  50   0.055  -0.401  -1.835
  356    HD2  PHE  50           HD2      PHE  50  -1.587  -2.144   1.684
  357    HE1  PHE  50           HE1      PHE  50   2.269  -0.323  -0.766
  358    HE2  PHE  50           HE2      PHE  50   0.624  -2.066   2.758
  359    HZ   PHE  50           HZ       PHE  50   2.561  -1.148   1.520
  360    HA   PRO  51           HA       PRO  51  -1.056  -4.874  -4.587
  361   1HB   PRO  51          HB2       PRO  51  -2.698  -4.085  -6.700
  362   2HB   PRO  51          HB1       PRO  51  -2.823  -5.602  -5.807
  363   1HG   PRO  51          HG2       PRO  51  -4.374  -3.077  -5.481
  364   2HG   PRO  51          HG1       PRO  51  -4.918  -4.757  -5.333
  365   1HD   PRO  51          HD2       PRO  51  -4.485  -3.244  -3.170
  366   2HD   PRO  51          HD1       PRO  51  -4.066  -4.976  -3.180
  367    H    ILE  52           HN       ILE  52   0.063  -4.172  -6.539
  368    HA   ILE  52           HA       ILE  52   1.261  -1.634  -6.212
  369    HB   ILE  52           HB       ILE  52   1.395  -3.305  -8.715
  370   1HG1  ILE  52          HG12      ILE  52   3.125  -3.603  -6.251
  371   2HG1  ILE  52          HG11      ILE  52   1.785  -4.675  -6.644
  372   1HG2  ILE  52          HG21      ILE  52   2.400  -1.097  -8.864
  373   2HG2  ILE  52          HG22      ILE  52   3.646  -2.345  -8.886
  374   3HG2  ILE  52          HG23      ILE  52   3.354  -1.416  -7.415
  375   1HD1  ILE  52          HD11      ILE  52   2.920  -5.279  -8.740
  376   2HD1  ILE  52          HD12      ILE  52   3.870  -5.676  -7.309
  377   3HD1  ILE  52          HD13      ILE  52   4.280  -4.258  -8.273
  378    H    ASN  53           HN       ASN  53  -1.538  -2.653  -7.947
  379    HA   ASN  53           HA       ASN  53  -1.541  -0.646  -9.944
  380   1HB   ASN  53          HB2       ASN  53  -3.957  -1.263 -10.162
  381   2HB   ASN  53          HB1       ASN  53  -2.851  -2.622 -10.284
  382   1HD2  ASN  53          HD21      ASN  53  -4.372  -4.131  -9.688
  383   2HD2  ASN  53          HD22      ASN  53  -4.997  -4.246  -8.081
  384    H    TYR  54           HN       TYR  54  -1.648  -0.221  -6.721
  385    HA   TYR  54           HA       TYR  54  -3.358   2.164  -6.966
  386   1HB   TYR  54          HB2       TYR  54  -3.065   0.329  -4.582
  387   2HB   TYR  54          HB1       TYR  54  -3.873   1.890  -4.528
  388    HD1  TYR  54           HD1      TYR  54  -5.342   1.799  -7.135
  389    HD2  TYR  54           HD2      TYR  54  -4.801  -1.169  -4.136
  390    HE1  TYR  54           HE1      TYR  54  -7.450   0.735  -7.817
  391    HE2  TYR  54           HE2      TYR  54  -6.907  -2.244  -4.812
  392    HH   TYR  54           HH       TYR  54  -9.000  -1.634  -5.955
  393    H    VAL  55           HN       VAL  55  -0.277   0.955  -6.312
  394    HA   VAL  55           HA       VAL  55   0.567   3.592  -5.345
  395    HB   VAL  55           HB       VAL  55   2.125   2.599  -3.724
  396   1HG1  VAL  55          HG11      VAL  55   0.438   1.927  -2.036
  397   2HG1  VAL  55          HG12      VAL  55  -0.778   1.884  -3.313
  398   3HG1  VAL  55          HG13      VAL  55   0.011   3.404  -2.897
  399   1HG2  VAL  55          HG21      VAL  55   0.708   0.011  -4.364
  400   2HG2  VAL  55          HG22      VAL  55   1.872   0.250  -3.061
  401   3HG2  VAL  55          HG23      VAL  55   2.385   0.403  -4.741
  402    H    GLU  56           HN       GLU  56   3.074   3.588  -5.215
  403    HA   GLU  56           HA       GLU  56   4.248   2.109  -7.454
  404   1HB   GLU  56          HB2       GLU  56   3.452   4.485  -8.079
  405   2HB   GLU  56          HB1       GLU  56   4.782   5.050  -7.081
  406   1HG   GLU  56          HG2       GLU  56   5.091   3.198  -9.431
  407   2HG   GLU  56          HG1       GLU  56   5.294   4.947  -9.503
  408    H    VAL  57           HN       VAL  57   5.654   0.901  -6.312
  409    HA   VAL  57           HA       VAL  57   6.909   1.617  -3.928
  410    HB   VAL  57           HB       VAL  57   7.900  -0.344  -6.006
  411   1HG1  VAL  57          HG11      VAL  57   9.641   0.230  -4.412
  412   2HG1  VAL  57          HG12      VAL  57   9.063  -1.411  -4.119
  413   3HG1  VAL  57          HG13      VAL  57   8.545  -0.093  -3.068
  414   1HG2  VAL  57          HG21      VAL  57   5.626  -0.845  -5.308
  415   2HG2  VAL  57          HG22      VAL  57   6.107  -0.752  -3.614
  416   3HG2  VAL  57          HG23      VAL  57   6.749  -2.033  -4.642
  417    H    ILE  58           HN       ILE  58   8.359   3.140  -3.552
  418    HA   ILE  58           HA       ILE  58   9.773   4.501  -5.601
  419    HB   ILE  58           HB       ILE  58  10.283   4.542  -2.624
  420   1HG1  ILE  58          HG12      ILE  58   7.965   5.154  -3.188
  421   2HG1  ILE  58          HG11      ILE  58   8.868   6.540  -2.587
  422   1HG2  ILE  58          HG21      ILE  58  12.157   5.425  -3.887
  423   2HG2  ILE  58          HG22      ILE  58  11.311   6.731  -3.057
  424   3HG2  ILE  58          HG23      ILE  58  11.076   6.488  -4.787
  425   1HD1  ILE  58          HD11      ILE  58   9.179   7.308  -4.899
  426   2HD1  ILE  58          HD12      ILE  58   7.480   7.184  -4.447
  427   3HD1  ILE  58          HD13      ILE  58   8.214   5.944  -5.463
  428    H    VAL  59           HN       VAL  59  10.797   2.180  -3.102
  429    HA   VAL  59           HA       VAL  59  13.112   1.531  -4.780
  430    HB   VAL  59           HB       VAL  59  14.065   3.015  -3.185
  431   1HG1  VAL  59          HG11      VAL  59  13.812   2.789  -0.785
  432   2HG1  VAL  59          HG12      VAL  59  12.765   1.387  -1.005
  433   3HG1  VAL  59          HG13      VAL  59  12.235   2.978  -1.551
  434   1HG2  VAL  59          HG21      VAL  59  15.643   1.579  -2.003
  435   2HG2  VAL  59          HG22      VAL  59  15.368   1.002  -3.646
  436   3HG2  VAL  59          HG23      VAL  59  14.599   0.187  -2.285
  437    HA   PRO  60           HA       PRO  60  11.010  -2.403  -3.762
  438   1HB   PRO  60          HB2       PRO  60  12.839  -3.343  -5.892
  439   2HB   PRO  60          HB1       PRO  60  11.091  -3.544  -5.742
  440   1HG   PRO  60          HG2       PRO  60  12.139  -1.857  -7.528
  441   2HG   PRO  60          HG1       PRO  60  10.639  -1.472  -6.663
  442   1HD   PRO  60          HD2       PRO  60  13.417  -0.463  -6.187
  443   2HD   PRO  60          HD1       PRO  60  11.873   0.412  -6.122
  Start of MODEL    8
    1   1H    MET   1          HT1       MET   1  19.060   0.808   7.979
    2   2H    MET   1          HT2       MET   1  17.748   0.887   9.042
    3   3H    MET   1          HT3       MET   1  19.315   1.184   9.608
    4    HA   MET   1           HA       MET   1  18.071   3.233   9.360
    5   1HB   MET   1          HB2       MET   1  20.571   3.062   8.964
    6   2HB   MET   1          HB1       MET   1  20.217   3.035   7.242
    7   1HG   MET   1          HG2       MET   1  19.287   5.257   9.030
    8   2HG   MET   1          HG1       MET   1  20.876   5.260   8.272
    9   1HE   MET   1          HE1       MET   1  19.996   5.348   4.471
   10   2HE   MET   1          HE2       MET   1  20.338   3.929   5.461
   11   3HE   MET   1          HE3       MET   1  21.286   5.401   5.672
   12    H    ASP   2           HN       ASP   2  18.654   1.677   6.203
   13    HA   ASP   2           HA       ASP   2  16.786   3.406   4.870
   14   1HB   ASP   2          HB2       ASP   2  18.729   2.528   3.667
   15   2HB   ASP   2          HB1       ASP   2  18.158   0.881   3.916
   16    H    GLN   3           HN       GLN   3  14.740   2.938   4.151
   17    HA   GLN   3           HA       GLN   3  13.598   0.326   4.801
   18   1HB   GLN   3          HB2       GLN   3  11.583   1.455   5.772
   19   2HB   GLN   3          HB1       GLN   3  13.040   1.606   6.744
   20   1HG   GLN   3          HG2       GLN   3  13.382   3.866   5.881
   21   2HG   GLN   3          HG1       GLN   3  11.919   3.714   4.909
   22   1HE2  GLN   3          HE21      GLN   3  13.213   4.063   8.117
   23   2HE2  GLN   3          HE22      GLN   3  11.731   4.507   8.887
   24    HA   PRO   4           HA       PRO   4  11.931   1.055   0.721
   25   1HB   PRO   4          HB2       PRO   4  10.333  -1.123   0.561
   26   2HB   PRO   4          HB1       PRO   4  12.091  -1.222   0.411
   27   1HG   PRO   4          HG2       PRO   4  10.357  -1.780   2.788
   28   2HG   PRO   4          HG1       PRO   4  11.739  -2.704   2.172
   29   1HD   PRO   4          HD2       PRO   4  11.937  -0.999   4.269
   30   2HD   PRO   4          HD1       PRO   4  13.277  -1.288   3.142
   31    H    CYS   5           HN       CYS   5  10.289   2.301   0.064
   32    HA   CYS   5           HA       CYS   5   7.695   2.092   1.401
   33   1HB   CYS   5          HB2       CYS   5   9.200   4.688   1.024
   34   2HB   CYS   5          HB1       CYS   5   7.535   4.556   1.578
   35    HG   CYS   5           HG       CYS   5   9.845   2.854   3.353
   36    H    CYS   6           HN       CYS   6   6.033   3.490   0.240
   37    HA   CYS   6           HA       CYS   6   6.576   3.831  -2.606
   38   1HB   CYS   6          HB2       CYS   6   4.724   2.479  -3.316
   39   2HB   CYS   6          HB1       CYS   6   5.748   1.499  -2.285
   40    HG   CYS   6           HG       CYS   6   3.768   0.664  -0.893
   41    H    ARG   7           HN       ARG   7   4.435   4.652  -3.688
   42    HA   ARG   7           HA       ARG   7   2.975   6.404  -1.845
   43   1HB   ARG   7          HB2       ARG   7   4.376   7.376  -4.340
   44   2HB   ARG   7          HB1       ARG   7   3.257   8.331  -3.378
   45   1HG   ARG   7          HG2       ARG   7   4.798   8.035  -1.436
   46   2HG   ARG   7          HG1       ARG   7   5.949   7.284  -2.542
   47   1HD   ARG   7          HD2       ARG   7   5.963   9.331  -3.895
   48   2HD   ARG   7          HD1       ARG   7   4.838  10.079  -2.763
   49    HE   ARG   7           HE       ARG   7   7.235   9.123  -1.512
   50   1HH1  ARG   7          HH11      ARG   7   5.793  11.781  -3.244
   51   2HH1  ARG   7          HH12      ARG   7   6.886  12.961  -2.600
   52   1HH2  ARG   7          HH21      ARG   7   8.677  10.669  -0.660
   53   2HH2  ARG   7          HH22      ARG   7   8.525  12.328  -1.133
   54    H    GLY   8           HN       GLY   8   0.874   6.740  -2.367
   55   1HA   GLY   8          HA2       GLY   8  -0.287   5.061  -4.373
   56   2HA   GLY   8          HA1       GLY   8  -1.147   6.172  -3.323
   57    H    LEU   9           HN       LEU   9  -1.064   5.524  -6.341
   58    HA   LEU   9           HA       LEU   9  -0.371   8.077  -7.503
   59   1HB   LEU   9          HB2       LEU   9  -1.392   5.472  -8.549
   60   2HB   LEU   9          HB1       LEU   9  -1.559   6.908  -9.539
   61    HG   LEU   9           HG       LEU   9   0.441   5.612 -10.126
   62   1HD1  LEU   9          HD11      LEU   9   0.461   8.005 -10.510
   63   2HD1  LEU   9          HD12      LEU   9   2.064   7.450 -10.028
   64   3HD1  LEU   9          HD13      LEU   9   1.034   8.284  -8.866
   65   1HD2  LEU   9          HD21      LEU   9   0.925   4.648  -7.945
   66   2HD2  LEU   9          HD22      LEU   9   1.340   6.242  -7.318
   67   3HD2  LEU   9          HD23      LEU   9   2.331   5.504  -8.575
   68    H    TYR  10           HN       TYR  10  -3.209   6.423  -6.389
   69    HA   TYR  10           HA       TYR  10  -4.747   8.870  -6.676
   70   1HB   TYR  10          HB2       TYR  10  -6.647   7.733  -7.740
   71   2HB   TYR  10          HB1       TYR  10  -5.230   7.786  -8.775
   72    HD1  TYR  10           HD1      TYR  10  -3.789   5.690  -8.937
   73    HD2  TYR  10           HD2      TYR  10  -7.690   5.690  -7.238
   74    HE1  TYR  10           HE1      TYR  10  -3.915   3.253  -9.237
   75    HE2  TYR  10           HE2      TYR  10  -7.827   3.254  -7.536
   76    HH   TYR  10           HH       TYR  10  -5.140   1.337  -8.258
   77    H    ASP  11           HN       ASP  11  -6.681   8.903  -5.409
   78    HA   ASP  11           HA       ASP  11  -6.346   7.619  -2.905
   79   1HB   ASP  11          HB2       ASP  11  -8.596   8.695  -2.412
   80   2HB   ASP  11          HB1       ASP  11  -7.282   9.772  -2.853
   81    H    PHE  12           HN       PHE  12  -8.125   6.560  -1.763
   82    HA   PHE  12           HA       PHE  12 -10.090   5.071  -3.186
   83   1HB   PHE  12          HB2       PHE  12  -7.574   3.890  -3.206
   84   2HB   PHE  12          HB1       PHE  12  -8.445   3.074  -1.913
   85    HD1  PHE  12           HD1      PHE  12  -7.891   3.221  -5.400
   86    HD2  PHE  12           HD2      PHE  12 -10.802   2.192  -2.472
   87    HE1  PHE  12           HE1      PHE  12  -9.062   1.831  -7.058
   88    HE2  PHE  12           HE2      PHE  12 -11.978   0.799  -4.124
   89    HZ   PHE  12           HZ       PHE  12 -11.108   0.617  -6.421
   90    H    GLU  13           HN       GLU  13 -11.709   4.614  -1.874
   91    HA   GLU  13           HA       GLU  13 -11.234   4.724   1.031
   92   1HB   GLU  13          HB2       GLU  13 -12.687   6.518   0.105
   93   2HB   GLU  13          HB1       GLU  13 -13.792   5.287  -0.487
   94   1HG   GLU  13          HG2       GLU  13 -14.636   6.232   1.555
   95   2HG   GLU  13          HG1       GLU  13 -14.182   4.549   1.821
   96    HA   PRO  14           HA       PRO  14 -12.081   0.261   0.183
   97   1HB   PRO  14          HB2       PRO  14 -11.396  -0.365   2.826
   98   2HB   PRO  14          HB1       PRO  14 -10.330  -0.467   1.423
   99   1HG   PRO  14          HG2       PRO  14 -10.582   1.692   3.461
  100   2HG   PRO  14          HG1       PRO  14  -9.133   1.087   2.637
  101   1HD   PRO  14          HD2       PRO  14 -10.251   3.410   1.934
  102   2HD   PRO  14          HD1       PRO  14  -9.568   2.317   0.710
  103    H    GLU  15           HN       GLU  15 -13.646  -1.178   1.018
  104    HA   GLU  15           HA       GLU  15 -15.621   0.066   2.819
  105   1HB   GLU  15          HB2       GLU  15 -16.087  -1.668   0.391
  106   2HB   GLU  15          HB1       GLU  15 -17.342  -1.259   1.552
  107   1HG   GLU  15          HG2       GLU  15 -15.776   0.737  -0.068
  108   2HG   GLU  15          HG1       GLU  15 -17.388   0.146  -0.466
  109    H    ASN  16           HN       ASN  16 -13.322  -2.109   2.874
  110    HA   ASN  16           HA       ASN  16 -14.803  -3.884   4.673
  111   1HB   ASN  16          HB2       ASN  16 -14.585  -5.008   2.458
  112   2HB   ASN  16          HB1       ASN  16 -12.836  -4.882   2.606
  113   1HD2  ASN  16          HD21      ASN  16 -14.955  -5.525   5.306
  114   2HD2  ASN  16          HD22      ASN  16 -14.449  -7.156   5.563
  115    H    GLN  17           HN       GLN  17 -13.487  -4.945   6.246
  116    HA   GLN  17           HA       GLN  17 -11.304  -3.307   7.142
  117   1HB   GLN  17          HB2       GLN  17 -12.867  -4.175   8.769
  118   2HB   GLN  17          HB1       GLN  17 -12.541  -5.826   8.262
  119   1HG   GLN  17          HG2       GLN  17 -10.252  -5.630   9.078
  120   2HG   GLN  17          HG1       GLN  17 -10.571  -3.970   9.580
  121   1HE2  GLN  17          HE21      GLN  17 -13.294  -4.621  10.449
  122   2HE2  GLN  17          HE22      GLN  17 -13.122  -5.462  11.948
  123    H    GLY  18           HN       GLY  18  -9.155  -3.825   7.271
  124   1HA   GLY  18          HA2       GLY  18  -7.389  -5.509   7.218
  125   2HA   GLY  18          HA1       GLY  18  -8.324  -6.355   5.993
  126    H    GLU  19           HN       GLU  19  -8.986  -3.780   4.654
  127    HA   GLU  19           HA       GLU  19  -6.601  -3.639   3.013
  128   1HB   GLU  19          HB2       GLU  19  -9.083  -3.664   2.223
  129   2HB   GLU  19          HB1       GLU  19  -9.051  -1.953   2.619
  130   1HG   GLU  19          HG2       GLU  19  -7.286  -1.563   1.036
  131   2HG   GLU  19          HG1       GLU  19  -7.154  -3.291   0.710
  132    H    LEU  20           HN       LEU  20  -5.769  -1.479   2.322
  133    HA   LEU  20           HA       LEU  20  -5.688   0.308   4.664
  134   1HB   LEU  20          HB2       LEU  20  -3.572  -0.825   3.806
  135   2HB   LEU  20          HB1       LEU  20  -3.689   0.235   2.416
  136    HG   LEU  20           HG       LEU  20  -3.496   2.195   3.893
  137   1HD1  LEU  20          HD11      LEU  20  -3.155   0.136   6.070
  138   2HD1  LEU  20          HD12      LEU  20  -4.474   1.296   5.914
  139   3HD1  LEU  20          HD13      LEU  20  -2.838   1.862   6.244
  140   1HD2  LEU  20          HD21      LEU  20  -1.161   1.971   4.371
  141   2HD2  LEU  20          HD22      LEU  20  -1.504   1.094   2.880
  142   3HD2  LEU  20          HD23      LEU  20  -1.283   0.211   4.391
  143    H    GLY  21           HN       GLY  21  -6.926   2.046   4.477
  144   1HA   GLY  21          HA2       GLY  21  -7.566   3.101   1.826
  145   2HA   GLY  21          HA1       GLY  21  -8.364   3.526   3.332
  146    H    PHE  22           HN       PHE  22  -7.060   5.108   1.088
  147    HA   PHE  22           HA       PHE  22  -6.063   7.219   2.661
  148   1HB   PHE  22          HB2       PHE  22  -4.123   5.206   2.072
  149   2HB   PHE  22          HB1       PHE  22  -3.710   6.655   1.160
  150    HD1  PHE  22           HD1      PHE  22  -3.872   8.893   2.583
  151    HD2  PHE  22           HD2      PHE  22  -3.284   4.999   4.195
  152    HE1  PHE  22           HE1      PHE  22  -2.880   9.885   4.604
  153    HE2  PHE  22           HE2      PHE  22  -2.293   5.984   6.220
  154    HZ   PHE  22           HZ       PHE  22  -2.092   8.430   6.428
  155    H    LYS  23           HN       LYS  23  -4.469   8.608   0.977
  156    HA   LYS  23           HA       LYS  23  -5.859   8.622  -1.594
  157   1HB   LYS  23          HB2       LYS  23  -5.693  11.162  -1.500
  158   2HB   LYS  23          HB1       LYS  23  -6.954  10.388  -0.542
  159   1HG   LYS  23          HG2       LYS  23  -4.309  10.984   0.683
  160   2HG   LYS  23          HG1       LYS  23  -5.505  12.270   0.500
  161   1HD   LYS  23          HD2       LYS  23  -6.149   9.633   1.785
  162   2HD   LYS  23          HD1       LYS  23  -5.507  10.995   2.709
  163   1HE   LYS  23          HE2       LYS  23  -8.060  10.946   1.101
  164   2HE   LYS  23          HE1       LYS  23  -7.929  10.944   2.859
  165   1HZ   LYS  23          HZ1       LYS  23  -8.431  13.148   2.010
  166   2HZ   LYS  23          HZ2       LYS  23  -7.032  13.133   1.062
  167   3HZ   LYS  23          HZ3       LYS  23  -6.909  13.131   2.749
  168    H    GLU  24           HN       GLU  24  -4.756  10.053  -3.209
  169    HA   GLU  24           HA       GLU  24  -2.235   9.188  -3.810
  170   1HB   GLU  24          HB2       GLU  24  -2.074  11.176  -5.293
  171   2HB   GLU  24          HB1       GLU  24  -3.614  10.333  -5.431
  172   1HG   GLU  24          HG2       GLU  24  -4.513  12.363  -5.214
  173   2HG   GLU  24          HG1       GLU  24  -4.168  12.146  -3.495
  174    H    GLY  25           HN       GLY  25  -0.156  10.026  -3.621
  175   1HA   GLY  25          HA2       GLY  25   1.553  11.349  -2.768
  176   2HA   GLY  25          HA1       GLY  25   0.347  12.348  -1.974
  177    H    ASP  26           HN       ASP  26  -0.544   9.363  -1.101
  178    HA   ASP  26           HA       ASP  26   0.601   9.627   1.518
  179   1HB   ASP  26          HB2       ASP  26  -0.820   7.854   2.163
  180   2HB   ASP  26          HB1       ASP  26  -1.737   8.747   0.956
  181    H    ILE  27           HN       ILE  27   2.197   8.433   2.461
  182    HA   ILE  27           HA       ILE  27   3.692   6.638   0.671
  183    HB   ILE  27           HB       ILE  27   4.690   8.068   3.142
  184   1HG1  ILE  27          HG12      ILE  27   5.280   8.645   0.231
  185   2HG1  ILE  27          HG11      ILE  27   4.148   9.568   1.215
  186   1HG2  ILE  27          HG21      ILE  27   6.160   6.460   1.057
  187   2HG2  ILE  27          HG22      ILE  27   5.859   5.976   2.725
  188   3HG2  ILE  27          HG23      ILE  27   6.907   7.352   2.383
  189   1HD1  ILE  27          HD11      ILE  27   5.975  10.212   2.701
  190   2HD1  ILE  27          HD12      ILE  27   6.278  10.705   1.036
  191   3HD1  ILE  27          HD13      ILE  27   7.104   9.297   1.704
  192    H    ILE  28           HN       ILE  28   3.810   4.535   1.144
  193    HA   ILE  28           HA       ILE  28   3.069   3.666   3.866
  194    HB   ILE  28           HB       ILE  28   2.468   2.177   1.309
  195   1HG1  ILE  28          HG12      ILE  28   0.472   3.561   3.098
  196   2HG1  ILE  28          HG11      ILE  28   1.186   4.353   1.697
  197   1HG2  ILE  28          HG21      ILE  28   1.619   1.682   4.159
  198   2HG2  ILE  28          HG22      ILE  28   2.780   0.729   3.236
  199   3HG2  ILE  28          HG23      ILE  28   1.085   0.760   2.754
  200   1HD1  ILE  28          HD11      ILE  28   0.206   2.772   0.214
  201   2HD1  ILE  28          HD12      ILE  28  -1.056   3.346   1.305
  202   3HD1  ILE  28          HD13      ILE  28  -0.326   1.760   1.556
  203    H    THR  29           HN       THR  29   4.298   2.092   4.814
  204    HA   THR  29           HA       THR  29   6.826   1.470   3.526
  205    HB   THR  29           HB       THR  29   7.492   0.495   5.658
  206    HG1  THR  29           HG1      THR  29   5.014  -0.016   6.025
  207   1HG2  THR  29          HG21      THR  29   7.677   2.926   5.396
  208   2HG2  THR  29          HG22      THR  29   7.341   2.484   7.070
  209   3HG2  THR  29          HG23      THR  29   6.050   3.119   6.049
  210    H    LEU  30           HN       LEU  30   7.282  -0.391   2.531
  211    HA   LEU  30           HA       LEU  30   5.251  -2.492   2.517
  212   1HB   LEU  30          HB2       LEU  30   6.196  -1.472   0.414
  213   2HB   LEU  30          HB1       LEU  30   7.719  -2.241   0.811
  214    HG   LEU  30           HG       LEU  30   6.574  -4.452   0.718
  215   1HD1  LEU  30          HD11      LEU  30   4.389  -4.596  -0.351
  216   2HD1  LEU  30          HD12      LEU  30   4.285  -2.836  -0.395
  217   3HD1  LEU  30          HD13      LEU  30   4.299  -3.681   1.154
  218   1HD2  LEU  30          HD21      LEU  30   6.542  -4.572  -1.689
  219   2HD2  LEU  30          HD22      LEU  30   7.850  -3.505  -1.177
  220   3HD2  LEU  30          HD23      LEU  30   6.352  -2.824  -1.809
  221    H    THR  31           HN       THR  31   5.515  -4.392   3.525
  222    HA   THR  31           HA       THR  31   8.038  -5.638   3.824
  223    HB   THR  31           HB       THR  31   8.288  -3.948   5.587
  224    HG1  THR  31           HG1      THR  31   9.400  -5.569   6.378
  225   1HG2  THR  31          HG21      THR  31   5.858  -3.761   6.128
  226   2HG2  THR  31          HG22      THR  31   6.894  -3.937   7.544
  227   3HG2  THR  31          HG23      THR  31   5.971  -5.316   6.951
  228    H    ASN  32           HN       ASN  32   5.058  -5.980   3.165
  229    HA   ASN  32           HA       ASN  32   4.851  -8.672   4.221
  230   1HB   ASN  32          HB2       ASN  32   2.735  -6.555   4.588
  231   2HB   ASN  32          HB1       ASN  32   2.473  -8.270   4.844
  232   1HD2  ASN  32          HD21      ASN  32   3.784  -5.367   6.110
  233   2HD2  ASN  32          HD22      ASN  32   4.253  -5.988   7.653
  234    H    GLN  33           HN       GLN  33   2.724  -9.666   3.133
  235    HA   GLN  33           HA       GLN  33   1.788  -8.489   0.745
  236   1HB   GLN  33          HB2       GLN  33   4.343  -9.850   0.575
  237   2HB   GLN  33          HB1       GLN  33   3.146 -10.535  -0.522
  238   1HG   GLN  33          HG2       GLN  33   2.782  -8.486  -1.577
  239   2HG   GLN  33          HG1       GLN  33   3.645  -7.588  -0.314
  240   1HE2  GLN  33          HE21      GLN  33   3.949  -9.632  -3.122
  241   2HE2  GLN  33          HE22      GLN  33   5.635  -9.363  -3.391
  242    H    ILE  34           HN       ILE  34   0.310  -9.709  -0.393
  243    HA   ILE  34           HA       ILE  34  -0.524 -12.169   0.956
  244    HB   ILE  34           HB       ILE  34  -2.141 -10.160  -0.609
  245   1HG1  ILE  34          HG12      ILE  34  -1.609  -9.591   1.747
  246   2HG1  ILE  34          HG11      ILE  34  -3.334  -9.817   1.477
  247   1HG2  ILE  34          HG21      ILE  34  -3.009 -12.833   0.484
  248   2HG2  ILE  34          HG22      ILE  34  -2.953 -12.344  -1.210
  249   3HG2  ILE  34          HG23      ILE  34  -4.104 -11.585  -0.110
  250   1HD1  ILE  34          HD11      ILE  34  -2.672 -10.817   3.567
  251   2HD1  ILE  34          HD12      ILE  34  -1.452 -11.792   2.751
  252   3HD1  ILE  34          HD13      ILE  34  -3.164 -12.074   2.433
  253    H    ASP  35           HN       ASP  35   0.237 -10.726  -2.114
  254    HA   ASP  35           HA       ASP  35   0.751 -13.270  -3.299
  255   1HB   ASP  35          HB2       ASP  35  -1.720 -13.179  -3.496
  256   2HB   ASP  35          HB1       ASP  35  -1.572 -11.687  -4.419
  257    H    GLU  36           HN       GLU  36   1.297 -12.974  -5.705
  258    HA   GLU  36           HA       GLU  36   3.297 -11.038  -5.951
  259   1HB   GLU  36          HB2       GLU  36   3.419 -11.725  -8.309
  260   2HB   GLU  36          HB1       GLU  36   3.327 -13.110  -7.230
  261   1HG   GLU  36          HG2       GLU  36   0.922 -13.297  -7.720
  262   2HG   GLU  36          HG1       GLU  36   1.072 -11.957  -8.855
  263    H    ASN  37           HN       ASN  37  -0.035 -10.673  -6.194
  264    HA   ASN  37           HA       ASN  37   0.210  -8.304  -7.915
  265   1HB   ASN  37          HB2       ASN  37  -2.248  -9.868  -7.099
  266   2HB   ASN  37          HB1       ASN  37  -2.256  -8.434  -8.122
  267   1HD2  ASN  37          HD21      ASN  37  -1.462  -8.565 -10.218
  268   2HD2  ASN  37          HD22      ASN  37  -1.214 -10.078 -11.014
  269    H    TRP  38           HN       TRP  38  -1.509  -9.356  -4.960
  270    HA   TRP  38           HA       TRP  38  -1.750  -6.575  -4.133
  271   1HB   TRP  38          HB2       TRP  38  -2.727  -8.835  -2.444
  272   2HB   TRP  38          HB1       TRP  38  -3.411  -7.225  -2.673
  273    HD1  TRP  38           HD1      TRP  38  -4.395  -6.880  -5.365
  274    HE1  TRP  38           HE1      TRP  38  -5.917  -8.514  -6.640
  275    HE3  TRP  38           HE3      TRP  38  -3.439 -11.130  -2.693
  276    HZ2  TRP  38           HZ2      TRP  38  -6.623 -11.244  -6.529
  277    HZ3  TRP  38           HZ3      TRP  38  -4.580 -13.211  -3.341
  278    HH2  TRP  38           HH2      TRP  38  -6.139 -13.266  -5.220
  279    H    TYR  39           HN       TYR  39  -0.463  -5.615  -2.697
  280    HA   TYR  39           HA       TYR  39   1.486  -7.298  -1.255
  281   1HB   TYR  39          HB2       TYR  39   1.596  -4.463  -2.270
  282   2HB   TYR  39          HB1       TYR  39   2.711  -5.033  -1.034
  283    HD1  TYR  39           HD1      TYR  39   1.424  -6.846  -4.014
  284    HD2  TYR  39           HD2      TYR  39   4.791  -5.054  -2.133
  285    HE1  TYR  39           HE1      TYR  39   2.880  -7.746  -5.778
  286    HE2  TYR  39           HE2      TYR  39   6.257  -5.946  -3.892
  287    HH   TYR  39           HH       TYR  39   6.259  -7.788  -5.528
  288    H    GLU  40           HN       GLU  40   2.296  -6.190   0.833
  289    HA   GLU  40           HA       GLU  40   0.100  -4.879   2.232
  290   1HB   GLU  40          HB2       GLU  40   1.309  -7.513   2.964
  291   2HB   GLU  40          HB1       GLU  40   0.665  -6.463   4.217
  292   1HG   GLU  40          HG2       GLU  40  -1.494  -6.442   2.962
  293   2HG   GLU  40          HG1       GLU  40  -0.815  -7.678   1.904
  294    H    GLY  41           HN       GLY  41   0.650  -3.609   3.950
  295   1HA   GLY  41          HA2       GLY  41   3.338  -3.500   4.975
  296   2HA   GLY  41          HA1       GLY  41   2.933  -2.147   3.928
  297    H    MET  42           HN       MET  42   3.451  -1.072   6.109
  298    HA   MET  42           HA       MET  42   0.896  -0.690   7.508
  299   1HB   MET  42          HB2       MET  42   3.464  -0.589   9.049
  300   2HB   MET  42          HB1       MET  42   1.822  -0.825   9.640
  301   1HG   MET  42          HG2       MET  42   1.794  -3.067   8.699
  302   2HG   MET  42          HG1       MET  42   3.421  -2.834   8.065
  303   1HE   MET  42          HE1       MET  42   4.871  -1.269  10.376
  304   2HE   MET  42          HE2       MET  42   5.593  -2.660   9.566
  305   3HE   MET  42          HE3       MET  42   5.555  -2.588  11.327
  306    H    ILE  43           HN       ILE  43   0.670   1.327   8.568
  307    HA   ILE  43           HA       ILE  43   2.591   3.416   7.934
  308    HB   ILE  43           HB       ILE  43   0.735   3.115   6.092
  309   1HG1  ILE  43          HG12      ILE  43   2.455   4.871   6.139
  310   2HG1  ILE  43          HG11      ILE  43   0.911   5.457   5.524
  311   1HG2  ILE  43          HG21      ILE  43  -1.232   4.489   6.435
  312   2HG2  ILE  43          HG22      ILE  43  -0.725   4.819   8.092
  313   3HG2  ILE  43          HG23      ILE  43  -1.165   3.178   7.613
  314   1HD1  ILE  43          HD11      ILE  43   0.445   6.389   7.778
  315   2HD1  ILE  43          HD12      ILE  43   1.838   7.115   6.974
  316   3HD1  ILE  43          HD13      ILE  43   2.077   5.926   8.254
  317    H    HIS  44           HN       HIS  44   2.743   4.858   9.547
  318    HA   HIS  44           HA       HIS  44   2.386   5.935  11.511
  319   1HB   HIS  44          HB2       HIS  44   0.337   6.760  10.444
  320   2HB   HIS  44          HB1       HIS  44  -0.527   5.317  10.966
  321    HD1  HIS  44           HD1      HIS  44   0.997   8.481  12.317
  322    HD2  HIS  44           HD2      HIS  44  -1.443   5.364  13.576
  323    HE1  HIS  44           HE1      HIS  44   0.099   9.193  14.555
  324    HE2  HIS  44           HE2      HIS  44  -1.308   7.255  15.335
  325    H    GLY  45           HN       GLY  45  -0.296   3.615  11.823
  326   1HA   GLY  45          HA2       GLY  45   1.238   1.965  13.648
  327   2HA   GLY  45          HA1       GLY  45  -0.039   2.904  14.404
  328    H    GLU  46           HN       GLU  46  -0.290   1.565  11.165
  329    HA   GLU  46           HA       GLU  46  -1.798  -0.733  12.051
  330   1HB   GLU  46          HB2       GLU  46  -3.470   1.084  12.176
  331   2HB   GLU  46          HB1       GLU  46  -3.180   1.451  10.481
  332   1HG   GLU  46          HG2       GLU  46  -3.987  -0.771   9.863
  333   2HG   GLU  46          HG1       GLU  46  -4.281  -1.135  11.564
  334    H    SER  47           HN       SER  47  -2.160  -2.261  10.450
  335    HA   SER  47           HA       SER  47  -0.571  -1.835   8.015
  336   1HB   SER  47          HB2       SER  47  -0.392  -4.286   7.911
  337   2HB   SER  47          HB1       SER  47   0.194  -3.667   9.453
  338    HG   SER  47           HG       SER  47  -2.286  -4.925   8.913
  339    H    GLY  48           HN       GLY  48  -1.313  -3.202   6.114
  340   1HA   GLY  48          HA2       GLY  48  -4.018  -3.958   5.815
  341   2HA   GLY  48          HA1       GLY  48  -3.805  -2.319   5.216
  342    H    PHE  49           HN       PHE  49  -4.625  -4.193   3.439
  343    HA   PHE  49           HA       PHE  49  -2.185  -4.820   1.908
  344   1HB   PHE  49          HB2       PHE  49  -3.286  -6.683   0.927
  345   2HB   PHE  49          HB1       PHE  49  -3.624  -6.769   2.651
  346    HD1  PHE  49           HD1      PHE  49  -5.023  -6.333  -0.668
  347    HD2  PHE  49           HD2      PHE  49  -5.863  -6.224   3.502
  348    HE1  PHE  49           HE1      PHE  49  -7.431  -6.433  -1.155
  349    HE2  PHE  49           HE2      PHE  49  -8.275  -6.323   3.022
  350    HZ   PHE  49           HZ       PHE  49  -9.061  -6.428   0.691
  351    H    PHE  50           HN       PHE  50  -2.332  -4.681  -0.423
  352    HA   PHE  50           HA       PHE  50  -4.401  -3.565  -1.879
  353   1HB   PHE  50          HB2       PHE  50  -3.252  -1.623  -0.211
  354   2HB   PHE  50          HB1       PHE  50  -2.621  -1.293  -1.822
  355    HD1  PHE  50           HD1      PHE  50  -4.646  -1.716  -3.675
  356    HD2  PHE  50           HD2      PHE  50  -5.055  -0.327   0.324
  357    HE1  PHE  50           HE1      PHE  50  -6.756  -0.607  -4.281
  358    HE2  PHE  50           HE2      PHE  50  -7.168   0.783  -0.273
  359    HZ   PHE  50           HZ       PHE  50  -8.028   0.632  -2.576
  360    HA   PRO  51           HA       PRO  51  -1.465  -5.199  -4.876
  361   1HB   PRO  51          HB2       PRO  51  -2.923  -4.153  -7.029
  362   2HB   PRO  51          HB1       PRO  51  -3.083  -5.771  -6.345
  363   1HG   PRO  51          HG2       PRO  51  -4.717  -3.328  -5.846
  364   2HG   PRO  51          HG1       PRO  51  -5.225  -5.026  -5.929
  365   1HD   PRO  51          HD2       PRO  51  -5.010  -3.781  -3.583
  366   2HD   PRO  51          HD1       PRO  51  -4.496  -5.479  -3.757
  367    H    ILE  52           HN       ILE  52  -0.125  -4.407  -6.590
  368    HA   ILE  52           HA       ILE  52   1.108  -1.951  -5.994
  369    HB   ILE  52           HB       ILE  52   1.377  -3.440  -8.601
  370   1HG1  ILE  52          HG12      ILE  52   2.911  -3.919  -6.036
  371   2HG1  ILE  52          HG11      ILE  52   1.622  -4.960  -6.632
  372   1HG2  ILE  52          HG21      ILE  52   2.424  -1.248  -8.559
  373   2HG2  ILE  52          HG22      ILE  52   3.652  -2.514  -8.568
  374   3HG2  ILE  52          HG23      ILE  52   3.274  -1.663  -7.070
  375   1HD1  ILE  52          HD11      ILE  52   4.268  -4.425  -7.957
  376   2HD1  ILE  52          HD12      ILE  52   2.960  -5.365  -8.673
  377   3HD1  ILE  52          HD13      ILE  52   3.740  -5.924  -7.194
  378    H    ASN  53           HN       ASN  53  -1.546  -2.695  -8.108
  379    HA   ASN  53           HA       ASN  53  -1.255  -0.475  -9.847
  380   1HB   ASN  53          HB2       ASN  53  -3.781  -0.938 -10.219
  381   2HB   ASN  53          HB1       ASN  53  -2.606  -2.140 -10.735
  382   1HD2  ASN  53          HD21      ASN  53  -4.965  -1.298  -8.295
  383   2HD2  ASN  53          HD22      ASN  53  -5.201  -2.902  -7.698
  384    H    TYR  54           HN       TYR  54  -1.553  -0.294  -6.686
  385    HA   TYR  54           HA       TYR  54  -3.419   1.983  -6.748
  386   1HB   TYR  54          HB2       TYR  54  -4.252   0.298  -5.259
  387   2HB   TYR  54          HB1       TYR  54  -2.677   0.111  -4.497
  388    HD1  TYR  54           HD1      TYR  54  -5.131   2.862  -5.161
  389    HD2  TYR  54           HD2      TYR  54  -2.452   1.040  -2.405
  390    HE1  TYR  54           HE1      TYR  54  -5.766   4.516  -3.458
  391    HE2  TYR  54           HE2      TYR  54  -3.080   2.689  -0.693
  392    HH   TYR  54           HH       TYR  54  -5.772   4.738  -1.018
  393    H    VAL  55           HN       VAL  55  -0.194   0.940  -6.065
  394    HA   VAL  55           HA       VAL  55   0.544   3.709  -5.427
  395    HB   VAL  55           HB       VAL  55   2.155   2.924  -3.721
  396   1HG1  VAL  55          HG11      VAL  55  -0.757   2.313  -3.260
  397   2HG1  VAL  55          HG12      VAL  55   0.104   3.810  -2.908
  398   3HG1  VAL  55          HG13      VAL  55   0.442   2.358  -1.970
  399   1HG2  VAL  55          HG21      VAL  55   0.754   0.272  -4.073
  400   2HG2  VAL  55          HG22      VAL  55   1.897   0.658  -2.787
  401   3HG2  VAL  55          HG23      VAL  55   2.435   0.632  -4.467
  402    H    GLU  56           HN       GLU  56   3.072   3.757  -5.258
  403    HA   GLU  56           HA       GLU  56   4.264   2.143  -7.398
  404   1HB   GLU  56          HB2       GLU  56   3.642   4.305  -8.375
  405   2HB   GLU  56          HB1       GLU  56   4.524   5.145  -7.106
  406   1HG   GLU  56          HG2       GLU  56   5.790   5.091  -9.177
  407   2HG   GLU  56          HG1       GLU  56   6.612   4.190  -7.904
  408    H    VAL  57           HN       VAL  57   5.626   0.954  -6.192
  409    HA   VAL  57           HA       VAL  57   6.917   1.841  -3.855
  410    HB   VAL  57           HB       VAL  57   7.779  -0.421  -5.661
  411   1HG1  VAL  57          HG11      VAL  57   8.743  -1.361  -3.606
  412   2HG1  VAL  57          HG12      VAL  57   8.271   0.095  -2.729
  413   3HG1  VAL  57          HG13      VAL  57   9.466   0.193  -4.024
  414   1HG2  VAL  57          HG21      VAL  57   6.425  -1.839  -4.123
  415   2HG2  VAL  57          HG22      VAL  57   5.466  -0.736  -5.110
  416   3HG2  VAL  57          HG23      VAL  57   5.770  -0.362  -3.413
  417    H    ILE  58           HN       ILE  58   8.397   3.389  -3.764
  418    HA   ILE  58           HA       ILE  58  10.052   4.051  -6.031
  419    HB   ILE  58           HB       ILE  58  10.141   5.173  -3.227
  420   1HG1  ILE  58          HG12      ILE  58   8.753   6.275  -5.681
  421   2HG1  ILE  58          HG11      ILE  58   7.935   5.437  -4.366
  422   1HG2  ILE  58          HG21      ILE  58  11.282   7.074  -4.271
  423   2HG2  ILE  58          HG22      ILE  58  11.251   6.236  -5.823
  424   3HG2  ILE  58          HG23      ILE  58  12.188   5.576  -4.482
  425   1HD1  ILE  58          HD11      ILE  58   8.644   7.186  -2.816
  426   2HD1  ILE  58          HD12      ILE  58   7.698   7.839  -4.154
  427   3HD1  ILE  58          HD13      ILE  58   9.451   8.026  -4.140
  428    H    VAL  59           HN       VAL  59  10.630   2.867  -2.722
  429    HA   VAL  59           HA       VAL  59  13.382   2.194  -3.473
  430    HB   VAL  59           HB       VAL  59  12.089   2.181  -0.742
  431   1HG1  VAL  59          HG11      VAL  59  14.391   1.998   0.099
  432   2HG1  VAL  59          HG12      VAL  59  14.974   1.854  -1.559
  433   3HG1  VAL  59          HG13      VAL  59  13.931   0.606  -0.880
  434   1HG2  VAL  59          HG21      VAL  59  13.379   4.215  -0.329
  435   2HG2  VAL  59          HG22      VAL  59  12.260   4.434  -1.674
  436   3HG2  VAL  59          HG23      VAL  59  13.977   4.179  -1.987
  437    HA   PRO  60           HA       PRO  60  12.056  -2.051  -4.071
  438   1HB   PRO  60          HB2       PRO  60  14.953  -2.616  -3.784
  439   2HB   PRO  60          HB1       PRO  60  13.853  -3.020  -5.105
  440   1HG   PRO  60          HG2       PRO  60  15.669  -1.087  -5.378
  441   2HG   PRO  60          HG1       PRO  60  14.051  -0.932  -6.086
  442   1HD   PRO  60          HD2       PRO  60  15.158   0.310  -3.598
  443   2HD   PRO  60          HD1       PRO  60  14.098   1.018  -4.835
  Start of MODEL    9
    1   1H    MET   1          HT1       MET   1  19.766  -4.574   6.306
    2   2H    MET   1          HT2       MET   1  19.116  -5.119   4.844
    3   3H    MET   1          HT3       MET   1  18.169  -4.191   5.894
    4    HA   MET   1           HA       MET   1  19.595  -2.290   5.574
    5   1HB   MET   1          HB2       MET   1  21.047  -4.146   3.680
    6   2HB   MET   1          HB1       MET   1  21.306  -2.408   3.754
    7   1HG   MET   1          HG2       MET   1  21.769  -4.334   6.019
    8   2HG   MET   1          HG1       MET   1  23.018  -3.670   4.966
    9   1HE   MET   1          HE1       MET   1  24.374  -2.872   7.043
   10   2HE   MET   1          HE2       MET   1  23.157  -3.439   8.186
   11   3HE   MET   1          HE3       MET   1  23.760  -1.786   8.290
   12    H    ASP   2           HN       ASP   2  17.280  -3.984   4.348
   13    HA   ASP   2           HA       ASP   2  16.939  -2.280   1.968
   14   1HB   ASP   2          HB2       ASP   2  15.553  -4.083   0.997
   15   2HB   ASP   2          HB1       ASP   2  17.209  -4.606   1.294
   16    H    GLN   3           HN       GLN   3  15.196  -1.015   1.917
   17    HA   GLN   3           HA       GLN   3  12.947  -1.609   3.706
   18   1HB   GLN   3          HB2       GLN   3  14.381   1.040   3.476
   19   2HB   GLN   3          HB1       GLN   3  12.817   0.836   4.254
   20   1HG   GLN   3          HG2       GLN   3  15.374  -0.514   5.092
   21   2HG   GLN   3          HG1       GLN   3  14.661   0.903   5.861
   22   1HE2  GLN   3          HE21      GLN   3  11.934  -0.105   5.506
   23   2HE2  GLN   3          HE22      GLN   3  11.732  -1.349   6.687
   24    HA   PRO   4           HA       PRO   4  11.408  -0.733  -0.552
   25   1HB   PRO   4          HB2       PRO   4   9.226  -2.351  -0.319
   26   2HB   PRO   4          HB1       PRO   4  10.816  -2.931  -0.825
   27   1HG   PRO   4          HG2       PRO   4   9.524  -3.056   1.874
   28   2HG   PRO   4          HG1       PRO   4  10.446  -4.305   1.015
   29   1HD   PRO   4          HD2       PRO   4  11.541  -2.814   2.974
   30   2HD   PRO   4          HD1       PRO   4  12.483  -3.363   1.572
   31    H    CYS   5           HN       CYS   5  10.300   1.083  -0.848
   32    HA   CYS   5           HA       CYS   5   7.977   1.625   0.877
   33   1HB   CYS   5          HB2       CYS   5  10.032   3.640  -0.056
   34   2HB   CYS   5          HB1       CYS   5   8.561   4.026   0.832
   35    HG   CYS   5           HG       CYS   5  11.146   2.132   2.042
   36    H    CYS   6           HN       CYS   6   6.413   3.138  -0.082
   37    HA   CYS   6           HA       CYS   6   6.535   3.468  -2.963
   38   1HB   CYS   6          HB2       CYS   6   4.515   2.280  -3.446
   39   2HB   CYS   6          HB1       CYS   6   5.578   1.194  -2.571
   40    HG   CYS   6           HG       CYS   6   4.201   1.819  -0.077
   41    H    ARG   7           HN       ARG   7   4.379   4.480  -3.728
   42    HA   ARG   7           HA       ARG   7   3.232   6.245  -1.694
   43   1HB   ARG   7          HB2       ARG   7   3.538   8.221  -3.179
   44   2HB   ARG   7          HB1       ARG   7   5.045   7.574  -2.545
   45   1HG   ARG   7          HG2       ARG   7   5.458   6.446  -4.673
   46   2HG   ARG   7          HG1       ARG   7   3.947   7.100  -5.310
   47   1HD   ARG   7          HD2       ARG   7   4.795   9.368  -5.008
   48   2HD   ARG   7          HD1       ARG   7   6.296   8.727  -4.341
   49    HE   ARG   7           HE       ARG   7   5.757   7.697  -6.945
   50   1HH1  ARG   7          HH11      ARG   7   6.993  10.465  -5.228
   51   2HH1  ARG   7          HH12      ARG   7   7.993  10.994  -6.539
   52   1HH2  ARG   7          HH21      ARG   7   7.071   8.385  -8.676
   53   2HH2  ARG   7          HH22      ARG   7   8.035   9.813  -8.500
   54    H    GLY   8           HN       GLY   8   1.102   6.435  -1.917
   55   1HA   GLY   8          HA2       GLY   8  -0.369   5.001  -3.792
   56   2HA   GLY   8          HA1       GLY   8  -1.009   6.302  -2.806
   57    H    LEU   9           HN       LEU   9  -1.472   5.475  -5.618
   58    HA   LEU   9           HA       LEU   9  -0.542   7.825  -7.081
   59   1HB   LEU   9          HB2       LEU   9  -1.608   5.171  -7.887
   60   2HB   LEU   9          HB1       LEU   9  -1.598   6.519  -9.017
   61    HG   LEU   9           HG       LEU   9   0.921   5.984  -7.569
   62   1HD1  LEU   9          HD11      LEU   9   1.526   4.258  -9.234
   63   2HD1  LEU   9          HD12      LEU   9  -0.173   4.190  -9.702
   64   3HD1  LEU   9          HD13      LEU   9   0.309   3.758  -8.060
   65   1HD2  LEU   9          HD21      LEU   9   0.279   6.656 -10.435
   66   2HD2  LEU   9          HD22      LEU   9   1.877   6.660  -9.685
   67   3HD2  LEU   9          HD23      LEU   9   0.652   7.820  -9.162
   68    H    TYR  10           HN       TYR  10  -3.453   6.126  -6.126
   69    HA   TYR  10           HA       TYR  10  -5.020   8.548  -6.668
   70   1HB   TYR  10          HB2       TYR  10  -5.986   5.756  -7.298
   71   2HB   TYR  10          HB1       TYR  10  -6.839   7.268  -7.591
   72    HD1  TYR  10           HD1      TYR  10  -4.596   4.848  -8.947
   73    HD2  TYR  10           HD2      TYR  10  -5.786   8.921  -9.241
   74    HE1  TYR  10           HE1      TYR  10  -3.603   4.970 -11.194
   75    HE2  TYR  10           HE2      TYR  10  -4.797   9.055 -11.489
   76    HH   TYR  10           HH       TYR  10  -3.062   7.895 -12.807
   77    H    ASP  11           HN       ASP  11  -6.769   8.895  -5.276
   78    HA   ASP  11           HA       ASP  11  -6.434   7.955  -2.651
   79   1HB   ASP  11          HB2       ASP  11  -8.738   9.042  -2.320
   80   2HB   ASP  11          HB1       ASP  11  -7.398  10.059  -2.823
   81    H    PHE  12           HN       PHE  12  -8.041   6.939  -1.327
   82    HA   PHE  12           HA       PHE  12 -10.059   5.270  -2.454
   83   1HB   PHE  12          HB2       PHE  12  -7.395   4.207  -2.244
   84   2HB   PHE  12          HB1       PHE  12  -8.487   3.344  -1.168
   85    HD1  PHE  12           HD1      PHE  12  -7.278   3.621  -4.475
   86    HD2  PHE  12           HD2      PHE  12 -10.710   2.523  -2.212
   87    HE1  PHE  12           HE1      PHE  12  -8.112   2.312  -6.384
   88    HE2  PHE  12           HE2      PHE  12 -11.551   1.210  -4.116
   89    HZ   PHE  12           HZ       PHE  12 -10.252   1.103  -6.206
   90    H    GLU  13           HN       GLU  13 -11.598   5.231  -0.970
   91    HA   GLU  13           HA       GLU  13 -10.921   5.717   1.825
   92   1HB   GLU  13          HB2       GLU  13 -12.756   6.981   0.643
   93   2HB   GLU  13          HB1       GLU  13 -13.660   5.476   0.570
   94   1HG   GLU  13          HG2       GLU  13 -14.500   6.679   2.411
   95   2HG   GLU  13          HG1       GLU  13 -13.505   5.385   3.075
   96    HA   PRO  14           HA       PRO  14 -10.889   1.348   2.804
   97   1HB   PRO  14          HB2       PRO  14 -11.995   2.392   5.374
   98   2HB   PRO  14          HB1       PRO  14 -10.670   1.255   5.099
   99   1HG   PRO  14          HG2       PRO  14 -10.214   3.812   5.755
  100   2HG   PRO  14          HG1       PRO  14  -9.151   2.923   4.651
  101   1HD   PRO  14          HD2       PRO  14 -11.104   5.069   4.070
  102   2HD   PRO  14          HD1       PRO  14  -9.644   4.597   3.179
  103    H    GLU  15           HN       GLU  15 -12.380  -0.201   2.518
  104    HA   GLU  15           HA       GLU  15 -15.188   0.392   3.153
  105   1HB   GLU  15          HB2       GLU  15 -14.173  -0.866   0.597
  106   2HB   GLU  15          HB1       GLU  15 -15.867  -0.763   1.061
  107   1HG   GLU  15          HG2       GLU  15 -15.700   1.688   1.048
  108   2HG   GLU  15          HG1       GLU  15 -14.023   1.553   0.524
  109    H    ASN  16           HN       ASN  16 -12.718  -2.040   2.510
  110    HA   ASN  16           HA       ASN  16 -14.368  -4.026   3.929
  111   1HB   ASN  16          HB2       ASN  16 -13.697  -4.535   1.548
  112   2HB   ASN  16          HB1       ASN  16 -12.027  -4.590   2.101
  113   1HD2  ASN  16          HD21      ASN  16 -13.710  -6.669   0.921
  114   2HD2  ASN  16          HD22      ASN  16 -13.712  -7.974   2.052
  115    H    GLN  17           HN       GLN  17 -13.643  -4.896   5.777
  116    HA   GLN  17           HA       GLN  17 -11.580  -3.710   7.238
  117   1HB   GLN  17          HB2       GLN  17 -12.816  -6.443   7.621
  118   2HB   GLN  17          HB1       GLN  17 -11.868  -5.575   8.821
  119   1HG   GLN  17          HG2       GLN  17 -13.551  -3.813   8.885
  120   2HG   GLN  17          HG1       GLN  17 -14.498  -4.667   7.669
  121   1HE2  GLN  17          HE21      GLN  17 -16.268  -4.851   9.032
  122   2HE2  GLN  17          HE22      GLN  17 -16.293  -5.943  10.371
  123    H    GLY  18           HN       GLY  18  -9.444  -3.975   7.263
  124   1HA   GLY  18          HA2       GLY  18  -7.517  -5.438   7.320
  125   2HA   GLY  18          HA1       GLY  18  -8.321  -6.460   6.138
  126    H    GLU  19           HN       GLU  19  -9.188  -4.062   4.595
  127    HA   GLU  19           HA       GLU  19  -6.862  -3.883   2.920
  128   1HB   GLU  19          HB2       GLU  19  -9.347  -3.933   2.206
  129   2HB   GLU  19          HB1       GLU  19  -9.346  -2.220   2.605
  130   1HG   GLU  19          HG2       GLU  19  -7.628  -1.795   0.970
  131   2HG   GLU  19          HG1       GLU  19  -7.495  -3.517   0.621
  132    H    LEU  20           HN       LEU  20  -6.103  -1.721   2.104
  133    HA   LEU  20           HA       LEU  20  -5.835   0.117   4.391
  134   1HB   LEU  20          HB2       LEU  20  -3.762  -0.963   3.561
  135   2HB   LEU  20          HB1       LEU  20  -4.017  -0.200   2.004
  136    HG   LEU  20           HG       LEU  20  -3.765   2.013   3.040
  137   1HD1  LEU  20          HD11      LEU  20  -2.952   2.180   5.356
  138   2HD1  LEU  20          HD12      LEU  20  -3.220   0.448   5.560
  139   3HD1  LEU  20          HD13      LEU  20  -4.586   1.524   5.265
  140   1HD2  LEU  20          HD21      LEU  20  -1.510   0.111   3.661
  141   2HD2  LEU  20          HD22      LEU  20  -1.372   1.863   3.517
  142   3HD2  LEU  20          HD23      LEU  20  -1.810   0.895   2.110
  143    H    GLY  21           HN       GLY  21  -6.430   2.208   4.229
  144   1HA   GLY  21          HA2       GLY  21  -7.295   3.170   1.570
  145   2HA   GLY  21          HA1       GLY  21  -8.228   3.470   3.021
  146    H    PHE  22           HN       PHE  22  -6.576   5.095   0.930
  147    HA   PHE  22           HA       PHE  22  -5.880   7.214   2.701
  148   1HB   PHE  22          HB2       PHE  22  -3.775   5.343   1.877
  149   2HB   PHE  22          HB1       PHE  22  -3.404   7.023   1.507
  150    HD1  PHE  22           HD1      PHE  22  -3.781   8.710   3.475
  151    HD2  PHE  22           HD2      PHE  22  -3.275   4.513   3.961
  152    HE1  PHE  22           HE1      PHE  22  -3.092   9.067   5.810
  153    HE2  PHE  22           HE2      PHE  22  -2.585   4.862   6.297
  154    HZ   PHE  22           HZ       PHE  22  -2.497   7.154   7.224
  155    H    LYS  23           HN       LYS  23  -4.317   8.809   1.206
  156    HA   LYS  23           HA       LYS  23  -5.685   8.915  -1.387
  157   1HB   LYS  23          HB2       LYS  23  -5.340  11.429  -1.228
  158   2HB   LYS  23          HB1       LYS  23  -6.609  10.713  -0.239
  159   1HG   LYS  23          HG2       LYS  23  -3.886  11.090   0.896
  160   2HG   LYS  23          HG1       LYS  23  -4.991  12.464   0.787
  161   1HD   LYS  23          HD2       LYS  23  -6.588  11.403   2.173
  162   2HD   LYS  23          HD1       LYS  23  -5.771   9.845   2.037
  163   1HE   LYS  23          HE2       LYS  23  -5.328  10.811   4.210
  164   2HE   LYS  23          HE1       LYS  23  -3.844  10.786   3.258
  165   1HZ   LYS  23          HZ1       LYS  23  -5.600  13.136   3.715
  166   2HZ   LYS  23          HZ2       LYS  23  -4.238  13.132   2.713
  167   3HZ   LYS  23          HZ3       LYS  23  -4.063  12.886   4.378
  168    H    GLU  24           HN       GLU  24  -4.563  10.282  -3.009
  169    HA   GLU  24           HA       GLU  24  -2.115   9.258  -3.714
  170   1HB   GLU  24          HB2       GLU  24  -1.949  11.220  -5.245
  171   2HB   GLU  24          HB1       GLU  24  -3.507  10.404  -5.307
  172   1HG   GLU  24          HG2       GLU  24  -4.365  12.450  -5.096
  173   2HG   GLU  24          HG1       GLU  24  -3.950  12.267  -3.388
  174    H    GLY  25           HN       GLY  25   0.000  10.012  -3.656
  175   1HA   GLY  25          HA2       GLY  25   1.816  11.257  -2.930
  176   2HA   GLY  25          HA1       GLY  25   0.704  12.377  -2.162
  177    H    ASP  26           HN       ASP  26  -0.316   9.516  -1.048
  178    HA   ASP  26           HA       ASP  26   0.949   9.901   1.496
  179   1HB   ASP  26          HB2       ASP  26  -0.541   8.276   2.329
  180   2HB   ASP  26          HB1       ASP  26  -1.452   9.113   1.078
  181    H    ILE  27           HN       ILE  27   2.636   8.854   2.358
  182    HA   ILE  27           HA       ILE  27   4.025   6.898   0.691
  183    HB   ILE  27           HB       ILE  27   4.984   8.128   3.277
  184   1HG1  ILE  27          HG12      ILE  27   5.591   9.037   0.455
  185   2HG1  ILE  27          HG11      ILE  27   4.462   9.847   1.536
  186   1HG2  ILE  27          HG21      ILE  27   6.134   6.086   2.619
  187   2HG2  ILE  27          HG22      ILE  27   7.198   7.483   2.456
  188   3HG2  ILE  27          HG23      ILE  27   6.457   6.768   1.025
  189   1HD1  ILE  27          HD11      ILE  27   6.306  10.264   3.106
  190   2HD1  ILE  27          HD12      ILE  27   6.575  10.998   1.525
  191   3HD1  ILE  27          HD13      ILE  27   7.421   9.513   1.964
  192    H    ILE  28           HN       ILE  28   4.197   4.780   1.199
  193    HA   ILE  28           HA       ILE  28   3.218   3.915   3.840
  194    HB   ILE  28           HB       ILE  28   2.683   2.485   1.234
  195   1HG1  ILE  28          HG12      ILE  28   0.704   3.947   2.992
  196   2HG1  ILE  28          HG11      ILE  28   1.433   4.656   1.554
  197   1HG2  ILE  28          HG21      ILE  28   2.879   0.979   3.134
  198   2HG2  ILE  28          HG22      ILE  28   1.204   1.074   2.591
  199   3HG2  ILE  28          HG23      ILE  28   1.713   1.944   4.039
  200   1HD1  ILE  28          HD11      ILE  28  -0.822   3.755   1.163
  201   2HD1  ILE  28          HD12      ILE  28  -0.226   2.148   1.575
  202   3HD1  ILE  28          HD13      ILE  28   0.409   2.986   0.161
  203    H    THR  29           HN       THR  29   4.344   2.318   4.847
  204    HA   THR  29           HA       THR  29   6.845   1.483   3.572
  205    HB   THR  29           HB       THR  29   7.642   0.878   5.738
  206    HG1  THR  29           HG1      THR  29   5.981  -0.107   6.760
  207   1HG2  THR  29          HG21      THR  29   7.390   2.951   7.015
  208   2HG2  THR  29          HG22      THR  29   6.009   3.404   6.017
  209   3HG2  THR  29          HG23      THR  29   7.616   3.291   5.300
  210    H    LEU  30           HN       LEU  30   7.103  -0.515   2.778
  211    HA   LEU  30           HA       LEU  30   4.951  -2.445   3.215
  212   1HB   LEU  30          HB2       LEU  30   7.154  -2.279   1.177
  213   2HB   LEU  30          HB1       LEU  30   6.128  -3.687   1.353
  214    HG   LEU  30           HG       LEU  30   5.160  -0.910   0.669
  215   1HD1  LEU  30          HD11      LEU  30   4.744  -1.829  -1.557
  216   2HD1  LEU  30          HD12      LEU  30   5.480  -3.356  -1.065
  217   3HD1  LEU  30          HD13      LEU  30   6.458  -1.890  -1.142
  218   1HD2  LEU  30          HD21      LEU  30   3.698  -3.547   0.773
  219   2HD2  LEU  30          HD22      LEU  30   3.027  -2.020   0.199
  220   3HD2  LEU  30          HD23      LEU  30   3.492  -2.197   1.890
  221    H    THR  31           HN       THR  31   5.253  -4.494   3.953
  222    HA   THR  31           HA       THR  31   7.799  -5.615   4.476
  223    HB   THR  31           HB       THR  31   7.682  -3.938   6.293
  224    HG1  THR  31           HG1      THR  31   8.463  -5.368   7.794
  225   1HG2  THR  31          HG21      THR  31   6.133  -4.287   8.156
  226   2HG2  THR  31          HG22      THR  31   5.367  -5.612   7.278
  227   3HG2  THR  31          HG23      THR  31   5.259  -3.964   6.659
  228    H    ASN  32           HN       ASN  32   4.869  -6.020   3.547
  229    HA   ASN  32           HA       ASN  32   4.672  -8.774   4.439
  230   1HB   ASN  32          HB2       ASN  32   2.534  -6.677   4.802
  231   2HB   ASN  32          HB1       ASN  32   2.195  -8.401   4.820
  232   1HD2  ASN  32          HD21      ASN  32   1.934  -6.313   6.899
  233   2HD2  ASN  32          HD22      ASN  32   2.822  -6.908   8.256
  234    H    GLN  33           HN       GLN  33   2.898  -9.881   3.059
  235    HA   GLN  33           HA       GLN  33   1.952  -8.588   0.731
  236   1HB   GLN  33          HB2       GLN  33   4.681  -9.553   0.647
  237   2HB   GLN  33          HB1       GLN  33   3.680 -10.298  -0.598
  238   1HG   GLN  33          HG2       GLN  33   3.064  -8.216  -1.481
  239   2HG   GLN  33          HG1       GLN  33   3.750  -7.341  -0.101
  240   1HE2  GLN  33          HE21      GLN  33   5.330 -10.050  -1.656
  241   2HE2  GLN  33          HE22      GLN  33   6.626  -9.147  -2.357
  242    H    ILE  34           HN       ILE  34   0.725  -9.865  -0.615
  243    HA   ILE  34           HA       ILE  34   0.116 -12.509   0.463
  244    HB   ILE  34           HB       ILE  34  -1.556 -10.686  -1.272
  245   1HG1  ILE  34          HG12      ILE  34  -3.098 -10.961   0.800
  246   2HG1  ILE  34          HG11      ILE  34  -1.636 -11.489   1.625
  247   1HG2  ILE  34          HG21      ILE  34  -3.343 -12.377  -0.997
  248   2HG2  ILE  34          HG22      ILE  34  -2.164 -13.460  -0.256
  249   3HG2  ILE  34          HG23      ILE  34  -1.972 -12.966  -1.937
  250   1HD1  ILE  34          HD11      ILE  34  -0.578  -9.379   1.201
  251   2HD1  ILE  34          HD12      ILE  34  -2.152  -9.102   1.948
  252   3HD1  ILE  34          HD13      ILE  34  -1.943  -8.851   0.215
  253    H    ASP  35           HN       ASP  35   0.937 -10.780  -2.446
  254    HA   ASP  35           HA       ASP  35   2.097 -13.076  -3.656
  255   1HB   ASP  35          HB2       ASP  35  -0.325 -13.518  -4.070
  256   2HB   ASP  35          HB1       ASP  35  -0.410 -12.011  -4.975
  257    H    GLU  36           HN       GLU  36   2.596 -12.480  -6.103
  258    HA   GLU  36           HA       GLU  36   4.177 -10.164  -6.050
  259   1HB   GLU  36          HB2       GLU  36   4.566 -10.597  -8.436
  260   2HB   GLU  36          HB1       GLU  36   4.714 -12.063  -7.477
  261   1HG   GLU  36          HG2       GLU  36   2.498 -12.767  -8.172
  262   2HG   GLU  36          HG1       GLU  36   2.298 -11.275  -9.091
  263    H    ASN  37           HN       ASN  37   0.874 -10.387  -6.326
  264    HA   ASN  37           HA       ASN  37   0.674  -7.976  -7.993
  265   1HB   ASN  37          HB2       ASN  37  -0.674 -10.051  -8.580
  266   2HB   ASN  37          HB1       ASN  37  -1.610  -9.746  -7.120
  267   1HD2  ASN  37          HD21      ASN  37  -2.913  -7.899  -7.011
  268   2HD2  ASN  37          HD22      ASN  37  -3.409  -7.057  -8.434
  269    H    TRP  38           HN       TRP  38  -0.933  -9.359  -5.107
  270    HA   TRP  38           HA       TRP  38  -1.511  -6.658  -4.173
  271   1HB   TRP  38          HB2       TRP  38  -2.286  -9.087  -2.615
  272   2HB   TRP  38          HB1       TRP  38  -3.128  -7.547  -2.787
  273    HD1  TRP  38           HD1      TRP  38  -4.515  -7.185  -5.117
  274    HE1  TRP  38           HE1      TRP  38  -5.672  -8.906  -6.639
  275    HE3  TRP  38           HE3      TRP  38  -2.165 -11.421  -3.484
  276    HZ2  TRP  38           HZ2      TRP  38  -5.602 -11.692  -7.086
  277    HZ3  TRP  38           HZ3      TRP  38  -2.770 -13.574  -4.509
  278    HH2  TRP  38           HH2      TRP  38  -4.454 -13.705  -6.273
  279    H    TYR  39           HN       TYR  39  -0.377  -5.629  -2.640
  280    HA   TYR  39           HA       TYR  39   1.637  -7.203  -1.150
  281   1HB   TYR  39          HB2       TYR  39   1.649  -4.279  -1.939
  282   2HB   TYR  39          HB1       TYR  39   2.857  -5.032  -0.910
  283    HD1  TYR  39           HD1      TYR  39   2.129  -7.506  -3.216
  284    HD2  TYR  39           HD2      TYR  39   4.035  -3.708  -2.989
  285    HE1  TYR  39           HE1      TYR  39   3.466  -8.065  -5.197
  286    HE2  TYR  39           HE2      TYR  39   5.378  -4.260  -4.971
  287    HH   TYR  39           HH       TYR  39   4.697  -6.940  -6.966
  288    H    GLU  40           HN       GLU  40   2.283  -6.082   0.978
  289    HA   GLU  40           HA       GLU  40  -0.003  -4.823   2.277
  290   1HB   GLU  40          HB2       GLU  40   0.945  -7.544   2.797
  291   2HB   GLU  40          HB1       GLU  40   0.812  -6.550   4.240
  292   1HG   GLU  40          HG2       GLU  40  -1.529  -6.013   3.540
  293   2HG   GLU  40          HG1       GLU  40  -1.356  -7.233   2.281
  294    H    GLY  41           HN       GLY  41   0.471  -3.601   4.091
  295   1HA   GLY  41          HA2       GLY  41   3.022  -3.553   5.337
  296   2HA   GLY  41          HA1       GLY  41   2.904  -2.265   4.144
  297    H    MET  42           HN       MET  42   3.248  -0.992   6.211
  298    HA   MET  42           HA       MET  42   0.624  -0.166   7.203
  299   1HB   MET  42          HB2       MET  42   1.276  -0.191   9.508
  300   2HB   MET  42          HB1       MET  42   1.576  -1.791   8.843
  301   1HG   MET  42          HG2       MET  42   3.948  -1.265   8.625
  302   2HG   MET  42          HG1       MET  42   3.653   0.343   9.283
  303   1HE   MET  42          HE1       MET  42   5.583  -1.432  12.192
  304   2HE   MET  42          HE2       MET  42   5.501   0.005  11.172
  305   3HE   MET  42          HE3       MET  42   5.855  -1.568  10.455
  306    H    ILE  43           HN       ILE  43   0.650   1.894   8.274
  307    HA   ILE  43           HA       ILE  43   2.966   3.580   8.089
  308    HB   ILE  43           HB       ILE  43   2.298   3.700   5.769
  309   1HG1  ILE  43          HG12      ILE  43   1.729   6.162   5.621
  310   2HG1  ILE  43          HG11      ILE  43   1.575   6.158   7.375
  311   1HG2  ILE  43          HG21      ILE  43   0.083   4.515   5.104
  312   2HG2  ILE  43          HG22      ILE  43  -0.418   4.509   6.795
  313   3HG2  ILE  43          HG23      ILE  43  -0.010   2.993   5.990
  314   1HD1  ILE  43          HD11      ILE  43   3.778   6.975   6.485
  315   2HD1  ILE  43          HD12      ILE  43   4.089   5.325   5.940
  316   3HD1  ILE  43          HD13      ILE  43   3.887   5.663   7.659
  317    H    HIS  44           HN       HIS  44   2.774   5.439   9.302
  318    HA   HIS  44           HA       HIS  44   1.987   6.842  10.900
  319   1HB   HIS  44          HB2       HIS  44   0.241   7.369   9.219
  320   2HB   HIS  44          HB1       HIS  44  -0.758   6.079   9.880
  321    HD1  HIS  44           HD1      HIS  44  -1.825   6.492  12.223
  322    HD2  HIS  44           HD2      HIS  44   0.255   9.737  10.673
  323    HE1  HIS  44           HE1      HIS  44  -2.500   8.459  13.636
  324    HE2  HIS  44           HE2      HIS  44  -1.294  10.426  12.627
  325    H    GLY  45           HN       GLY  45  -0.753   4.581  10.982
  326   1HA   GLY  45          HA2       GLY  45   0.282   3.235  13.322
  327   2HA   GLY  45          HA1       GLY  45  -1.055   4.324  13.657
  328    H    GLU  46           HN       GLU  46  -0.770   2.477  10.675
  329    HA   GLU  46           HA       GLU  46  -2.472   0.348  11.563
  330   1HB   GLU  46          HB2       GLU  46  -4.409   0.872  10.180
  331   2HB   GLU  46          HB1       GLU  46  -4.131   2.149  11.354
  332   1HG   GLU  46          HG2       GLU  46  -3.045   3.495   9.612
  333   2HG   GLU  46          HG1       GLU  46  -3.382   2.222   8.440
  334    H    SER  47           HN       SER  47  -2.702  -1.309  10.073
  335    HA   SER  47           HA       SER  47  -1.007  -1.055   7.675
  336   1HB   SER  47          HB2       SER  47  -0.530  -3.452   7.895
  337   2HB   SER  47          HB1       SER  47  -0.082  -2.594   9.367
  338    HG   SER  47           HG       SER  47  -1.918  -4.565   9.003
  339    H    GLY  48           HN       GLY  48  -1.595  -2.746   5.964
  340   1HA   GLY  48          HA2       GLY  48  -4.184  -3.827   5.792
  341   2HA   GLY  48          HA1       GLY  48  -4.198  -2.238   5.040
  342    H    PHE  49           HN       PHE  49  -4.831  -4.260   3.425
  343    HA   PHE  49           HA       PHE  49  -2.361  -4.870   1.942
  344   1HB   PHE  49          HB2       PHE  49  -3.503  -6.761   0.962
  345   2HB   PHE  49          HB1       PHE  49  -3.666  -6.841   2.711
  346    HD1  PHE  49           HD1      PHE  49  -5.422  -6.218  -0.451
  347    HD2  PHE  49           HD2      PHE  49  -5.805  -6.635   3.767
  348    HE1  PHE  49           HE1      PHE  49  -7.862  -6.422  -0.697
  349    HE2  PHE  49           HE2      PHE  49  -8.246  -6.840   3.529
  350    HZ   PHE  49           HZ       PHE  49  -9.276  -6.734   1.294
  351    H    PHE  50           HN       PHE  50  -2.399  -4.767  -0.363
  352    HA   PHE  50           HA       PHE  50  -4.439  -3.864  -1.980
  353   1HB   PHE  50          HB2       PHE  50  -3.590  -1.779  -0.298
  354   2HB   PHE  50          HB1       PHE  50  -2.892  -1.432  -1.877
  355    HD1  PHE  50           HD1      PHE  50  -4.745  -2.080  -3.840
  356    HD2  PHE  50           HD2      PHE  50  -5.539  -0.658   0.090
  357    HE1  PHE  50           HE1      PHE  50  -6.909  -1.193  -4.603
  358    HE2  PHE  50           HE2      PHE  50  -7.705   0.230  -0.665
  359    HZ   PHE  50           HZ       PHE  50  -8.393  -0.036  -3.014
  360    HA   PRO  51           HA       PRO  51  -1.086  -5.155  -4.695
  361   1HB   PRO  51          HB2       PRO  51  -2.486  -4.610  -7.020
  362   2HB   PRO  51          HB1       PRO  51  -2.568  -6.128  -6.121
  363   1HG   PRO  51          HG2       PRO  51  -4.419  -3.777  -6.045
  364   2HG   PRO  51          HG1       PRO  51  -4.805  -5.510  -6.047
  365   1HD   PRO  51          HD2       PRO  51  -4.906  -4.105  -3.788
  366   2HD   PRO  51          HD1       PRO  51  -4.251  -5.763  -3.792
  367    H    ILE  52           HN       ILE  52   0.054  -4.243  -6.588
  368    HA   ILE  52           HA       ILE  52   0.986  -1.658  -6.086
  369    HB   ILE  52           HB       ILE  52   1.158  -3.091  -8.739
  370   1HG1  ILE  52          HG12      ILE  52   3.045  -3.307  -6.383
  371   2HG1  ILE  52          HG11      ILE  52   1.848  -4.526  -6.808
  372   1HG2  ILE  52          HG21      ILE  52   1.878  -0.779  -8.827
  373   2HG2  ILE  52          HG22      ILE  52   3.274  -1.848  -8.958
  374   3HG2  ILE  52          HG23      ILE  52   2.930  -1.027  -7.434
  375   1HD1  ILE  52          HD11      ILE  52   2.961  -4.850  -8.963
  376   2HD1  ILE  52          HD12      ILE  52   4.042  -5.156  -7.605
  377   3HD1  ILE  52          HD13      ILE  52   4.169  -3.648  -8.511
  378    H    ASN  53           HN       ASN  53  -1.804  -2.694  -7.781
  379    HA   ASN  53           HA       ASN  53  -2.098  -0.571  -9.612
  380   1HB   ASN  53          HB2       ASN  53  -4.116  -2.413  -8.327
  381   2HB   ASN  53          HB1       ASN  53  -4.502  -1.286  -9.619
  382   1HD2  ASN  53          HD21      ASN  53  -5.106  -2.942 -11.005
  383   2HD2  ASN  53          HD22      ASN  53  -3.947  -3.985 -11.750
  384    H    TYR  54           HN       TYR  54  -1.795  -0.198  -6.442
  385    HA   TYR  54           HA       TYR  54  -3.734   2.016  -6.337
  386   1HB   TYR  54          HB2       TYR  54  -4.527   0.379  -4.804
  387   2HB   TYR  54          HB1       TYR  54  -2.914   0.089  -4.167
  388    HD1  TYR  54           HD1      TYR  54  -5.186   3.032  -4.608
  389    HD2  TYR  54           HD2      TYR  54  -2.555   0.892  -2.041
  390    HE1  TYR  54           HE1      TYR  54  -5.610   4.666  -2.821
  391    HE2  TYR  54           HE2      TYR  54  -2.973   2.520  -0.247
  392    HH   TYR  54           HH       TYR  54  -3.731   4.800   0.032
  393    H    VAL  55           HN       VAL  55  -0.474   0.956  -5.867
  394    HA   VAL  55           HA       VAL  55   0.287   3.720  -5.211
  395    HB   VAL  55           HB       VAL  55   2.004   2.915  -3.639
  396   1HG1  VAL  55          HG11      VAL  55  -0.881   2.330  -3.101
  397   2HG1  VAL  55          HG12      VAL  55   0.123   3.651  -2.503
  398   3HG1  VAL  55          HG13      VAL  55   0.337   2.022  -1.866
  399   1HG2  VAL  55          HG21      VAL  55   1.885   0.593  -2.801
  400   2HG2  VAL  55          HG22      VAL  55   2.349   0.683  -4.500
  401   3HG2  VAL  55          HG23      VAL  55   0.705   0.225  -4.058
  402    H    GLU  56           HN       GLU  56   2.787   3.860  -5.275
  403    HA   GLU  56           HA       GLU  56   3.793   2.371  -7.604
  404   1HB   GLU  56          HB2       GLU  56   3.192   4.707  -8.200
  405   2HB   GLU  56          HB1       GLU  56   4.313   5.285  -6.974
  406   1HG   GLU  56          HG2       GLU  56   5.340   5.432  -9.137
  407   2HG   GLU  56          HG1       GLU  56   6.158   4.195  -8.184
  408    H    VAL  57           HN       VAL  57   5.063   0.948  -6.510
  409    HA   VAL  57           HA       VAL  57   6.586   1.511  -4.231
  410    HB   VAL  57           HB       VAL  57   7.127  -0.614  -6.310
  411   1HG1  VAL  57          HG11      VAL  57   7.954  -0.410  -3.416
  412   2HG1  VAL  57          HG12      VAL  57   9.014  -0.291  -4.821
  413   3HG1  VAL  57          HG13      VAL  57   8.205  -1.815  -4.453
  414   1HG2  VAL  57          HG21      VAL  57   5.816  -2.087  -4.824
  415   2HG2  VAL  57          HG22      VAL  57   4.850  -0.784  -5.517
  416   3HG2  VAL  57          HG23      VAL  57   5.394  -0.683  -3.843
  417    H    ILE  58           HN       ILE  58   8.110   3.027  -4.142
  418    HA   ILE  58           HA       ILE  58   9.653   3.865  -6.382
  419    HB   ILE  58           HB       ILE  58  10.131   4.392  -3.445
  420   1HG1  ILE  58          HG12      ILE  58   7.922   5.163  -4.170
  421   2HG1  ILE  58          HG11      ILE  58   8.984   6.530  -3.851
  422   1HG2  ILE  58          HG21      ILE  58  12.124   4.809  -4.756
  423   2HG2  ILE  58          HG22      ILE  58  11.417   6.338  -4.233
  424   3HG2  ILE  58          HG23      ILE  58  11.200   5.789  -5.894
  425   1HD1  ILE  58          HD11      ILE  58   7.638   6.879  -5.847
  426   2HD1  ILE  58          HD12      ILE  58   8.316   5.420  -6.569
  427   3HD1  ILE  58          HD13      ILE  58   9.355   6.807  -6.240
  428    H    VAL  59           HN       VAL  59  10.195   1.668  -3.695
  429    HA   VAL  59           HA       VAL  59  12.694   0.802  -4.987
  430    HB   VAL  59           HB       VAL  59  12.257   0.995  -2.003
  431   1HG1  VAL  59          HG11      VAL  59  14.651   0.411  -1.869
  432   2HG1  VAL  59          HG12      VAL  59  14.664   0.156  -3.614
  433   3HG1  VAL  59          HG13      VAL  59  13.676  -0.875  -2.579
  434   1HG2  VAL  59          HG21      VAL  59  12.538   3.201  -2.964
  435   2HG2  VAL  59          HG22      VAL  59  13.974   2.666  -3.837
  436   3HG2  VAL  59          HG23      VAL  59  13.991   2.745  -2.075
  437    HA   PRO  60           HA       PRO  60   9.987  -2.889  -4.752
  438   1HB   PRO  60          HB2       PRO  60  12.009  -3.932  -6.633
  439   2HB   PRO  60          HB1       PRO  60  10.254  -3.847  -6.803
  440   1HG   PRO  60          HG2       PRO  60  11.868  -2.232  -8.201
  441   2HG   PRO  60          HG1       PRO  60  10.301  -1.672  -7.587
  442   1HD   PRO  60          HD2       PRO  60  13.049  -1.173  -6.506
  443   2HD   PRO  60          HD1       PRO  60  11.675  -0.056  -6.651
  Start of MODEL   10
    1   1H    MET   1          HT1       MET   1  19.961  -4.302   6.182
    2   2H    MET   1          HT2       MET   1  19.780  -3.049   5.060
    3   3H    MET   1          HT3       MET   1  18.573  -4.224   5.218
    4    HA   MET   1           HA       MET   1  18.049  -3.488   7.420
    5   1HB   MET   1          HB2       MET   1  20.369  -2.784   7.978
    6   2HB   MET   1          HB1       MET   1  20.159  -1.369   6.954
    7   1HG   MET   1          HG2       MET   1  18.416  -0.533   8.392
    8   2HG   MET   1          HG1       MET   1  18.484  -1.995   9.374
    9   1HE   MET   1          HE1       MET   1  20.511  -2.624  10.965
   10   2HE   MET   1          HE2       MET   1  22.009  -1.698  11.042
   11   3HE   MET   1          HE3       MET   1  21.581  -2.561   9.565
   12    H    ASP   2           HN       ASP   2  18.597  -2.000   4.379
   13    HA   ASP   2           HA       ASP   2  16.796   0.201   4.735
   14   1HB   ASP   2          HB2       ASP   2  18.592   0.356   3.098
   15   2HB   ASP   2          HB1       ASP   2  17.957  -1.039   2.231
   16    H    GLN   3           HN       GLN   3  14.646   0.185   4.595
   17    HA   GLN   3           HA       GLN   3  13.342  -2.236   3.569
   18   1HB   GLN   3          HB2       GLN   3  12.187  -0.053   5.311
   19   2HB   GLN   3          HB1       GLN   3  11.397  -1.561   4.872
   20   1HG   GLN   3          HG2       GLN   3  13.197  -2.787   6.059
   21   2HG   GLN   3          HG1       GLN   3  13.844  -1.236   6.591
   22   1HE2  GLN   3          HE21      GLN   3  11.257  -3.527   6.908
   23   2HE2  GLN   3          HE22      GLN   3  10.566  -2.858   8.343
   24    HA   PRO   4           HA       PRO   4  11.963   0.127   0.060
   25   1HB   PRO   4          HB2       PRO   4  10.093  -1.577  -0.893
   26   2HB   PRO   4          HB1       PRO   4  11.826  -1.892  -1.041
   27   1HG   PRO   4          HG2       PRO   4   9.865  -2.974   0.945
   28   2HG   PRO   4          HG1       PRO   4  11.149  -3.824   0.064
   29   1HD   PRO   4          HD2       PRO   4  11.419  -3.010   2.641
   30   2HD   PRO   4          HD1       PRO   4  12.788  -3.113   1.517
   31    H    CYS   5           HN       CYS   5  10.276   1.449  -0.565
   32    HA   CYS   5           HA       CYS   5   7.803   1.375   1.009
   33   1HB   CYS   5          HB2       CYS   5   9.467   3.864   0.557
   34   2HB   CYS   5          HB1       CYS   5   7.890   3.811   1.340
   35    HG   CYS   5           HG       CYS   5  10.874   3.374   2.648
   36    H    CYS   6           HN       CYS   6   6.110   2.832   0.038
   37    HA   CYS   6           HA       CYS   6   6.486   3.397  -2.792
   38   1HB   CYS   6          HB2       CYS   6   4.662   2.087  -3.564
   39   2HB   CYS   6          HB1       CYS   6   5.658   1.028  -2.584
   40    HG   CYS   6           HG       CYS   6   3.145   0.241  -1.954
   41    H    ARG   7           HN       ARG   7   4.289   4.267  -3.694
   42    HA   ARG   7           HA       ARG   7   2.899   5.876  -1.681
   43   1HB   ARG   7          HB2       ARG   7   3.219   7.945  -2.954
   44   2HB   ARG   7          HB1       ARG   7   4.755   7.283  -2.417
   45   1HG   ARG   7          HG2       ARG   7   5.104   6.340  -4.666
   46   2HG   ARG   7          HG1       ARG   7   3.598   7.097  -5.190
   47   1HD   ARG   7          HD2       ARG   7   4.539   9.299  -4.565
   48   2HD   ARG   7          HD1       ARG   7   6.060   8.504  -4.160
   49    HE   ARG   7           HE       ARG   7   5.360   7.828  -6.789
   50   1HH1  ARG   7          HH11      ARG   7   6.403  10.582  -4.925
   51   2HH1  ARG   7          HH12      ARG   7   7.173  11.361  -6.268
   52   1HH2  ARG   7          HH21      ARG   7   6.372   8.847  -8.562
   53   2HH2  ARG   7          HH22      ARG   7   7.156  10.374  -8.334
   54    H    GLY   8           HN       GLY   8   0.786   6.239  -2.144
   55   1HA   GLY   8          HA2       GLY   8  -0.379   4.767  -4.313
   56   2HA   GLY   8          HA1       GLY   8  -1.241   5.740  -3.132
   57    H    LEU   9           HN       LEU   9  -1.419   5.475  -6.118
   58    HA   LEU   9           HA       LEU   9  -0.859   8.243  -6.907
   59   1HB   LEU   9          HB2       LEU   9  -1.259   5.701  -8.431
   60   2HB   LEU   9          HB1       LEU   9  -1.564   7.236  -9.219
   61    HG   LEU   9           HG       LEU   9   0.688   6.357  -9.691
   62   1HD1  LEU   9          HD11      LEU   9   1.930   8.409  -9.154
   63   2HD1  LEU   9          HD12      LEU   9   0.629   8.895  -8.067
   64   3HD1  LEU   9          HD13      LEU   9   0.323   8.743  -9.798
   65   1HD2  LEU   9          HD21      LEU   9   1.187   6.770  -6.745
   66   2HD2  LEU   9          HD22      LEU   9   2.384   6.303  -7.954
   67   3HD2  LEU   9          HD23      LEU   9   1.060   5.209  -7.554
   68    H    TYR  10           HN       TYR  10  -3.420   5.928  -6.457
   69    HA   TYR  10           HA       TYR  10  -5.393   8.004  -7.158
   70   1HB   TYR  10          HB2       TYR  10  -5.888   5.027  -7.103
   71   2HB   TYR  10          HB1       TYR  10  -6.955   6.284  -7.720
   72    HD1  TYR  10           HD1      TYR  10  -4.223   4.060  -8.471
   73    HD2  TYR  10           HD2      TYR  10  -6.299   7.525  -9.807
   74    HE1  TYR  10           HE1      TYR  10  -3.250   3.772 -10.710
   75    HE2  TYR  10           HE2      TYR  10  -5.332   7.246 -12.051
   76    HH   TYR  10           HH       TYR  10  -3.371   6.182 -13.090
   77    H    ASP  11           HN       ASP  11  -7.120   8.373  -5.772
   78    HA   ASP  11           HA       ASP  11  -6.603   7.788  -3.018
   79   1HB   ASP  11          HB2       ASP  11  -7.406   9.932  -3.396
   80   2HB   ASP  11          HB1       ASP  11  -8.680   9.390  -4.474
   81    H    PHE  12           HN       PHE  12  -8.149   6.957  -1.561
   82    HA   PHE  12           HA       PHE  12 -10.372   5.395  -2.424
   83   1HB   PHE  12          HB2       PHE  12  -7.858   4.116  -2.538
   84   2HB   PHE  12          HB1       PHE  12  -8.704   3.474  -1.137
   85    HD1  PHE  12           HD1      PHE  12  -8.439   3.447  -4.709
   86    HD2  PHE  12           HD2      PHE  12 -11.005   2.504  -1.446
   87    HE1  PHE  12           HE1      PHE  12  -9.762   1.982  -6.178
   88    HE2  PHE  12           HE2      PHE  12 -12.332   1.036  -2.910
   89    HZ   PHE  12           HZ       PHE  12 -11.705   0.767  -5.275
   90    H    GLU  13           HN       GLU  13 -11.780   5.639  -0.825
   91    HA   GLU  13           HA       GLU  13 -10.840   6.243   1.846
   92   1HB   GLU  13          HB2       GLU  13 -13.306   6.508   2.329
   93   2HB   GLU  13          HB1       GLU  13 -12.649   7.597   1.118
   94   1HG   GLU  13          HG2       GLU  13 -14.510   6.986   0.011
   95   2HG   GLU  13          HG1       GLU  13 -13.485   5.644  -0.492
   96    HA   PRO  14           HA       PRO  14 -11.161   1.922   2.961
   97   1HB   PRO  14          HB2       PRO  14 -10.518   2.196   5.588
   98   2HB   PRO  14          HB1       PRO  14  -9.318   2.217   4.292
   99   1HG   PRO  14          HG2       PRO  14 -10.532   4.497   5.791
  100   2HG   PRO  14          HG1       PRO  14  -8.858   4.270   5.251
  101   1HD   PRO  14          HD2       PRO  14 -10.651   5.860   3.951
  102   2HD   PRO  14          HD1       PRO  14  -9.302   5.041   3.141
  103    H    GLU  15           HN       GLU  15 -12.851   0.725   3.606
  104    HA   GLU  15           HA       GLU  15 -14.796   1.918   5.462
  105   1HB   GLU  15          HB2       GLU  15 -15.591   2.086   3.106
  106   2HB   GLU  15          HB1       GLU  15 -15.506   0.335   2.986
  107   1HG   GLU  15          HG2       GLU  15 -17.190   0.110   4.714
  108   2HG   GLU  15          HG1       GLU  15 -17.243   1.860   4.912
  109    H    ASN  16           HN       ASN  16 -12.861  -0.710   4.594
  110    HA   ASN  16           HA       ASN  16 -14.148  -2.369   6.649
  111   1HB   ASN  16          HB2       ASN  16 -14.803  -3.265   4.466
  112   2HB   ASN  16          HB1       ASN  16 -13.113  -3.351   3.980
  113   1HD2  ASN  16          HD21      ASN  16 -11.805  -4.954   4.809
  114   2HD2  ASN  16          HD22      ASN  16 -12.435  -6.328   5.644
  115    H    GLN  17           HN       GLN  17 -12.786  -3.157   8.130
  116    HA   GLN  17           HA       GLN  17 -10.112  -2.316   8.250
  117   1HB   GLN  17          HB2       GLN  17  -9.919  -3.855  10.179
  118   2HB   GLN  17          HB1       GLN  17 -11.344  -2.829  10.268
  119   1HG   GLN  17          HG2       GLN  17 -12.716  -4.691   9.446
  120   2HG   GLN  17          HG1       GLN  17 -11.281  -5.714   9.415
  121   1HE2  GLN  17          HE21      GLN  17 -11.879  -3.322  11.888
  122   2HE2  GLN  17          HE22      GLN  17 -12.154  -4.438  13.178
  123    H    GLY  18           HN       GLY  18  -8.182  -3.305   7.841
  124   1HA   GLY  18          HA2       GLY  18  -6.913  -5.353   7.430
  125   2HA   GLY  18          HA1       GLY  18  -8.297  -5.946   6.524
  126    H    GLU  19           HN       GLU  19  -8.598  -3.159   5.370
  127    HA   GLU  19           HA       GLU  19  -6.609  -3.510   3.241
  128   1HB   GLU  19          HB2       GLU  19  -8.944  -1.664   3.019
  129   2HB   GLU  19          HB1       GLU  19  -8.134  -2.585   1.760
  130   1HG   GLU  19          HG2       GLU  19  -9.124  -4.650   2.710
  131   2HG   GLU  19          HG1       GLU  19 -10.019  -3.649   3.849
  132    H    LEU  20           HN       LEU  20  -5.703  -1.555   2.261
  133    HA   LEU  20           HA       LEU  20  -5.124   0.454   4.312
  134   1HB   LEU  20          HB2       LEU  20  -3.688  -0.551   1.920
  135   2HB   LEU  20          HB1       LEU  20  -3.376   1.095   2.430
  136    HG   LEU  20           HG       LEU  20  -3.067  -1.309   4.227
  137   1HD1  LEU  20          HD11      LEU  20  -0.656  -1.041   3.884
  138   2HD1  LEU  20          HD12      LEU  20  -0.973   0.191   2.663
  139   3HD1  LEU  20          HD13      LEU  20  -1.490  -1.472   2.392
  140   1HD2  LEU  20          HD21      LEU  20  -2.141   1.547   4.506
  141   2HD2  LEU  20          HD22      LEU  20  -1.809   0.236   5.638
  142   3HD2  LEU  20          HD23      LEU  20  -3.464   0.795   5.396
  143    H    GLY  21           HN       GLY  21  -6.318   2.233   4.265
  144   1HA   GLY  21          HA2       GLY  21  -7.299   3.188   1.652
  145   2HA   GLY  21          HA1       GLY  21  -8.117   3.459   3.179
  146    H    PHE  22           HN       PHE  22  -6.693   5.095   0.898
  147    HA   PHE  22           HA       PHE  22  -6.155   7.375   2.449
  148   1HB   PHE  22          HB2       PHE  22  -3.948   5.554   2.229
  149   2HB   PHE  22          HB1       PHE  22  -3.567   7.027   1.345
  150    HD1  PHE  22           HD1      PHE  22  -4.399   9.229   2.732
  151    HD2  PHE  22           HD2      PHE  22  -3.206   5.493   4.385
  152    HE1  PHE  22           HE1      PHE  22  -3.837  10.349   4.850
  153    HE2  PHE  22           HE2      PHE  22  -2.642   6.606   6.505
  154    HZ   PHE  22           HZ       PHE  22  -2.951   9.051   6.731
  155    H    LYS  23           HN       LYS  23  -4.717   8.983   0.982
  156    HA   LYS  23           HA       LYS  23  -5.823   8.748  -1.726
  157   1HB   LYS  23          HB2       LYS  23  -5.506  11.309  -1.713
  158   2HB   LYS  23          HB1       LYS  23  -6.895  10.606  -0.895
  159   1HG   LYS  23          HG2       LYS  23  -4.399  11.088   0.643
  160   2HG   LYS  23          HG1       LYS  23  -5.461  12.450   0.270
  161   1HD   LYS  23          HD2       LYS  23  -6.465   9.908   1.520
  162   2HD   LYS  23          HD1       LYS  23  -5.853  11.253   2.488
  163   1HE   LYS  23          HE2       LYS  23  -7.535  12.726   1.548
  164   2HE   LYS  23          HE1       LYS  23  -8.108  11.435   0.492
  165   1HZ   LYS  23          HZ1       LYS  23  -9.509  11.716   2.454
  166   2HZ   LYS  23          HZ2       LYS  23  -8.193  11.376   3.461
  167   3HZ   LYS  23          HZ3       LYS  23  -8.794  10.183   2.422
  168    H    GLU  24           HN       GLU  24  -4.607  10.271  -3.285
  169    HA   GLU  24           HA       GLU  24  -2.108   9.225  -3.818
  170   1HB   GLU  24          HB2       GLU  24  -1.843  11.098  -5.389
  171   2HB   GLU  24          HB1       GLU  24  -3.457  10.401  -5.481
  172   1HG   GLU  24          HG2       GLU  24  -3.962  12.280  -3.696
  173   2HG   GLU  24          HG1       GLU  24  -2.586  13.048  -4.487
  174    H    GLY  25           HN       GLY  25  -0.008  10.009  -3.599
  175   1HA   GLY  25          HA2       GLY  25   1.704  11.345  -2.754
  176   2HA   GLY  25          HA1       GLY  25   0.501  12.349  -1.962
  177    H    ASP  26           HN       ASP  26  -0.527   9.498  -1.029
  178    HA   ASP  26           HA       ASP  26   0.668   9.690   1.558
  179   1HB   ASP  26          HB2       ASP  26  -1.643   8.964   1.336
  180   2HB   ASP  26          HB1       ASP  26  -1.143   7.578   0.371
  181    H    ILE  27           HN       ILE  27   2.198   8.433   2.516
  182    HA   ILE  27           HA       ILE  27   3.615   6.536   0.757
  183    HB   ILE  27           HB       ILE  27   4.771   7.986   3.141
  184   1HG1  ILE  27          HG12      ILE  27   4.136   9.596   1.385
  185   2HG1  ILE  27          HG11      ILE  27   5.883   9.477   1.557
  186   1HG2  ILE  27          HG21      ILE  27   5.910   5.920   2.602
  187   2HG2  ILE  27          HG22      ILE  27   6.924   7.297   2.170
  188   3HG2  ILE  27          HG23      ILE  27   6.057   6.413   0.915
  189   1HD1  ILE  27          HD11      ILE  27   4.242   8.136  -0.580
  190   2HD1  ILE  27          HD12      ILE  27   5.998   8.078  -0.423
  191   3HD1  ILE  27          HD13      ILE  27   5.194   9.607  -0.778
  192    H    ILE  28           HN       ILE  28   3.767   4.467   1.386
  193    HA   ILE  28           HA       ILE  28   3.150   3.795   4.189
  194    HB   ILE  28           HB       ILE  28   2.260   2.219   1.768
  195   1HG1  ILE  28          HG12      ILE  28   0.600   3.844   3.708
  196   2HG1  ILE  28          HG11      ILE  28   1.041   4.372   2.087
  197   1HG2  ILE  28          HG21      ILE  28   1.743   1.820   4.712
  198   2HG2  ILE  28          HG22      ILE  28   2.715   0.787   3.663
  199   3HG2  ILE  28          HG23      ILE  28   0.973   0.905   3.415
  200   1HD1  ILE  28          HD11      ILE  28  -0.664   1.999   2.795
  201   2HD1  ILE  28          HD12      ILE  28  -0.182   2.452   1.160
  202   3HD1  ILE  28          HD13      ILE  28  -1.212   3.526   2.106
  203    H    THR  29           HN       THR  29   4.286   2.055   5.081
  204    HA   THR  29           HA       THR  29   6.771   1.425   3.708
  205    HB   THR  29           HB       THR  29   7.476   0.385   5.805
  206    HG1  THR  29           HG1      THR  29   5.929   0.668   7.624
  207   1HG2  THR  29          HG21      THR  29   6.156   3.064   6.260
  208   2HG2  THR  29          HG22      THR  29   7.749   2.809   5.546
  209   3HG2  THR  29          HG23      THR  29   7.456   2.370   7.230
  210    H    LEU  30           HN       LEU  30   7.287  -0.484   2.818
  211    HA   LEU  30           HA       LEU  30   5.214  -2.543   2.731
  212   1HB   LEU  30          HB2       LEU  30   6.337  -1.578   0.663
  213   2HB   LEU  30          HB1       LEU  30   7.779  -2.441   1.167
  214    HG   LEU  30           HG       LEU  30   6.492  -4.571   1.043
  215   1HD1  LEU  30          HD11      LEU  30   4.252  -3.640   1.325
  216   2HD1  LEU  30          HD12      LEU  30   4.372  -4.595  -0.153
  217   3HD1  LEU  30          HD13      LEU  30   4.388  -2.833  -0.238
  218   1HD2  LEU  30          HD21      LEU  30   7.937  -3.871  -0.784
  219   2HD2  LEU  30          HD22      LEU  30   6.618  -2.935  -1.487
  220   3HD2  LEU  30          HD23      LEU  30   6.504  -4.693  -1.403
  221    H    THR  31           HN       THR  31   5.412  -4.470   3.721
  222    HA   THR  31           HA       THR  31   7.913  -5.694   4.229
  223    HB   THR  31           HB       THR  31   8.114  -4.102   6.009
  224    HG1  THR  31           HG1      THR  31   7.240  -6.365   7.428
  225   1HG2  THR  31          HG21      THR  31   5.987  -3.292   6.464
  226   2HG2  THR  31          HG22      THR  31   6.338  -4.261   7.896
  227   3HG2  THR  31          HG23      THR  31   5.298  -4.905   6.627
  228    H    ASN  32           HN       ASN  32   5.001  -6.048   3.316
  229    HA   ASN  32           HA       ASN  32   4.743  -8.760   4.271
  230   1HB   ASN  32          HB2       ASN  32   2.626  -6.655   4.690
  231   2HB   ASN  32          HB1       ASN  32   2.327  -8.378   4.807
  232   1HD2  ASN  32          HD21      ASN  32   3.672  -5.610   6.337
  233   2HD2  ASN  32          HD22      ASN  32   4.055  -6.359   7.846
  234    H    GLN  33           HN       GLN  33   2.649  -9.696   3.095
  235    HA   GLN  33           HA       GLN  33   1.762  -8.437   0.731
  236   1HB   GLN  33          HB2       GLN  33   4.324  -9.797   0.572
  237   2HB   GLN  33          HB1       GLN  33   3.149 -10.434  -0.578
  238   1HG   GLN  33          HG2       GLN  33   2.814  -8.348  -1.559
  239   2HG   GLN  33          HG1       GLN  33   3.643  -7.499  -0.240
  240   1HE2  GLN  33          HE21      GLN  33   4.828 -10.461  -1.666
  241   2HE2  GLN  33          HE22      GLN  33   6.207  -9.772  -2.447
  242    H    ILE  34           HN       ILE  34   0.287  -9.628  -0.447
  243    HA   ILE  34           HA       ILE  34  -0.536 -12.129   0.827
  244    HB   ILE  34           HB       ILE  34  -2.145 -10.091  -0.696
  245   1HG1  ILE  34          HG12      ILE  34  -1.665  -9.596   1.680
  246   2HG1  ILE  34          HG11      ILE  34  -3.381  -9.832   1.374
  247   1HG2  ILE  34          HG21      ILE  34  -2.946 -12.238  -1.399
  248   2HG2  ILE  34          HG22      ILE  34  -4.110 -11.545  -0.270
  249   3HG2  ILE  34          HG23      ILE  34  -3.006 -12.811   0.268
  250   1HD1  ILE  34          HD11      ILE  34  -2.692 -10.880   3.454
  251   2HD1  ILE  34          HD12      ILE  34  -1.513 -11.860   2.584
  252   3HD1  ILE  34          HD13      ILE  34  -3.237 -12.086   2.289
  253    H    ASP  35           HN       ASP  35   0.165 -10.587  -2.209
  254    HA   ASP  35           HA       ASP  35   0.654 -13.134  -3.460
  255   1HB   ASP  35          HB2       ASP  35  -1.796 -12.839  -3.763
  256   2HB   ASP  35          HB1       ASP  35  -1.485 -11.327  -4.609
  257    H    GLU  36           HN       GLU  36   1.341 -12.748  -5.825
  258    HA   GLU  36           HA       GLU  36   3.465 -10.921  -5.844
  259   1HB   GLU  36          HB2       GLU  36   2.115 -12.404  -8.100
  260   2HB   GLU  36          HB1       GLU  36   3.587 -11.464  -8.299
  261   1HG   GLU  36          HG2       GLU  36   4.203 -13.745  -8.078
  262   2HG   GLU  36          HG1       GLU  36   4.666 -12.919  -6.592
  263    H    ASN  37           HN       ASN  37   0.184 -10.363  -6.252
  264    HA   ASN  37           HA       ASN  37   0.661  -7.930  -7.837
  265   1HB   ASN  37          HB2       ASN  37  -1.912  -9.439  -7.329
  266   2HB   ASN  37          HB1       ASN  37  -1.785  -7.947  -8.256
  267   1HD2  ASN  37          HD21      ASN  37  -2.539  -8.883 -10.132
  268   2HD2  ASN  37          HD22      ASN  37  -1.605 -10.006 -11.055
  269    H    TRP  38           HN       TRP  38  -1.359  -9.063  -5.111
  270    HA   TRP  38           HA       TRP  38  -1.630  -6.337  -4.161
  271   1HB   TRP  38          HB2       TRP  38  -2.636  -8.761  -2.692
  272   2HB   TRP  38          HB1       TRP  38  -3.248  -7.109  -2.644
  273    HD1  TRP  38           HD1      TRP  38  -2.834  -9.647  -5.584
  274    HE1  TRP  38           HE1      TRP  38  -5.059  -9.705  -6.873
  275    HE3  TRP  38           HE3      TRP  38  -5.514  -6.353  -2.733
  276    HZ2  TRP  38           HZ2      TRP  38  -7.615  -8.521  -6.701
  277    HZ3  TRP  38           HZ3      TRP  38  -7.844  -5.877  -3.361
  278    HH2  TRP  38           HH2      TRP  38  -8.871  -6.938  -5.304
  279    H    TYR  39           HN       TYR  39  -0.349  -5.415  -2.681
  280    HA   TYR  39           HA       TYR  39   1.576  -7.141  -1.265
  281   1HB   TYR  39          HB2       TYR  39   1.586  -4.217  -1.997
  282   2HB   TYR  39          HB1       TYR  39   2.696  -4.873  -0.803
  283    HD1  TYR  39           HD1      TYR  39   1.932  -7.159  -3.486
  284    HD2  TYR  39           HD2      TYR  39   4.441  -3.910  -2.359
  285    HE1  TYR  39           HE1      TYR  39   3.503  -7.756  -5.277
  286    HE2  TYR  39           HE2      TYR  39   6.017  -4.502  -4.149
  287    HH   TYR  39           HH       TYR  39   5.255  -6.613  -6.646
  288    H    GLU  40           HN       GLU  40   2.311  -6.023   0.882
  289    HA   GLU  40           HA       GLU  40   0.054  -4.916   2.331
  290   1HB   GLU  40          HB2       GLU  40   1.256  -7.594   2.896
  291   2HB   GLU  40          HB1       GLU  40   0.612  -6.632   4.217
  292   1HG   GLU  40          HG2       GLU  40  -1.535  -6.500   2.898
  293   2HG   GLU  40          HG1       GLU  40  -0.850  -7.735   1.842
  294    H    GLY  41           HN       GLY  41   0.599  -3.592   3.958
  295   1HA   GLY  41          HA2       GLY  41   3.262  -3.612   5.092
  296   2HA   GLY  41          HA1       GLY  41   2.904  -2.220   4.078
  297    H    MET  42           HN       MET  42   3.358  -1.139   6.223
  298    HA   MET  42           HA       MET  42   0.795  -0.795   7.602
  299   1HB   MET  42          HB2       MET  42   3.283  -0.720   9.248
  300   2HB   MET  42          HB1       MET  42   1.626  -1.062   9.736
  301   1HG   MET  42          HG2       MET  42   1.797  -3.244   8.563
  302   2HG   MET  42          HG1       MET  42   3.494  -2.896   8.247
  303   1HE   MET  42          HE1       MET  42   4.055  -5.272   9.417
  304   2HE   MET  42          HE2       MET  42   2.341  -5.510   9.752
  305   3HE   MET  42          HE3       MET  42   3.524  -5.690  11.045
  306    H    ILE  43           HN       ILE  43   0.527   1.175   8.668
  307    HA   ILE  43           HA       ILE  43   2.486   3.276   8.132
  308    HB   ILE  43           HB       ILE  43   0.893   3.408   6.271
  309   1HG1  ILE  43          HG12      ILE  43   0.055   5.753   6.669
  310   2HG1  ILE  43          HG11      ILE  43   0.630   5.609   8.328
  311   1HG2  ILE  43          HG21      ILE  43  -1.481   4.019   6.760
  312   2HG2  ILE  43          HG22      ILE  43  -1.178   3.596   8.445
  313   3HG2  ILE  43          HG23      ILE  43  -1.037   2.368   7.189
  314   1HD1  ILE  43          HD11      ILE  43   2.435   5.235   5.949
  315   2HD1  ILE  43          HD12      ILE  43   2.891   5.494   7.633
  316   3HD1  ILE  43          HD13      ILE  43   2.159   6.804   6.707
  317    H    HIS  44           HN       HIS  44   2.228   5.124   9.528
  318    HA   HIS  44           HA       HIS  44   2.055   4.777  12.141
  319   1HB   HIS  44          HB2       HIS  44   0.906   7.154  10.671
  320   2HB   HIS  44          HB1       HIS  44   1.259   7.129  12.396
  321    HD1  HIS  44           HD1      HIS  44   3.702   7.359  13.107
  322    HD2  HIS  44           HD2      HIS  44   3.181   7.214   8.987
  323    HE1  HIS  44           HE1      HIS  44   5.921   8.017  12.125
  324    HE2  HIS  44           HE2      HIS  44   5.601   7.859   9.632
  325    H    GLY  45           HN       GLY  45  -0.782   5.027  10.077
  326   1HA   GLY  45          HA2       GLY  45  -2.632   5.025  12.278
  327   2HA   GLY  45          HA1       GLY  45  -3.034   4.872  10.576
  328    H    GLU  46           HN       GLU  46  -2.010   2.625   9.678
  329    HA   GLU  46           HA       GLU  46  -2.111   0.412  11.459
  330   1HB   GLU  46          HB2       GLU  46  -4.221  -0.572  10.860
  331   2HB   GLU  46          HB1       GLU  46  -4.513   1.044  11.484
  332   1HG   GLU  46          HG2       GLU  46  -4.427   0.303   8.568
  333   2HG   GLU  46          HG1       GLU  46  -5.894   0.499   9.525
  334    H    SER  47           HN       SER  47  -2.441  -1.664  10.262
  335    HA   SER  47           HA       SER  47  -0.912  -1.523   7.754
  336   1HB   SER  47          HB2       SER  47  -0.255  -3.836   8.215
  337   2HB   SER  47          HB1       SER  47   0.111  -2.804   9.598
  338    HG   SER  47           HG       SER  47  -1.889  -4.753   9.307
  339    H    GLY  48           HN       GLY  48  -1.505  -2.744   5.947
  340   1HA   GLY  48          HA2       GLY  48  -3.812  -4.425   5.887
  341   2HA   GLY  48          HA1       GLY  48  -4.163  -2.833   5.231
  342    H    PHE  49           HN       PHE  49  -4.589  -4.398   3.321
  343    HA   PHE  49           HA       PHE  49  -2.068  -4.914   1.898
  344   1HB   PHE  49          HB2       PHE  49  -3.305  -6.449   0.473
  345   2HB   PHE  49          HB1       PHE  49  -3.529  -6.871   2.164
  346    HD1  PHE  49           HD1      PHE  49  -5.131  -5.493  -0.830
  347    HD2  PHE  49           HD2      PHE  49  -5.678  -6.721   3.206
  348    HE1  PHE  49           HE1      PHE  49  -7.569  -5.468  -1.158
  349    HE2  PHE  49           HE2      PHE  49  -8.116  -6.697   2.887
  350    HZ   PHE  49           HZ       PHE  49  -9.065  -6.072   0.702
  351    H    PHE  50           HN       PHE  50  -1.982  -4.467  -0.403
  352    HA   PHE  50           HA       PHE  50  -3.842  -2.828  -1.729
  353   1HB   PHE  50          HB2       PHE  50  -2.550  -1.392   0.177
  354   2HB   PHE  50          HB1       PHE  50  -1.458  -1.163  -1.182
  355    HD1  PHE  50           HD1      PHE  50  -1.776   1.037  -1.865
  356    HD2  PHE  50           HD2      PHE  50  -5.163  -1.427  -1.117
  357    HE1  PHE  50           HE1      PHE  50  -3.247   2.798  -2.750
  358    HE2  PHE  50           HE2      PHE  50  -6.641   0.332  -1.999
  359    HZ   PHE  50           HZ       PHE  50  -5.654   2.496  -2.765
  360    HA   PRO  51           HA       PRO  51  -1.012  -4.867  -4.680
  361   1HB   PRO  51          HB2       PRO  51  -2.628  -4.197  -6.838
  362   2HB   PRO  51          HB1       PRO  51  -2.748  -5.686  -5.897
  363   1HG   PRO  51          HG2       PRO  51  -4.335  -3.164  -5.669
  364   2HG   PRO  51          HG1       PRO  51  -4.878  -4.848  -5.538
  365   1HD   PRO  51          HD2       PRO  51  -4.540  -3.348  -3.359
  366   2HD   PRO  51          HD1       PRO  51  -4.077  -5.069  -3.361
  367    H    ILE  52           HN       ILE  52   0.154  -4.153  -6.562
  368    HA   ILE  52           HA       ILE  52   1.190  -1.540  -6.299
  369    HB   ILE  52           HB       ILE  52   1.512  -3.282  -8.734
  370   1HG1  ILE  52          HG12      ILE  52   3.144  -3.400  -6.189
  371   2HG1  ILE  52          HG11      ILE  52   1.911  -4.577  -6.627
  372   1HG2  ILE  52          HG21      ILE  52   2.395  -1.030  -8.928
  373   2HG2  ILE  52          HG22      ILE  52   3.714  -2.197  -8.847
  374   3HG2  ILE  52          HG23      ILE  52   3.301  -1.234  -7.429
  375   1HD1  ILE  52          HD11      ILE  52   4.480  -4.016  -8.085
  376   2HD1  ILE  52          HD12      ILE  52   3.213  -5.094  -8.671
  377   3HD1  ILE  52          HD13      ILE  52   4.061  -5.465  -7.169
  378    H    ASN  53           HN       ASN  53  -1.500  -2.771  -8.002
  379    HA   ASN  53           HA       ASN  53  -1.624  -0.981 -10.170
  380   1HB   ASN  53          HB2       ASN  53  -2.960  -3.040 -10.050
  381   2HB   ASN  53          HB1       ASN  53  -3.882  -2.369  -8.709
  382   1HD2  ASN  53          HD21      ASN  53  -3.228  -2.166 -12.125
  383   2HD2  ASN  53          HD22      ASN  53  -4.637  -1.257 -12.541
  384    H    TYR  54           HN       TYR  54  -1.768  -0.268  -6.923
  385    HA   TYR  54           HA       TYR  54  -3.294   2.185  -7.484
  386   1HB   TYR  54          HB2       TYR  54  -3.368   0.522  -4.965
  387   2HB   TYR  54          HB1       TYR  54  -4.095   2.118  -5.122
  388    HD1  TYR  54           HD1      TYR  54  -6.173   2.424  -6.265
  389    HD2  TYR  54           HD2      TYR  54  -4.287  -1.390  -6.245
  390    HE1  TYR  54           HE1      TYR  54  -8.235   1.408  -7.137
  391    HE2  TYR  54           HE2      TYR  54  -6.343  -2.416  -7.118
  392    HH   TYR  54           HH       TYR  54  -8.742  -1.957  -7.195
  393    H    VAL  55           HN       VAL  55  -0.329   0.941  -6.614
  394    HA   VAL  55           HA       VAL  55   0.484   3.558  -5.556
  395    HB   VAL  55           HB       VAL  55   2.054   2.481  -3.976
  396   1HG1  VAL  55          HG11      VAL  55  -0.894   1.961  -3.657
  397   2HG1  VAL  55          HG12      VAL  55   0.058   3.301  -3.019
  398   3HG1  VAL  55          HG13      VAL  55   0.267   1.680  -2.361
  399   1HG2  VAL  55          HG21      VAL  55   1.748   0.126  -3.388
  400   2HG2  VAL  55          HG22      VAL  55   2.243   0.309  -5.071
  401   3HG2  VAL  55          HG23      VAL  55   0.560  -0.046  -4.678
  402    H    GLU  56           HN       GLU  56   2.983   3.602  -5.418
  403    HA   GLU  56           HA       GLU  56   4.230   2.197  -7.658
  404   1HB   GLU  56          HB2       GLU  56   3.295   4.544  -8.283
  405   2HB   GLU  56          HB1       GLU  56   4.642   5.158  -7.336
  406   1HG   GLU  56          HG2       GLU  56   4.906   3.305  -9.693
  407   2HG   GLU  56          HG1       GLU  56   5.094   5.056  -9.758
  408    H    VAL  57           HN       VAL  57   5.784   1.127  -6.599
  409    HA   VAL  57           HA       VAL  57   6.927   1.812  -4.166
  410    HB   VAL  57           HB       VAL  57   8.200   0.187  -6.376
  411   1HG1  VAL  57          HG11      VAL  57   9.474  -0.873  -4.557
  412   2HG1  VAL  57          HG12      VAL  57   8.782   0.283  -3.418
  413   3HG1  VAL  57          HG13      VAL  57   9.836   0.846  -4.716
  414   1HG2  VAL  57          HG21      VAL  57   6.447  -0.655  -4.071
  415   2HG2  VAL  57          HG22      VAL  57   7.285  -1.753  -5.166
  416   3HG2  VAL  57          HG23      VAL  57   6.020  -0.690  -5.781
  417    H    ILE  58           HN       ILE  58   8.307   3.335  -3.571
  418    HA   ILE  58           HA       ILE  58   9.538   5.070  -5.496
  419    HB   ILE  58           HB       ILE  58   9.989   5.002  -2.510
  420   1HG1  ILE  58          HG12      ILE  58   7.989   6.668  -4.053
  421   2HG1  ILE  58          HG11      ILE  58   7.574   5.199  -3.175
  422   1HG2  ILE  58          HG21      ILE  58  10.620   7.344  -2.794
  423   2HG2  ILE  58          HG22      ILE  58  10.349   7.214  -4.531
  424   3HG2  ILE  58          HG23      ILE  58  11.644   6.289  -3.770
  425   1HD1  ILE  58          HD11      ILE  58   7.031   7.163  -1.875
  426   2HD1  ILE  58          HD12      ILE  58   8.701   7.721  -1.983
  427   3HD1  ILE  58          HD13      ILE  58   8.319   6.246  -1.094
  428    H    VAL  59           HN       VAL  59  10.800   2.904  -2.961
  429    HA   VAL  59           HA       VAL  59  13.416   2.953  -4.293
  430    HB   VAL  59           HB       VAL  59  12.747   1.885  -1.549
  431   1HG1  VAL  59          HG11      VAL  59  14.747   0.902  -2.526
  432   2HG1  VAL  59          HG12      VAL  59  15.170   1.980  -1.198
  433   3HG1  VAL  59          HG13      VAL  59  15.388   2.509  -2.866
  434   1HG2  VAL  59          HG21      VAL  59  13.911   4.553  -2.344
  435   2HG2  VAL  59          HG22      VAL  59  13.780   3.946  -0.694
  436   3HG2  VAL  59          HG23      VAL  59  12.322   4.275  -1.630
  437    HA   PRO  60           HA       PRO  60  12.101  -1.061  -5.969
  438   1HB   PRO  60          HB2       PRO  60  14.925  -1.010  -6.895
  439   2HB   PRO  60          HB1       PRO  60  13.447  -1.324  -7.809
  440   1HG   PRO  60          HG2       PRO  60  14.732   0.995  -8.056
  441   2HG   PRO  60          HG1       PRO  60  12.959   0.929  -8.050
  442   1HD   PRO  60          HD2       PRO  60  14.836   1.762  -5.876
  443   2HD   PRO  60          HD1       PRO  60  13.258   2.442  -6.327