*HEADER    LIGASE                                  24-JAN-07   2JNH              
*TITLE     SOLUTION STRUCTURE OF THE UBA DOMAIN FROM CBL-B                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: E3 UBIQUITIN-PROTEIN LIGASE CBL-B;                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UBA DOMAIN;                                                
*COMPND   5 SYNONYM: SIGNAL TRANSDUCTION PROTEIN CBL-B, SH3-BINDING              
*COMPND   6 PROTEIN CBL-B, CASITAS B-LINEAGE LYMPHOMA PROTO-ONCOGENE B,          
*COMPND   7 RING FINGER PROTEIN 56;                                              
*COMPND   8 EC: 6.3.2.-;                                                         
*COMPND   9 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: CBLB, RNF56;                                                   
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET-32M                                    
*KEYWDS    UBA DOMAIN, CBL-B, NMR, LIGASE                                        
*EXPDTA    NMR, 15 STRUCTURES                                                    
*AUTHOR    C.ZHOU, Z.ZHOU, D.LIN, H.HU                                           
*REVDAT   1   05-FEB-08 2JNH    0                                                


assign (segid "    " and resid    5 and name  HB2) (segid "    " and resid    5 and name   HA) 2.059 0.509 0.509 ! spec=C13NOESY, no=3, id=261
assign (segid "    " and resid   43 and name  HB2) (segid "    " and resid   43 and name   HA) 2.595 0.808 0.808 ! spec=C13NOESY, no=5, id=263
assign (segid "    " and resid   33 and name   HA) (segid "    " and resid   28 and name   HA) 4.101 2.018 2.018 ! spec=C13NOESY, no=7, id=264
assign (segid "    " and resid   33 and name   HA) (segid "    " and resid   33 and name  HB1) 3.546 1.509 1.509 ! spec=C13NOESY, no=10, id=267
assign (segid "    " and resid    5 and name  HB2) (segid "    " and resid    5 and name  HG1) 2.707 0.879 0.879 ! spec=C13NOESY, no=11, id=268
assign (segid "    " and resid    5 and name  HG1) (segid "    " and resid    5 and name  HB1) 2.397 0.689 0.689 ! spec=C13NOESY, no=14, id=270
assign (segid "    " and resid   43 and name  HB2) (segid "    " and resid   43 and name  HG2) 2.780 0.927 0.927 ! spec=C13NOESY, no=17, id=271
assign (segid "    " and resid   33 and name   HA) (segid "    " and resid   28 and name HD22) 3.398 1.385 1.385 ! spec=C13NOESY, no=20, id=272
assign (segid "    " and resid   11 and name HG12) (segid "    " and resid   11 and name   HA) 3.690 1.634 1.634 ! spec=C13NOESY, no=21, id=273
assign (segid "    " and resid   11 and name HG11) (segid "    " and resid   11 and name   HB) 2.530 0.768 0.768 ! spec=C13NOESY, no=23, id=275
assign (segid "    " and resid   11 and name HG11) (segid "    " and resid   11 and name HD12) 2.939 1.037 1.037 ! spec=C13NOESY, no=26, id=276
assign (segid "    " and resid   11 and name HG12) (segid "    " and resid   11 and name HG11) 2.156 0.558 0.558 ! spec=C13NOESY, no=27, id=277
assign (segid "    " and resid   26 and name  HB2) (segid "    " and resid   26 and name  HG2) 2.662 0.850 0.850 ! spec=C13NOESY, no=33, id=282
assign (segid "    " and resid   39 and name  HB2) (segid "    " and resid   36 and name   HA) 2.075 0.517 0.517 ! spec=C13NOESY, no=34, id=283
assign (segid "    " and resid   10 and name  HD1) (segid "    " and resid   10 and name  HE2) 3.170 1.206 1.206 ! spec=C13NOESY, no=37, id=285
assign (segid "    " and resid   39 and name  HB2) (segid "    " and resid   39 and name  HG2) 3.191 1.222 1.222 ! spec=C13NOESY, no=40, id=286
assign (segid "    " and resid   10 and name  HD1) (segid "    " and resid   10 and name  HG2) 2.487 0.742 0.742 ! spec=C13NOESY, no=41, id=287
assign (segid "    " and resid   17 and name  HB2) (segid "    " and resid   17 and name   HA) 2.827 0.959 0.959 ! spec=C13NOESY, no=43, id=288
assign (segid "    " and resid   25 and name  HD1) (segid "    " and resid   25 and name   HA) 3.864 1.792 1.792 ! spec=C13NOESY, no=45, id=290
assign (segid "    " and resid   25 and name  HD1) (segid "    " and resid   25 and name  HE2) 4.074 1.992 1.992 ! spec=C13NOESY, no=47, id=292
assign (segid "    " and resid   25 and name  HD2) (segid "    " and resid   25 and name  HE1) 3.086 1.143 1.143 ! spec=C13NOESY, no=48, id=293
assign (segid "    " and resid   17 and name  HB2) (segid "    " and resid   17 and name  HG2) 2.747 0.905 0.905 ! spec=C13NOESY, no=49, id=294
assign (segid "    " and resid   17 and name  HB1) (segid "    " and resid   17 and name  HG2) 2.769 0.920 0.920 ! spec=C13NOESY, no=50, id=295
assign (segid "    " and resid   17 and name  HB2) (segid "    " and resid   17 and name  HB1) 2.595 0.808 0.808 ! spec=C13NOESY, no=51, id=296
assign (segid "    " and resid   25 and name  HD2) (segid "    " and resid   25 and name  HG2) 2.933 1.032 1.032 ! spec=C13NOESY, no=56, id=300
assign (segid "    " and resid   25 and name  HD1) (segid "    " and resid   25 and name  HG2) 2.983 1.068 1.068 ! spec=C13NOESY, no=57, id=301
assign (segid "    " and resid   36 and name  HB2) (segid "    " and resid   36 and name   HA) 2.298 0.634 0.634 ! spec=C13NOESY, no=60, id=304
assign (segid "    " and resid   36 and name  HB2) (segid "    " and resid   36 and name  HG2) 2.769 0.920 0.920 ! spec=C13NOESY, no=64, id=308
assign (segid "    " and resid   36 and name  HB1) (segid "    " and resid   36 and name  HB2) 2.475 0.735 0.735 ! spec=C13NOESY, no=70, id=312
assign (segid "    " and resid    6 and name   HA) (segid "    " and resid    9 and name  HB2) 3.597 1.553 1.553 ! spec=C13NOESY, no=75, id=316
assign (segid "    " and resid   34 and name   HA) (segid "    " and resid   35 and name   HA) 5.095 3.115 3.115 ! spec=C13NOESY, no=80, id=319
assign (segid "    " and resid   34 and name  HB2) (segid "    " and resid   34 and name   HA) 2.178 0.569 0.569 ! spec=C13NOESY, no=81, id=320
assign (segid "    " and resid    6 and name   HA) (segid "    " and resid    6 and name  HB2) 3.039 1.108 1.108 ! spec=C13NOESY, no=82, id=321
assign (segid "    " and resid   34 and name   HA) (segid "    " and resid   34 and name  HB1) 2.306 0.638 0.638 ! spec=C13NOESY, no=83, id=322
assign (segid "    " and resid   34 and name   HA) (segid "    " and resid   37 and name   HB) 4.175 2.092 2.092 ! spec=C13NOESY, no=84, id=323
assign (segid "    " and resid   22 and name  HB2) (segid "    " and resid   22 and name   HA) 3.083 1.140 1.140 ! spec=C13NOESY, no=90, id=324
assign (segid "    " and resid   22 and name  HB1) (segid "    " and resid   22 and name   HA) 3.043 1.112 1.112 ! spec=C13NOESY, no=91, id=325
assign (segid "    " and resid   22 and name  HB2) (segid "    " and resid   22 and name  HG2) 2.167 0.564 0.564 ! spec=C13NOESY, no=92, id=326
assign (segid "    " and resid   22 and name  HB1) (segid "    " and resid   22 and name  HG1) 2.196 0.579 0.579 ! spec=C13NOESY, no=93, id=327
assign (segid "    " and resid   31 and name   HA) (segid "    " and resid   37 and name   HB) 3.907 1.832 1.832 ! spec=C13NOESY, no=104, id=335
assign (segid "    " and resid   31 and name  HB2) (segid "    " and resid   31 and name   HA) 3.325 1.326 1.326 ! spec=C13NOESY, no=105, id=336
assign (segid "    " and resid   31 and name   HA) (segid "    " and resid   30 and name HG22) 2.788 0.933 0.933 ! spec=C13NOESY, no=107, id=337
assign (segid "    " and resid   20 and name   HA) (segid "    " and resid   19 and name  HB1) 4.306 2.225 2.225 ! spec=C13NOESY, no=110, id=339
assign (segid "    " and resid   20 and name  HB2) (segid "    " and resid   20 and name   HA) 3.159 1.197 1.197 ! spec=C13NOESY, no=114, id=342
assign (segid "    " and resid   14 and name   HG) (segid "    " and resid   14 and name HD22) 2.035 0.497 0.497 ! spec=C13NOESY, no=117, id=344
assign (segid "    " and resid   28 and name HD12) (segid "    " and resid   29 and name   HA) 4.201 2.117 2.117 ! spec=C13NOESY, no=118, id=345
assign (segid "    " and resid   42 and name   HG) (segid "    " and resid   42 and name   HA) 3.293 1.301 1.301 ! spec=C13NOESY, no=119, id=346
assign (segid "    " and resid   42 and name   HG) (segid "    " and resid   39 and name   HA) 3.510 1.478 1.478 ! spec=C13NOESY, no=120, id=347
assign (segid "    " and resid   42 and name   HG) (segid "    " and resid   17 and name  HG1) 4.419 2.343 2.343 ! spec=C13NOESY, no=121, id=348
assign (segid "    " and resid   28 and name HD12) (segid "    " and resid   28 and name  HB1) 2.507 0.754 0.754 ! spec=C13NOESY, no=123, id=350
assign (segid "    " and resid   28 and name HD12) (segid "    " and resid   28 and name   HG) 2.711 0.882 0.882 ! spec=C13NOESY, no=124, id=351
assign (segid "    " and resid   42 and name   HG) (segid "    " and resid   42 and name  HB2) 3.132 1.177 1.177 ! spec=C13NOESY, no=125, id=352
assign (segid "    " and resid   10 and name  HG2) (segid "    " and resid   10 and name  HB2) 3.560 1.521 1.521 ! spec=C13NOESY, no=132, id=357
assign (segid "    " and resid   10 and name  HG2) (segid "    " and resid   10 and name  HD2) 2.748 0.906 0.906 ! spec=C13NOESY, no=133, id=358
assign (segid "    " and resid   10 and name  HG2) (segid "    " and resid   10 and name  HB1) 2.733 0.896 0.896 ! spec=C13NOESY, no=134, id=359
assign (segid "    " and resid   10 and name  HG2) (segid "    " and resid   35 and name HG12) 3.814 1.745 1.745 ! spec=C13NOESY, no=137, id=360
assign (segid "    " and resid   42 and name HD12) (segid "    " and resid   42 and name HD22) 3.534 1.499 1.499 ! spec=C13NOESY, no=138, id=361
assign (segid "    " and resid   42 and name HD12) (segid "    " and resid   42 and name   HG) 2.953 1.047 1.047 ! spec=C13NOESY, no=139, id=362
assign (segid "    " and resid   14 and name HD12) (segid "    " and resid   14 and name   HG) 3.398 1.385 1.385 ! spec=C13NOESY, no=140, id=363
assign (segid "    " and resid   14 and name HD12) (segid "    " and resid   14 and name   HA) 4.565 2.501 2.501 ! spec=C13NOESY, no=141, id=364
assign (segid "    " and resid   14 and name HD12) (segid "    " and resid   11 and name   HA) 3.694 1.638 1.638 ! spec=C13NOESY, no=143, id=366
assign (segid "    " and resid   14 and name HD12) (segid "    " and resid   35 and name   HA) 3.606 1.561 1.561 ! spec=C13NOESY, no=144, id=367
assign (segid "    " and resid   14 and name HD12) (segid "    " and resid   14 and name  HB2) 3.345 1.343 1.343 ! spec=C13NOESY, no=145, id=368
assign (segid "    " and resid   14 and name HD12) (segid "    " and resid   13 and name  HG2) 3.540 1.504 1.504 ! spec=C13NOESY, no=146, id=369
assign (segid "    " and resid   14 and name HD12) (segid "    " and resid   42 and name   HG) 3.706 1.648 1.648 ! spec=C13NOESY, no=150, id=370
assign (segid "    " and resid   24 and name HG22) (segid "    " and resid   21 and name   HA) 3.955 1.877 1.877 ! spec=C13NOESY, no=152, id=372
assign (segid "    " and resid   24 and name HG22) (segid "    " and resid   24 and name   HA) 3.702 1.645 1.645 ! spec=C13NOESY, no=154, id=373
assign (segid "    " and resid   24 and name HG22) (segid "    " and resid   19 and name  HB2) 3.240 1.259 1.259 ! spec=C13NOESY, no=155, id=374
assign (segid "    " and resid   24 and name HG22) (segid "    " and resid   19 and name  HB1) 2.979 1.065 1.065 ! spec=C13NOESY, no=158, id=375
assign (segid "    " and resid   24 and name HG22) (segid "    " and resid   24 and name   HB) 2.954 1.047 1.047 ! spec=C13NOESY, no=159, id=376
assign (segid "    " and resid   24 and name HG22) (segid "    " and resid   20 and name  HB2) 3.694 1.638 1.638 ! spec=C13NOESY, no=161, id=377
assign (segid "    " and resid   24 and name HG22) (segid "    " and resid   25 and name  HD2) 3.534 1.499 1.499 ! spec=C13NOESY, no=162, id=378
assign (segid "    " and resid   24 and name HG12) (segid "    " and resid   28 and name HD12) 3.902 1.827 1.827 ! spec=C13NOESY, no=165, id=379
    or (segid "    " and resid   24 and name HG12) (segid "    " and resid   28 and name HD11)
    or (segid "    " and resid   24 and name HG12) (segid "    " and resid   28 and name HD13)
    or (segid "    " and resid   24 and name HG11) (segid "    " and resid   28 and name HD12)
    or (segid "    " and resid   24 and name HG11) (segid "    " and resid   28 and name HD11)
    or (segid "    " and resid   24 and name HG11) (segid "    " and resid   28 and name HD13)
    or (segid "    " and resid   24 and name HG13) (segid "    " and resid   28 and name HD12)
    or (segid "    " and resid   24 and name HG13) (segid "    " and resid   28 and name HD11)
    or (segid "    " and resid   24 and name HG13) (segid "    " and resid   28 and name HD13)
assign (segid "    " and resid   24 and name HG22) (segid "    " and resid   42 and name HD22) 3.005 1.083 1.083 ! spec=C13NOESY, no=166, id=380
assign (segid "    " and resid   24 and name HG22) (segid "    " and resid   42 and name   HG) 3.191 1.222 1.222 ! spec=C13NOESY, no=167, id=381
assign (segid "    " and resid   32 and name  HG2) (segid "    " and resid   32 and name  HB2) 1.980 0.471 0.471 ! spec=C13NOESY, no=168, id=382
assign (segid "    " and resid   24 and name HG12) (segid "    " and resid   21 and name   HA) 4.408 2.332 2.332 ! spec=C13NOESY, no=171, id=384
assign (segid "    " and resid   24 and name HG12) (segid "    " and resid   24 and name   HA) 3.330 1.331 1.331 ! spec=C13NOESY, no=172, id=385
assign (segid "    " and resid   24 and name HG12) (segid "    " and resid   15 and name  HG1) 4.411 2.334 2.334 ! spec=C13NOESY, no=173, id=386
assign (segid "    " and resid   24 and name HG12) (segid "    " and resid   11 and name   HA) 3.323 1.325 1.325 ! spec=C13NOESY, no=174, id=387
assign (segid "    " and resid   24 and name HG12) (segid "    " and resid   25 and name  HE2) 4.409 2.333 2.333 ! spec=C13NOESY, no=175, id=388
assign (segid "    " and resid   24 and name HG12) (segid "    " and resid   14 and name   HG) 3.809 1.741 1.741 ! spec=C13NOESY, no=178, id=390
assign (segid "    " and resid   24 and name HG12) (segid "    " and resid   27 and name  HB2) 3.800 1.732 1.732 ! spec=C13NOESY, no=179, id=391
assign (segid "    " and resid   24 and name HG12) (segid "    " and resid   28 and name HD12) 3.328 1.329 1.329 ! spec=C13NOESY, no=181, id=392
assign (segid "    " and resid   24 and name HG12) (segid "    " and resid   42 and name HD22) 5.063 3.076 3.076 ! spec=C13NOESY, no=182, id=393
assign (segid "    " and resid   24 and name HG12) (segid "    " and resid   42 and name   HG) 4.228 2.146 2.146 ! spec=C13NOESY, no=183, id=394
assign (segid "    " and resid   25 and name  HG2) (segid "    " and resid   25 and name  HB2) 2.815 0.951 0.951 ! spec=C13NOESY, no=185, id=396
assign (segid "    " and resid   28 and name HD22) (segid "    " and resid   28 and name   HA) 3.096 1.150 1.150 ! spec=C13NOESY, no=188, id=397
assign (segid "    " and resid   25 and name  HG1) (segid "    " and resid   25 and name   HA) 2.154 0.557 0.557 ! spec=C13NOESY, no=190, id=398
assign (segid "    " and resid   28 and name HD22) (segid "    " and resid   35 and name   HA) 3.021 1.095 1.095 ! spec=C13NOESY, no=191, id=399
assign (segid "    " and resid   28 and name HD22) (segid "    " and resid   33 and name  HB2) 4.309 2.229 2.229 ! spec=C13NOESY, no=192, id=400
assign (segid "    " and resid   25 and name  HG1) (segid "    " and resid   25 and name  HE2) 4.537 2.471 2.471 ! spec=C13NOESY, no=193, id=401
assign (segid "    " and resid   28 and name HD22) (segid "    " and resid   33 and name  HB1) 5.026 3.031 3.031 ! spec=C13NOESY, no=194, id=402
assign (segid "    " and resid   28 and name HD22) (segid "    " and resid   28 and name  HB1) 2.783 0.930 0.930 ! spec=C13NOESY, no=197, id=403
assign (segid "    " and resid   28 and name HD22) (segid "    " and resid   28 and name   HG) 2.780 0.927 0.927 ! spec=C13NOESY, no=198, id=404
assign (segid "    " and resid   25 and name  HG1) (segid "    " and resid   25 and name  HB2) 2.929 1.030 1.030 ! spec=C13NOESY, no=199, id=405
assign (segid "    " and resid   25 and name  HG2) (segid "    " and resid   25 and name  HG1) 1.467 0.258 0.258 ! spec=C13NOESY, no=200, id=406
assign (segid "    " and resid   13 and name  HG2) (segid "    " and resid   13 and name   HA) 3.572 1.531 1.531 ! spec=C13NOESY, no=203, id=407
assign (segid "    " and resid   13 and name  HG2) (segid "    " and resid   10 and name  HE2) 2.774 0.923 0.923 ! spec=C13NOESY, no=204, id=408
assign (segid "    " and resid   13 and name  HG2) (segid "    " and resid   13 and name  HB2) 2.873 0.990 0.990 ! spec=C13NOESY, no=206, id=410
assign (segid "    " and resid   13 and name  HD2) (segid "    " and resid   13 and name  HG2) 2.662 0.850 0.850 ! spec=C13NOESY, no=207, id=411
assign (segid "    " and resid   13 and name  HG2) (segid "    " and resid   35 and name HG22) 2.984 1.068 1.068 ! spec=C13NOESY, no=211, id=414
assign (segid "    " and resid    4 and name HD22) (segid "    " and resid    4 and name   HA) 3.843 1.772 1.772 ! spec=C13NOESY, no=214, id=416
assign (segid "    " and resid    4 and name HD22) (segid "    " and resid    5 and name  HB2) 5.102 3.124 3.124 ! spec=C13NOESY, no=215, id=417
assign (segid "    " and resid    4 and name HD22) (segid "    " and resid    4 and name  HB1) 3.496 1.467 1.467 ! spec=C13NOESY, no=216, id=418
assign (segid "    " and resid   35 and name HG12) (segid "    " and resid   34 and name  HB2) 3.864 1.792 1.792 ! spec=C13NOESY, no=222, id=421
assign (segid "    " and resid   35 and name HG12) (segid "    " and resid   14 and name HD12) 3.515 1.483 1.483 ! spec=C13NOESY, no=228, id=424
assign (segid "    " and resid   35 and name HG12) (segid "    " and resid   28 and name HD22) 3.491 1.463 1.463 ! spec=C13NOESY, no=229, id=425
assign (segid "    " and resid   42 and name HD22) (segid "    " and resid   19 and name  HB2) 4.258 2.175 2.175 ! spec=C13NOESY, no=232, id=428
assign (segid "    " and resid   42 and name HD22) (segid "    " and resid   19 and name  HB1) 3.381 1.372 1.372 ! spec=C13NOESY, no=233, id=429
assign (segid "    " and resid   42 and name HD22) (segid "    " and resid   42 and name   HG) 2.202 0.582 0.582 ! spec=C13NOESY, no=239, id=430
assign (segid "    " and resid   14 and name HD22) (segid "    " and resid   14 and name   HA) 3.222 1.246 1.246 ! spec=C13NOESY, no=240, id=431
assign (segid "    " and resid   14 and name HD22) (segid "    " and resid   23 and name   HA) 4.875 2.852 2.852 ! spec=C13NOESY, no=241, id=432
assign (segid "    " and resid   16 and name  HA1) (segid "    " and resid   16 and name  HA2) 2.006 0.483 0.483 ! spec=C13NOESY, no=242, id=433
assign (segid "    " and resid   14 and name HD22) (segid "    " and resid   11 and name   HA) 3.967 1.889 1.889 ! spec=C13NOESY, no=244, id=434
assign (segid "    " and resid   14 and name HD22) (segid "    " and resid   24 and name   HA) 3.980 1.901 1.901 ! spec=C13NOESY, no=245, id=435
assign (segid "    " and resid   14 and name HD22) (segid "    " and resid   17 and name  HB1) 4.112 2.029 2.029 ! spec=C13NOESY, no=246, id=436
assign (segid "    " and resid   14 and name HD22) (segid "    " and resid   42 and name HD22) 4.274 2.193 2.193 ! spec=C13NOESY, no=256, id=442
assign (segid "    " and resid    7 and name HG12) (segid "    " and resid    7 and name   HA) 1.983 0.472 0.472 ! spec=C13NOESY, no=260, id=444
assign (segid "    " and resid    7 and name HG12) (segid "    " and resid   33 and name  HB2) 4.367 2.289 2.289 ! spec=C13NOESY, no=263, id=447
assign (segid "    " and resid    7 and name HG12) (segid "    " and resid   33 and name  HB1) 4.446 2.372 2.372 ! spec=C13NOESY, no=265, id=449
assign (segid "    " and resid   35 and name HG22) (segid "    " and resid   39 and name  HG2) 2.582 0.800 0.800 ! spec=C13NOESY, no=275, id=454
assign (segid "    " and resid   35 and name HG22) (segid "    " and resid   35 and name   HA) 2.208 0.585 0.585 ! spec=C13NOESY, no=281, id=457
assign (segid "    " and resid   31 and name  HB2) (segid "    " and resid   34 and name  HB1) 4.079 1.997 1.997 ! spec=C13NOESY, no=288, id=460
    or (segid "    " and resid   31 and name  HB1) (segid "    " and resid   34 and name  HB1)
    or (segid "    " and resid   31 and name  HB3) (segid "    " and resid   34 and name  HB1)
assign (segid "    " and resid   31 and name  HB2) (segid "    " and resid   32 and name  HG2) 4.337 2.257 2.257 ! spec=C13NOESY, no=290, id=462
assign (segid "    " and resid   20 and name  HB2) (segid "    " and resid   23 and name  HG2) 2.843 0.970 0.970 ! spec=C13NOESY, no=295, id=465
assign (segid "    " and resid   20 and name  HB2) (segid "    " and resid   23 and name  HG1) 3.464 1.440 1.440 ! spec=C13NOESY, no=296, id=466
assign (segid "    " and resid   43 and name  HB2) (segid "    " and resid   43 and name  HD2) 1.918 0.442 0.442 ! spec=C13NOESY, no=302, id=468
assign (segid "    " and resid   26 and name  HB2) (segid "    " and resid   26 and name  HD1) 1.921 0.443 0.443 ! spec=C13NOESY, no=310, id=471
assign (segid "    " and resid   26 and name  HD1) (segid "    " and resid   26 and name  HG2) 1.927 0.446 0.446 ! spec=C13NOESY, no=311, id=472
assign (segid "    " and resid   24 and name   HA) (segid "    " and resid   25 and name  HD1) 3.999 1.919 1.919 ! spec=C13NOESY, no=312, id=473
assign (segid "    " and resid   43 and name  HD2) (segid "    " and resid   43 and name   HA) 2.211 0.587 0.587 ! spec=C13NOESY, no=314, id=474
assign (segid "    " and resid   43 and name  HD2) (segid "    " and resid   43 and name  HG2) 1.951 0.457 0.457 ! spec=C13NOESY, no=316, id=476
assign (segid "    " and resid   42 and name HD22) (segid "    " and resid   24 and name   HA) 3.216 1.241 1.241 ! spec=C13NOESY, no=320, id=478
assign (segid "    " and resid   24 and name   HA) (segid "    " and resid   42 and name   HG) 3.207 1.234 1.234 ! spec=C13NOESY, no=321, id=479
assign (segid "    " and resid   39 and name  HD2) (segid "    " and resid   39 and name  HG2) 1.942 0.452 0.452 ! spec=C13NOESY, no=323, id=480
assign (segid "    " and resid   14 and name   HG) (segid "    " and resid   14 and name  HB2) 2.365 0.671 0.671 ! spec=C13NOESY, no=328, id=483
assign (segid "    " and resid   14 and name  HB1) (segid "    " and resid   14 and name   HG) 3.790 1.724 1.724 ! spec=C13NOESY, no=329, id=484
assign (segid "    " and resid   14 and name  HB1) (segid "    " and resid   11 and name HG22) 2.941 1.038 1.038 ! spec=C13NOESY, no=332, id=486
assign (segid "    " and resid   14 and name HD22) (segid "    " and resid   14 and name  HB2) 3.084 1.141 1.141 ! spec=C13NOESY, no=333, id=487
assign (segid "    " and resid   14 and name HD22) (segid "    " and resid   14 and name  HB1) 2.961 1.052 1.052 ! spec=C13NOESY, no=334, id=488
assign (segid "    " and resid    9 and name   HA) (segid "    " and resid    9 and name  HB2) 2.480 0.738 0.738 ! spec=C13NOESY, no=335, id=489
assign (segid "    " and resid    9 and name  HB2) (segid "    " and resid   10 and name   HA) 4.691 2.641 2.641 ! spec=C13NOESY, no=336, id=490
assign (segid "    " and resid    9 and name  HB2) (segid "    " and resid    8 and name  HB2) 3.496 1.467 1.467 ! spec=C13NOESY, no=340, id=493
assign (segid "    " and resid    9 and name  HB2) (segid "    " and resid    5 and name  HG1) 4.332 2.252 2.252 ! spec=C13NOESY, no=341, id=494
assign (segid "    " and resid    9 and name  HB2) (segid "    " and resid   13 and name  HB2) 3.730 1.669 1.669 ! spec=C13NOESY, no=342, id=495
assign (segid "    " and resid   35 and name HG12) (segid "    " and resid   35 and name   HA) 2.698 0.874 0.874 ! spec=C13NOESY, no=349, id=498
assign (segid "    " and resid    4 and name  HB2) (segid "    " and resid    4 and name   HA) 3.993 1.913 1.913 ! spec=C13NOESY, no=352, id=499
assign (segid "    " and resid    4 and name  HB1) (segid "    " and resid    4 and name   HA) 4.283 2.201 2.201 ! spec=C13NOESY, no=353, id=500
assign (segid "    " and resid   10 and name  HE2) (segid "    " and resid   10 and name   HA) 3.537 1.501 1.501 ! spec=C13NOESY, no=356, id=502
assign (segid "    " and resid   10 and name  HE1) (segid "    " and resid   10 and name   HA) 2.868 0.987 0.987 ! spec=C13NOESY, no=357, id=503
assign (segid "    " and resid   38 and name  HB2) (segid "    " and resid   14 and name   HG) 3.993 1.913 1.913 ! spec=C13NOESY, no=366, id=507
assign (segid "    " and resid    4 and name  HB1) (segid "    " and resid    4 and name  HB2) 1.489 0.266 0.266 ! spec=C13NOESY, no=368, id=508
assign (segid "    " and resid   10 and name  HB1) (segid "    " and resid   10 and name  HE2) 1.940 0.452 0.452 ! spec=C13NOESY, no=369, id=509
assign (segid "    " and resid   10 and name  HE2) (segid "    " and resid   10 and name  HG2) 2.871 0.989 0.989 ! spec=C13NOESY, no=371, id=510
assign (segid "    " and resid   10 and name  HG2) (segid "    " and resid   10 and name  HE1) 2.908 1.015 1.015 ! spec=C13NOESY, no=372, id=511
assign (segid "    " and resid    4 and name  HB1) (segid "    " and resid    4 and name HD12) 3.925 1.848 1.848 ! spec=C13NOESY, no=375, id=513
assign (segid "    " and resid   38 and name  HB2) (segid "    " and resid   42 and name   HG) 4.252 2.169 2.169 ! spec=C13NOESY, no=379, id=514
assign (segid "    " and resid   12 and name  HB2) (segid "    " and resid   12 and name   HA) 2.448 0.719 0.719 ! spec=C13NOESY, no=380, id=515
assign (segid "    " and resid   11 and name HG22) (segid "    " and resid    8 and name   HA) 4.494 2.423 2.423 ! spec=C13NOESY, no=384, id=517
assign (segid "    " and resid   11 and name HG22) (segid "    " and resid   15 and name  HG1) 3.445 1.424 1.424 ! spec=C13NOESY, no=394, id=524
assign (segid "    " and resid   13 and name  HE1) (segid "    " and resid   13 and name  HB2) 4.466 2.393 2.393 ! spec=C13NOESY, no=395, id=525
assign (segid "    " and resid   13 and name  HE2) (segid "    " and resid   13 and name  HB2) 4.708 2.659 2.659 ! spec=C13NOESY, no=396, id=526
assign (segid "    " and resid   11 and name HG22) (segid "    " and resid   11 and name   HB) 3.177 1.211 1.211 ! spec=C13NOESY, no=397, id=527
assign (segid "    " and resid   37 and name   HB) (segid "    " and resid   37 and name   HA) 3.838 1.768 1.768 ! spec=C13NOESY, no=398, id=528
assign (segid "    " and resid   13 and name  HD2) (segid "    " and resid   13 and name  HE2) 1.907 0.436 0.436 ! spec=C13NOESY, no=399, id=529
assign (segid "    " and resid   13 and name  HD2) (segid "    " and resid   13 and name  HE1) 2.756 0.912 0.912 ! spec=C13NOESY, no=400, id=530
assign (segid "    " and resid   13 and name  HE2) (segid "    " and resid   13 and name  HG2) 1.886 0.427 0.427 ! spec=C13NOESY, no=402, id=532
assign (segid "    " and resid   13 and name  HG2) (segid "    " and resid   13 and name  HE1) 2.840 0.968 0.968 ! spec=C13NOESY, no=403, id=533
assign (segid "    " and resid   37 and name HG12) (segid "    " and resid   37 and name   HA) 3.085 1.142 1.142 ! spec=C13NOESY, no=404, id=534
assign (segid "    " and resid   25 and name  HE2) (segid "    " and resid   25 and name   HA) 4.633 2.575 2.575 ! spec=C13NOESY, no=407, id=535
assign (segid "    " and resid   25 and name  HE1) (segid "    " and resid   25 and name   HA) 4.742 2.698 2.698 ! spec=C13NOESY, no=408, id=536
assign (segid "    " and resid   25 and name  HE1) (segid "    " and resid   25 and name  HE2) 1.914 0.440 0.440 ! spec=C13NOESY, no=410, id=537
assign (segid "    " and resid   25 and name  HD2) (segid "    " and resid   25 and name  HE2) 2.830 0.961 0.961 ! spec=C13NOESY, no=417, id=543
assign (segid "    " and resid   25 and name  HE1) (segid "    " and resid   25 and name  HB2) 3.643 1.593 1.593 ! spec=C13NOESY, no=418, id=544
assign (segid "    " and resid   25 and name  HG2) (segid "    " and resid   25 and name  HE2) 3.665 1.611 1.611 ! spec=C13NOESY, no=419, id=545
assign (segid "    " and resid   25 and name  HE1) (segid "    " and resid   25 and name  HG2) 3.809 1.741 1.741 ! spec=C13NOESY, no=420, id=546
assign (segid "    " and resid   28 and name  HB2) (segid "    " and resid   29 and name   HA) 4.119 2.036 2.036 ! spec=C13NOESY, no=423, id=549
assign (segid "    " and resid   28 and name  HB1) (segid "    " and resid   29 and name   HA) 4.057 1.975 1.975 ! spec=C13NOESY, no=424, id=550
assign (segid "    " and resid   28 and name  HB1) (segid "    " and resid   28 and name   HA) 3.606 1.561 1.561 ! spec=C13NOESY, no=425, id=551
assign (segid "    " and resid   28 and name  HB1) (segid "    " and resid   28 and name  HB2) 2.424 0.705 0.705 ! spec=C13NOESY, no=432, id=554
assign (segid "    " and resid   28 and name HD12) (segid "    " and resid   28 and name  HB2) 2.678 0.860 0.860 ! spec=C13NOESY, no=436, id=557
assign (segid "    " and resid   30 and name   HA) (segid "    " and resid   29 and name  HB2) 4.766 2.726 2.726 ! spec=C13NOESY, no=440, id=559
assign (segid "    " and resid   30 and name   HA) (segid "    " and resid   30 and name   HB) 3.474 1.448 1.448 ! spec=C13NOESY, no=441, id=560
assign (segid "    " and resid   30 and name   HA) (segid "    " and resid   30 and name HG11) 1.999 0.479 0.479 ! spec=C13NOESY, no=442, id=561
assign (segid "    " and resid   30 and name HG22) (segid "    " and resid   30 and name   HA) 2.025 0.492 0.492 ! spec=C13NOESY, no=444, id=563
assign (segid "    " and resid    7 and name   HA) (segid "    " and resid   10 and name  HE1) 4.622 2.563 2.563 ! spec=C13NOESY, no=446, id=565
assign (segid "    " and resid    7 and name   HB) (segid "    " and resid    7 and name   HA) 3.507 1.476 1.476 ! spec=C13NOESY, no=447, id=566
assign (segid "    " and resid    7 and name   HA) (segid "    " and resid   10 and name  HB1) 3.557 1.518 1.518 ! spec=C13NOESY, no=448, id=567
assign (segid "    " and resid    7 and name   HA) (segid "    " and resid   10 and name  HG2) 4.559 2.494 2.494 ! spec=C13NOESY, no=449, id=568
assign (segid "    " and resid   11 and name HG22) (segid "    " and resid   11 and name   HA) 2.759 0.913 0.913 ! spec=C13NOESY, no=457, id=573
assign (segid "    " and resid    8 and name  HB2) (segid "    " and resid   11 and name HD12) 3.554 1.516 1.516 ! spec=C13NOESY, no=458, id=574
assign (segid "    " and resid   11 and name HG11) (segid "    " and resid   11 and name   HA) 2.053 0.506 0.506 ! spec=C13NOESY, no=459, id=575
assign (segid "    " and resid   42 and name  HB2) (segid "    " and resid   39 and name   HA) 2.420 0.702 0.702 ! spec=C13NOESY, no=461, id=577
assign (segid "    " and resid   42 and name  HB1) (segid "    " and resid   42 and name HD22) 3.751 1.688 1.688 ! spec=C13NOESY, no=464, id=578
assign (segid "    " and resid    9 and name  HB2) (segid "    " and resid    6 and name  HB2) 4.178 2.095 2.095 ! spec=C13NOESY, no=492, id=596
assign (segid "    " and resid   31 and name  HB2) (segid "    " and resid   34 and name  HB1) 4.201 2.117 2.117 ! spec=C13NOESY, no=493, id=597
assign (segid "    " and resid   37 and name HG12) (segid "    " and resid   34 and name  HB2) 3.650 1.599 1.599 ! spec=C13NOESY, no=495, id=598
assign (segid "    " and resid   37 and name HG12) (segid "    " and resid   34 and name  HB1) 3.742 1.681 1.681 ! spec=C13NOESY, no=496, id=599
assign (segid "    " and resid    6 and name  HB2) (segid "    " and resid    7 and name HG12) 4.821 2.789 2.789 ! spec=C13NOESY, no=497, id=600
assign (segid "    " and resid   30 and name HD12) (segid "    " and resid   31 and name   HA) 4.497 2.427 2.427 ! spec=C13NOESY, no=498, id=601
assign (segid "    " and resid   30 and name HD12) (segid "    " and resid   30 and name   HA) 3.786 1.720 1.720 ! spec=C13NOESY, no=500, id=603
assign (segid "    " and resid   21 and name  HB2) (segid "    " and resid   21 and name   HA) 3.600 1.555 1.555 ! spec=C13NOESY, no=501, id=604
assign (segid "    " and resid   21 and name  HB1) (segid "    " and resid   21 and name   HA) 3.616 1.569 1.569 ! spec=C13NOESY, no=502, id=605
assign (segid "    " and resid   21 and name   HA) (segid "    " and resid   25 and name  HE1) 4.034 1.953 1.953 ! spec=C13NOESY, no=503, id=606
assign (segid "    " and resid   21 and name   HA) (segid "    " and resid   24 and name   HB) 2.189 0.575 0.575 ! spec=C13NOESY, no=505, id=607
assign (segid "    " and resid   30 and name HD12) (segid "    " and resid   30 and name   HB) 3.129 1.175 1.175 ! spec=C13NOESY, no=507, id=608
assign (segid "    " and resid   30 and name HD12) (segid "    " and resid   26 and name  HG2) 3.400 1.387 1.387 ! spec=C13NOESY, no=508, id=609
assign (segid "    " and resid   11 and name   HB) (segid "    " and resid   11 and name   HA) 3.357 1.352 1.352 ! spec=C13NOESY, no=516, id=614
assign (segid "    " and resid   30 and name HG22) (segid "    " and resid   30 and name   HB) 3.069 1.130 1.130 ! spec=C13NOESY, no=521, id=616
assign (segid "    " and resid   11 and name HD12) (segid "    " and resid    8 and name   HA) 3.828 1.759 1.759 ! spec=C13NOESY, no=526, id=617
assign (segid "    " and resid   11 and name HD12) (segid "    " and resid   11 and name   HA) 3.795 1.728 1.728 ! spec=C13NOESY, no=527, id=618
assign (segid "    " and resid   11 and name HD12) (segid "    " and resid   11 and name   HB) 3.383 1.373 1.373 ! spec=C13NOESY, no=529, id=620
assign (segid "    " and resid   11 and name HD12) (segid "    " and resid   11 and name HG12) 3.207 1.234 1.234 ! spec=C13NOESY, no=530, id=621
assign (segid "    " and resid   11 and name HD12) (segid "    " and resid   25 and name  HD2) 3.790 1.724 1.724 ! spec=C13NOESY, no=531, id=622
assign (segid "    " and resid   11 and name HD12) (segid "    " and resid   25 and name  HG2) 3.537 1.501 1.501 ! spec=C13NOESY, no=532, id=623
assign (segid "    " and resid   17 and name  HG1) (segid "    " and resid   17 and name   HA) 2.150 0.555 0.555 ! spec=C13NOESY, no=537, id=626
assign (segid "    " and resid   36 and name  HG2) (segid "    " and resid   36 and name   HA) 3.431 1.412 1.412 ! spec=C13NOESY, no=538, id=627
assign (segid "    " and resid   17 and name  HG1) (segid "    " and resid   17 and name  HG2) 2.809 0.947 0.947 ! spec=C13NOESY, no=541, id=629
assign (segid "    " and resid   36 and name  HG2) (segid "    " and resid   35 and name HG22) 3.853 1.782 1.782 ! spec=C13NOESY, no=543, id=630
assign (segid "    " and resid   33 and name   HA) (segid "    " and resid   33 and name  HB2) 3.623 1.575 1.575 ! spec=C13NOESY, no=545, id=632
assign (segid "    " and resid   33 and name  HB1) (segid "    " and resid   33 and name  HB2) 2.468 0.731 0.731 ! spec=C13NOESY, no=549, id=635
assign (segid "    " and resid   33 and name  HB2) (segid "    " and resid   10 and name  HD1) 4.549 2.483 2.483 ! spec=C13NOESY, no=553, id=637
assign (segid "    " and resid   22 and name   HA) (segid "    " and resid   25 and name  HE2) 5.036 3.043 3.043 ! spec=C13NOESY, no=555, id=638
assign (segid "    " and resid   22 and name   HA) (segid "    " and resid   22 and name  HG1) 3.566 1.526 1.526 ! spec=C13NOESY, no=556, id=639
assign (segid "    " and resid   39 and name   HA) (segid "    " and resid   39 and name  HD2) 4.635 2.578 2.578 ! spec=C13NOESY, no=560, id=641
assign (segid "    " and resid   10 and name   HA) (segid "    " and resid   10 and name  HB2) 3.396 1.384 1.384 ! spec=C13NOESY, no=562, id=643
assign (segid "    " and resid   39 and name  HB2) (segid "    " and resid   39 and name   HA) 2.424 0.705 0.705 ! spec=C13NOESY, no=563, id=644
assign (segid "    " and resid   10 and name   HA) (segid "    " and resid   10 and name  HD2) 2.972 1.060 1.060 ! spec=C13NOESY, no=564, id=645
assign (segid "    " and resid   10 and name   HA) (segid "    " and resid   10 and name  HB1) 2.970 1.059 1.059 ! spec=C13NOESY, no=565, id=646
assign (segid "    " and resid   39 and name  HG2) (segid "    " and resid   39 and name   HA) 2.241 0.603 0.603 ! spec=C13NOESY, no=566, id=647
assign (segid "    " and resid   10 and name  HG2) (segid "    " and resid   10 and name   HA) 2.981 1.067 1.067 ! spec=C13NOESY, no=567, id=648
assign (segid "    " and resid   39 and name   HA) (segid "    " and resid   42 and name  HB1) 2.347 0.661 0.661 ! spec=C13NOESY, no=568, id=649
assign (segid "    " and resid   10 and name   HA) (segid "    " and resid   11 and name HG11) 4.526 2.458 2.458 ! spec=C13NOESY, no=570, id=650
assign (segid "    " and resid   25 and name   HA) (segid "    " and resid   28 and name  HB1) 1.965 0.464 0.464 ! spec=C13NOESY, no=572, id=651
assign (segid "    " and resid   25 and name   HA) (segid "    " and resid   25 and name  HB2) 2.333 0.653 0.653 ! spec=C13NOESY, no=573, id=652
assign (segid "    " and resid   25 and name   HA) (segid "    " and resid   25 and name  HB1) 2.512 0.757 0.757 ! spec=C13NOESY, no=574, id=653
assign (segid "    " and resid   25 and name   HA) (segid "    " and resid   24 and name HG12) 2.651 0.843 0.843 ! spec=C13NOESY, no=575, id=654
    or (segid "    " and resid   25 and name   HA) (segid "    " and resid   24 and name HG11)
    or (segid "    " and resid   25 and name   HA) (segid "    " and resid   24 and name HG13)
assign (segid "    " and resid   36 and name   HA) (segid "    " and resid   36 and name  HB1) 2.080 0.519 0.519 ! spec=C13NOESY, no=579, id=656
assign (segid "    " and resid   36 and name   HA) (segid "    " and resid   39 and name  HG2) 4.417 2.341 2.341 ! spec=C13NOESY, no=580, id=657
assign (segid "    " and resid   36 and name   HA) (segid "    " and resid   35 and name HG22) 3.885 1.811 1.811 ! spec=C13NOESY, no=581, id=658
assign (segid "    " and resid   15 and name   HA) (segid "    " and resid   15 and name  HG2) 3.069 1.130 1.130 ! spec=C13NOESY, no=585, id=660
assign (segid "    " and resid   15 and name   HA) (segid "    " and resid   15 and name  HG1) 3.116 1.165 1.165 ! spec=C13NOESY, no=586, id=661
assign (segid "    " and resid   15 and name   HA) (segid "    " and resid   15 and name  HB2) 3.130 1.176 1.176 ! spec=C13NOESY, no=587, id=662
assign (segid "    " and resid   15 and name   HA) (segid "    " and resid   15 and name  HB1) 3.076 1.136 1.136 ! spec=C13NOESY, no=588, id=663
assign (segid "    " and resid   24 and name HG22) (segid "    " and resid   15 and name   HA) 3.874 1.801 1.801 ! spec=C13NOESY, no=589, id=664
assign (segid "    " and resid   13 and name  HB2) (segid "    " and resid   13 and name   HA) 1.982 0.471 0.471 ! spec=C13NOESY, no=595, id=666
assign (segid "    " and resid   13 and name  HD2) (segid "    " and resid   13 and name   HA) 2.091 0.525 0.525 ! spec=C13NOESY, no=597, id=667
assign (segid "    " and resid   23 and name   HA) (segid "    " and resid   27 and name  HB2) 4.948 2.938 2.938 ! spec=C13NOESY, no=600, id=668
assign (segid "    " and resid   28 and name   HA) (segid "    " and resid   29 and name   HA) 4.073 1.991 1.991 ! spec=C13NOESY, no=602, id=669
assign (segid "    " and resid   26 and name  HB2) (segid "    " and resid   26 and name   HA) 2.203 0.582 0.582 ! spec=C13NOESY, no=606, id=671
assign (segid "    " and resid   28 and name   HA) (segid "    " and resid   28 and name   HG) 2.981 1.067 1.067 ! spec=C13NOESY, no=608, id=672
assign (segid "    " and resid   19 and name  HB2) (segid "    " and resid   19 and name   HA) 3.672 1.618 1.618 ! spec=C13NOESY, no=614, id=676
assign (segid "    " and resid   14 and name   HA) (segid "    " and resid   17 and name  HG2) 4.210 2.127 2.127 ! spec=C13NOESY, no=615, id=677
assign (segid "    " and resid   14 and name   HA) (segid "    " and resid   17 and name  HB1) 3.804 1.737 1.737 ! spec=C13NOESY, no=616, id=678
assign (segid "    " and resid   19 and name  HB1) (segid "    " and resid   19 and name   HA) 3.730 1.669 1.669 ! spec=C13NOESY, no=617, id=679
assign (segid "    " and resid   14 and name  HB2) (segid "    " and resid   14 and name   HA) 3.751 1.688 1.688 ! spec=C13NOESY, no=619, id=680
assign (segid "    " and resid   14 and name   HG) (segid "    " and resid   14 and name   HA) 3.819 1.750 1.750 ! spec=C13NOESY, no=620, id=681
assign (segid "    " and resid   14 and name  HB1) (segid "    " and resid   14 and name   HA) 3.189 1.220 1.220 ! spec=C13NOESY, no=621, id=682
assign (segid "    " and resid   10 and name  HB1) (segid "    " and resid   10 and name  HD2) 2.850 0.975 0.975 ! spec=C13NOESY, no=627, id=686
assign (segid "    " and resid   42 and name  HB2) (segid "    " and resid   42 and name   HA) 3.045 1.113 1.113 ! spec=C13NOESY, no=631, id=688
assign (segid "    " and resid   10 and name  HB1) (segid "    " and resid   35 and name HG12) 3.438 1.418 1.418 ! spec=C13NOESY, no=634, id=691
assign (segid "    " and resid   10 and name  HB2) (segid "    " and resid   11 and name HG11) 3.828 1.759 1.759 ! spec=C13NOESY, no=636, id=692
assign (segid "    " and resid   10 and name  HB1) (segid "    " and resid   11 and name HG11) 3.742 1.681 1.681 ! spec=C13NOESY, no=637, id=693
assign (segid "    " and resid   42 and name HD22) (segid "    " and resid   42 and name   HA) 3.275 1.287 1.287 ! spec=C13NOESY, no=638, id=694
assign (segid "    " and resid   42 and name  HB1) (segid "    " and resid   42 and name   HA) 2.989 1.072 1.072 ! spec=C13NOESY, no=639, id=695
assign (segid "    " and resid    8 and name  HB2) (segid "    " and resid    8 and name   HA) 3.217 1.242 1.242 ! spec=C13NOESY, no=641, id=696
assign (segid "    " and resid   11 and name   HB) (segid "    " and resid    8 and name   HA) 2.044 0.501 0.501 ! spec=C13NOESY, no=642, id=697
assign (segid "    " and resid   15 and name  HB1) (segid "    " and resid   12 and name   HA) 2.118 0.538 0.538 ! spec=C13NOESY, no=651, id=701
assign (segid "    " and resid   32 and name  HG2) (segid "    " and resid   32 and name   HA) 2.772 0.922 0.922 ! spec=C13NOESY, no=662, id=706
assign (segid "    " and resid   32 and name   HA) (segid "    " and resid   32 and name  HB2) 2.822 0.956 0.956 ! spec=C13NOESY, no=663, id=707
assign (segid "    " and resid    5 and name  HB1) (segid "    " and resid    5 and name   HA) 2.018 0.489 0.489 ! spec=C13NOESY, no=665, id=708
assign (segid "    " and resid   34 and name  HB2) (segid "    " and resid   37 and name   HB) 3.286 1.296 1.296 ! spec=C13NOESY, no=667, id=710
assign (segid "    " and resid   34 and name  HB1) (segid "    " and resid   37 and name   HB) 3.777 1.712 1.712 ! spec=C13NOESY, no=668, id=711
assign (segid "    " and resid   17 and name  HG2) (segid "    " and resid   17 and name   HA) 2.087 0.523 0.523 ! spec=C13NOESY, no=669, id=712
assign (segid "    " and resid   37 and name HG12) (segid "    " and resid   37 and name   HB) 1.957 0.460 0.460 ! spec=C13NOESY, no=670, id=713
assign (segid "    " and resid   13 and name  HB2) (segid "    " and resid   10 and name   HA) 2.212 0.587 0.587 ! spec=C13NOESY, no=674, id=717
assign (segid "    " and resid   35 and name   HB) (segid "    " and resid   35 and name   HA) 3.718 1.659 1.659 ! spec=C13NOESY, no=676, id=719
assign (segid "    " and resid   15 and name  HG1) (segid "    " and resid   15 and name  HG2) 2.006 0.483 0.483 ! spec=C13NOESY, no=679, id=721
assign (segid "    " and resid   15 and name  HB1) (segid "    " and resid   15 and name  HG1) 2.690 0.868 0.868 ! spec=C13NOESY, no=682, id=722
assign (segid "    " and resid   13 and name  HD2) (segid "    " and resid   13 and name  HB2) 3.091 1.147 1.147 ! spec=C13NOESY, no=684, id=724
assign (segid "    " and resid   35 and name HG12) (segid "    " and resid   35 and name   HB) 1.949 0.456 0.456 ! spec=C13NOESY, no=686, id=726
assign (segid "    " and resid   11 and name HG22) (segid "    " and resid   15 and name  HG2) 3.786 1.720 1.720 ! spec=C13NOESY, no=687, id=727
assign (segid "    " and resid   35 and name HG22) (segid "    " and resid   35 and name   HB) 2.023 0.491 0.491 ! spec=C13NOESY, no=688, id=728
assign (segid "    " and resid   25 and name  HG1) (segid "    " and resid   25 and name  HD2) 1.968 0.465 0.465 ! spec=C13NOESY, no=695, id=733
assign (segid "    " and resid   25 and name  HB1) (segid "    " and resid   25 and name  HB2) 2.555 0.784 0.784 ! spec=C13NOESY, no=696, id=734
assign (segid "    " and resid   25 and name  HG1) (segid "    " and resid   25 and name  HB1) 1.982 0.471 0.471 ! spec=C13NOESY, no=698, id=735
assign (segid "    " and resid   27 and name  HB2) (segid "    " and resid   27 and name   HA) 3.243 1.262 1.262 ! spec=C13NOESY, no=702, id=737
assign (segid "    " and resid   30 and name HD12) (segid "    " and resid   27 and name   HA) 3.353 1.349 1.349 ! spec=C13NOESY, no=703, id=738
assign (segid "    " and resid   24 and name   HA) (segid "    " and resid   24 and name   HB) 3.413 1.398 1.398 ! spec=C13NOESY, no=709, id=741
assign (segid "    " and resid   15 and name  HB2) (segid "    " and resid   12 and name   HA) 2.834 0.964 0.964 ! spec=C13NOESY, no=710, id=742
assign (segid "    " and resid   24 and name HG12) (segid "    " and resid   24 and name   HB) 1.999 0.479 0.479 ! spec=C13NOESY, no=714, id=745
assign (segid "    " and resid   11 and name HG22) (segid "    " and resid   12 and name   HA) 4.233 2.151 2.151 ! spec=C13NOESY, no=715, id=746
assign (segid "    " and resid   24 and name   HB) (segid "    " and resid   27 and name   HN) 3.702 1.645 1.645 ! spec=C13NOESY, no=717, id=748
assign (segid "    " and resid   28 and name HD22) (segid "    " and resid   28 and name  HB2) 2.089 0.523 0.523 ! spec=C13NOESY, no=722, id=753
assign (segid "    " and resid   25 and name  HG1) (segid "    " and resid   25 and name  HE1) 3.679 1.624 1.624 ! spec=C13NOESY, no=723, id=754
assign (segid "    " and resid   25 and name  HD2) (segid "    " and resid   25 and name   HA) 2.882 0.997 0.997 ! spec=C13NOESY, no=726, id=756
assign (segid "    " and resid   22 and name  HG1) (segid "    " and resid   22 and name  HB2) 3.885 1.811 1.811 ! spec=C13NOESY, no=728, id=757
assign (segid "    " and resid   29 and name  HB1) (segid "    " and resid   29 and name   HA) 2.373 0.676 0.676 ! spec=C13NOESY, no=731, id=758
assign (segid "    " and resid   24 and name HG22) (segid "    " and resid   24 and name HG12) 3.154 1.193 1.193 ! spec=C13NOESY, no=737, id=760
assign (segid "    " and resid   42 and name  HB2) (segid "    " and resid   42 and name HD22) 2.249 0.607 0.607 ! spec=C13NOESY, no=738, id=761
assign (segid "    " and resid   17 and name  HB1) (segid "    " and resid   17 and name   HA) 2.799 0.940 0.940 ! spec=C13NOESY, no=744, id=764
assign (segid "    " and resid   10 and name  HB2) (segid "    " and resid   10 and name  HD2) 2.733 0.896 0.896 ! spec=C13NOESY, no=746, id=765
assign (segid "    " and resid   10 and name  HE1) (segid "    " and resid   10 and name  HE2) 1.833 0.403 0.403 ! spec=C13NOESY, no=747, id=766
assign (segid "    " and resid   10 and name  HE2) (segid "    " and resid   10 and name  HD2) 1.912 0.439 0.439 ! spec=C13NOESY, no=748, id=767
assign (segid "    " and resid   10 and name  HE2) (segid "    " and resid   10 and name  HB2) 4.378 2.300 2.300 ! spec=C13NOESY, no=749, id=768
assign (segid "    " and resid   28 and name HD12) (segid "    " and resid   25 and name   HA) 3.361 1.355 1.355 ! spec=C13NOESY, no=755, id=770
assign (segid "    " and resid   28 and name HD12) (segid "    " and resid   28 and name   HA) 3.213 1.239 1.239 ! spec=C13NOESY, no=756, id=771
assign (segid "    " and resid   14 and name HD22) (segid "    " and resid   42 and name   HG) 2.960 1.051 1.051 ! spec=C13NOESY, no=758, id=773
assign (segid "    " and resid   46 and name  HB2) (segid "    " and resid   46 and name   HA) 2.344 0.659 0.659 ! spec=C13NOESY, no=760, id=774
assign (segid "    " and resid   43 and name  HD2) (segid "    " and resid   43 and name  HD1) 1.414 0.240 0.240 ! spec=C13NOESY, no=762, id=775
assign (segid "    " and resid   23 and name   HA) (segid "    " and resid   23 and name  HG1) 1.870 0.420 0.420 ! spec=C13NOESY, no=769, id=779
assign (segid "    " and resid   28 and name  HB2) (segid "    " and resid   28 and name   HA) 3.022 1.096 1.096 ! spec=C13NOESY, no=771, id=780
assign (segid "    " and resid    5 and name   HA) (segid "    " and resid    4 and name  HB1) 4.595 2.533 2.533 ! spec=C13NOESY, no=774, id=781
assign (segid "    " and resid   15 and name  HB2) (segid "    " and resid   15 and name  HG2) 3.018 1.093 1.093 ! spec=C13NOESY, no=775, id=782
assign (segid "    " and resid   15 and name  HB1) (segid "    " and resid   15 and name  HG2) 3.307 1.312 1.312 ! spec=C13NOESY, no=776, id=783
assign (segid "    " and resid   15 and name  HB2) (segid "    " and resid   15 and name  HG1) 3.240 1.259 1.259 ! spec=C13NOESY, no=777, id=784
assign (segid "    " and resid    7 and name HG12) (segid "    " and resid    7 and name   HB) 1.945 0.454 0.454 ! spec=C13NOESY, no=778, id=785
assign (segid "    " and resid   10 and name  HD1) (segid "    " and resid   10 and name   HA) 3.021 1.095 1.095 ! spec=C13NOESY, no=780, id=786
assign (segid "    " and resid   42 and name   HG) (segid "    " and resid   14 and name  HB1) 3.373 1.365 1.365 ! spec=C13NOESY, no=781, id=787
assign (segid "    " and resid    4 and name  HB2) (segid "    " and resid    4 and name HD22) 3.853 1.782 1.782 ! spec=C13NOESY, no=783, id=788
assign (segid "    " and resid    4 and name  HB2) (segid "    " and resid    4 and name HD12) 3.281 1.292 1.292 ! spec=C13NOESY, no=784, id=789
assign (segid "    " and resid   39 and name  HD1) (segid "    " and resid   39 and name  HB2) 1.941 0.452 0.452 ! spec=C13NOESY, no=789, id=791
assign (segid "    " and resid   39 and name  HD1) (segid "    " and resid   39 and name  HG2) 1.954 0.458 0.458 ! spec=C13NOESY, no=790, id=792
assign (segid "    " and resid   38 and name  HB2) (segid "    " and resid   38 and name   HA) 2.859 0.981 0.981 ! spec=C13NOESY, no=799, id=795
assign (segid "    " and resid   38 and name  HB2) (segid "    " and resid   35 and name   HA) 3.031 1.102 1.102 ! spec=C13NOESY, no=805, id=797
assign (segid "    " and resid   38 and name  HB2) (segid "    " and resid   35 and name   HB) 3.730 1.669 1.669 ! spec=C13NOESY, no=806, id=798
assign (segid "    " and resid   28 and name   HA) (segid "    " and resid   38 and name  HB2) 3.566 1.526 1.526 ! spec=C13NOESY, no=807, id=799
    or (segid "    " and resid   28 and name   HA) (segid "    " and resid   38 and name  HB1)
    or (segid "    " and resid   28 and name   HA) (segid "    " and resid   38 and name  HB3)
assign (segid "    " and resid   30 and name   HB) (segid "    " and resid   27 and name   HA) 2.922 1.024 1.024 ! spec=C13NOESY, no=809, id=800
assign (segid "    " and resid   29 and name  HB2) (segid "    " and resid   29 and name   HA) 2.264 0.615 0.615 ! spec=C13NOESY, no=814, id=803
assign (segid "    " and resid   30 and name HG12) (segid "    " and resid   30 and name   HA) 3.809 1.741 1.741 ! spec=C13NOESY, no=815, id=804
assign (segid "    " and resid   30 and name HG12) (segid "    " and resid   30 and name HG11) 2.120 0.539 0.539 ! spec=C13NOESY, no=819, id=806
assign (segid "    " and resid   30 and name HG12) (segid "    " and resid   30 and name HD12) 2.016 0.488 0.488 ! spec=C13NOESY, no=820, id=807
assign (segid "    " and resid   30 and name HD12) (segid "    " and resid   30 and name HG11) 3.140 1.183 1.183 ! spec=C13NOESY, no=822, id=808
assign (segid "    " and resid   37 and name   HB) (segid "    " and resid   37 and name HG22) 1.951 0.457 0.457 ! spec=C13NOESY, no=826, id=809
assign (segid "    " and resid   25 and name  HD1) (segid "    " and resid   25 and name  HE1) 3.066 1.128 1.128 ! spec=C13NOESY, no=829, id=810
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   33 and name   HN) 3.677 1.623 1.623 ! spec=N15NOESY, no=1, id=0
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   34 and name   HA) 3.757 1.693 1.693 ! spec=N15NOESY, no=4, id=3
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   35 and name   HA) 4.107 2.024 2.024 ! spec=N15NOESY, no=5, id=4
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   34 and name  HB2) 4.593 2.532 2.532 ! spec=N15NOESY, no=6, id=5
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   34 and name  HB1) 4.742 2.699 2.699 ! spec=N15NOESY, no=7, id=6
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   35 and name   HB) 3.612 1.566 1.566 ! spec=N15NOESY, no=8, id=7
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   10 and name  HB1) 4.680 2.628 2.628 ! spec=N15NOESY, no=9, id=8
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   35 and name HG12) 3.573 1.532 1.532 ! spec=N15NOESY, no=10, id=9
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   28 and name HD22) 4.971 2.965 2.965 ! spec=N15NOESY, no=11, id=10
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   19 and name   HA) 3.400 1.387 1.387 ! spec=N15NOESY, no=14, id=11
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   20 and name   HA) 3.138 1.182 1.182 ! spec=N15NOESY, no=15, id=12
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   19 and name  HB2) 4.027 1.946 1.946 ! spec=N15NOESY, no=16, id=13
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   19 and name  HB1) 3.996 1.917 1.917 ! spec=N15NOESY, no=17, id=14
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   20 and name  HB2) 3.447 1.426 1.426 ! spec=N15NOESY, no=18, id=15
assign (segid "    " and resid   20 and name   HN) (segid "    " and resid   24 and name HG22) 4.697 2.648 2.648 ! spec=N15NOESY, no=19, id=16
assign (segid "    " and resid    9 and name   HN) (segid "    " and resid    8 and name   HA) 2.723 0.890 0.890 ! spec=N15NOESY, no=21, id=18
assign (segid "    " and resid    9 and name   HN) (segid "    " and resid    9 and name   HA) 2.849 0.974 0.974 ! spec=N15NOESY, no=22, id=19
assign (segid "    " and resid    9 and name   HN) (segid "    " and resid    6 and name  HB2) 4.948 2.938 2.938 ! spec=N15NOESY, no=23, id=20
assign (segid "    " and resid    9 and name   HN) (segid "    " and resid    8 and name  HB2) 4.017 1.936 1.936 ! spec=N15NOESY, no=24, id=21
assign (segid "    " and resid    9 and name   HN) (segid "    " and resid    9 and name  HB2) 3.175 1.210 1.210 ! spec=N15NOESY, no=27, id=22
assign (segid "    " and resid    9 and name   HN) (segid "    " and resid    6 and name   HA) 3.468 1.443 1.443 ! spec=N15NOESY, no=29, id=23
assign (segid "    " and resid    3 and name  HT3) (segid "    " and resid    3 and name   HA) 3.022 1.096 1.096 ! spec=N15NOESY, no=30, id=24
    or (segid "    " and resid    3 and name  HT2) (segid "    " and resid    3 and name   HA)
    or (segid "    " and resid    3 and name  HT1) (segid "    " and resid    3 and name   HA)
assign (segid "    " and resid    3 and name  HT3) (segid "    " and resid    3 and name  HB2) 2.602 0.812 0.812 ! spec=N15NOESY, no=31, id=25
    or (segid "    " and resid    3 and name  HT2) (segid "    " and resid    3 and name  HB2)
    or (segid "    " and resid    3 and name  HT1) (segid "    " and resid    3 and name  HB2)
assign (segid "    " and resid   38 and name   HN) (segid "    " and resid   37 and name   HN) 3.673 1.618 1.618 ! spec=N15NOESY, no=32, id=26
assign (segid "    " and resid   38 and name   HN) (segid "    " and resid   38 and name   HA) 3.673 1.618 1.618 ! spec=N15NOESY, no=34, id=27
assign (segid "    " and resid   38 and name   HN) (segid "    " and resid   35 and name   HA) 4.331 2.251 2.251 ! spec=N15NOESY, no=35, id=28
assign (segid "    " and resid   38 and name   HN) (segid "    " and resid   34 and name  HB2) 5.212 3.260 3.260 ! spec=N15NOESY, no=36, id=29
assign (segid "    " and resid   38 and name   HN) (segid "    " and resid   14 and name   HG) 4.264 2.182 2.182 ! spec=N15NOESY, no=38, id=30
assign (segid "    " and resid   38 and name   HN) (segid "    " and resid   38 and name  HB2) 1.828 0.401 0.401 ! spec=N15NOESY, no=40, id=31
assign (segid "    " and resid   38 and name   HN) (segid "    " and resid   28 and name HD22) 4.549 2.483 2.483 ! spec=N15NOESY, no=42, id=32
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   31 and name   HN) 3.612 1.566 1.566 ! spec=N15NOESY, no=43, id=33
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   29 and name   HN) 3.784 1.718 1.718 ! spec=N15NOESY, no=44, id=34
assign (segid "    " and resid   30 and name   HN) (segid "    " and resid   30 and name HG12) 1.880 0.424 0.424 ! spec=N15NOESY, no=46, id=35
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   22 and name   HN) 1.907 0.436 0.436 ! spec=N15NOESY, no=47, id=36
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   20 and name   HA) 3.400 1.387 1.387 ! spec=N15NOESY, no=51, id=38
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   21 and name   HA) 3.954 1.876 1.876 ! spec=N15NOESY, no=53, id=39
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   21 and name  HB2) 3.655 1.603 1.603 ! spec=N15NOESY, no=56, id=40
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   24 and name   HA) 4.077 1.995 1.995 ! spec=N15NOESY, no=57, id=41
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   21 and name  HB1) 3.659 1.607 1.607 ! spec=N15NOESY, no=58, id=42
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid    6 and name  HB2) 4.397 2.320 2.320 ! spec=N15NOESY, no=59, id=43
assign (segid "    " and resid    8 and name   HN) (segid "    " and resid    8 and name  HB2) 3.187 1.219 1.219 ! spec=N15NOESY, no=60, id=44
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   19 and name  HB1) 4.026 1.945 1.945 ! spec=N15NOESY, no=61, id=45
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   24 and name   HB) 2.424 0.705 0.705 ! spec=N15NOESY, no=62, id=46
assign (segid "    " and resid   21 and name   HN) (segid "    " and resid   20 and name  HB2) 3.715 1.656 1.656 ! spec=N15NOESY, no=63, id=47
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   25 and name  HB2) 3.856 1.784 1.784 ! spec=N15NOESY, no=64, id=48
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   25 and name  HB1) 4.770 2.731 2.731 ! spec=N15NOESY, no=65, id=49
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   26 and name  HG2) 1.814 0.395 0.395 ! spec=N15NOESY, no=67, id=50
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   25 and name  HB1) 4.166 2.083 2.083 ! spec=N15NOESY, no=69, id=51
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   27 and name  HB2) 4.418 2.342 2.342 ! spec=N15NOESY, no=70, id=52
assign (segid "    " and resid    5 and name   HN) (segid "    " and resid    4 and name   HA) 3.159 1.197 1.197 ! spec=N15NOESY, no=74, id=54
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   26 and name   HA) 3.108 1.159 1.159 ! spec=N15NOESY, no=75, id=55
assign (segid "    " and resid   37 and name   HN) (segid "    " and resid   37 and name   HA) 3.913 1.837 1.837 ! spec=N15NOESY, no=76, id=56
assign (segid "    " and resid    5 and name   HN) (segid "    " and resid    5 and name  HG2) 1.792 0.385 0.385 ! spec=N15NOESY, no=78, id=58
assign (segid "    " and resid   37 and name   HN) (segid "    " and resid   36 and name  HB2) 3.573 1.532 1.532 ! spec=N15NOESY, no=79, id=59
assign (segid "    " and resid    5 and name   HN) (segid "    " and resid    4 and name  HB1) 1.849 0.410 0.410 ! spec=N15NOESY, no=82, id=62
assign (segid "    " and resid   37 and name   HN) (segid "    " and resid   37 and name HG12) 3.321 1.324 1.324 ! spec=N15NOESY, no=83, id=63
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid    7 and name   HB) 3.371 1.364 1.364 ! spec=N15NOESY, no=84, id=64
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid    7 and name HG12) 3.240 1.260 1.260 ! spec=N15NOESY, no=86, id=66
assign (segid "    " and resid    9 and name   HN) (segid "    " and resid   10 and name   HN) 3.062 1.125 1.125 ! spec=N15NOESY, no=87, id=67
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid    9 and name   HA) 4.120 2.037 2.037 ! spec=N15NOESY, no=88, id=68
assign (segid "    " and resid   12 and name   HN) (segid "    " and resid   12 and name   HA) 2.202 0.582 0.582 ! spec=N15NOESY, no=89, id=69
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid   10 and name   HA) 3.696 1.639 1.639 ! spec=N15NOESY, no=90, id=70
assign (segid "    " and resid   12 and name   HN) (segid "    " and resid   11 and name   HA) 4.268 2.186 2.186 ! spec=N15NOESY, no=91, id=71
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid   10 and name  HE2) 4.347 2.268 2.268 ! spec=N15NOESY, no=92, id=72
assign (segid "    " and resid   12 and name   HN) (segid "    " and resid   11 and name   HB) 1.792 0.385 0.385 ! spec=N15NOESY, no=94, id=73
assign (segid "    " and resid   12 and name   HN) (segid "    " and resid   12 and name  HB2) 2.785 0.931 0.931 ! spec=N15NOESY, no=98, id=74
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid   10 and name  HG2) 1.754 0.369 0.369 ! spec=N15NOESY, no=99, id=75
assign (segid "    " and resid   12 and name   HN) (segid "    " and resid   11 and name HG22) 3.477 1.451 1.451 ! spec=N15NOESY, no=100, id=76
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   42 and name   HA) 3.364 1.358 1.358 ! spec=N15NOESY, no=102, id=77
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   42 and name  HB2) 1.817 0.396 0.396 ! spec=N15NOESY, no=104, id=78
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   42 and name HD22) 3.187 1.219 1.219 ! spec=N15NOESY, no=105, id=79
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   15 and name   HA) 4.517 2.449 2.449 ! spec=N15NOESY, no=108, id=82
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   12 and name   HA) 3.900 1.825 1.825 ! spec=N15NOESY, no=109, id=83
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   11 and name   HA) 4.862 2.836 2.836 ! spec=N15NOESY, no=110, id=84
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   15 and name  HG2) 3.483 1.456 1.456 ! spec=N15NOESY, no=111, id=85
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   15 and name  HG1) 3.450 1.428 1.428 ! spec=N15NOESY, no=112, id=86
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   15 and name  HB2) 3.262 1.277 1.277 ! spec=N15NOESY, no=113, id=87
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   15 and name  HB1) 3.264 1.278 1.278 ! spec=N15NOESY, no=114, id=88
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   14 and name   HG) 4.447 2.373 2.373 ! spec=N15NOESY, no=115, id=89
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   12 and name  HB2) 4.734 2.690 2.690 ! spec=N15NOESY, no=116, id=90
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   14 and name  HB1) 2.531 0.769 0.769 ! spec=N15NOESY, no=117, id=91
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   11 and name HG22) 3.596 1.552 1.552 ! spec=N15NOESY, no=118, id=92
assign (segid "    " and resid    6 and name   HN) (segid "    " and resid    5 and name   HA) 3.715 1.656 1.656 ! spec=N15NOESY, no=121, id=95
assign (segid "    " and resid    6 and name   HN) (segid "    " and resid    6 and name  HB2) 3.918 1.842 1.842 ! spec=N15NOESY, no=123, id=96
assign (segid "    " and resid    6 and name   HN) (segid "    " and resid    9 and name  HB2) 4.051 1.969 1.969 ! spec=N15NOESY, no=125, id=97
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   28 and name   HN) 3.306 1.311 1.311 ! spec=N15NOESY, no=127, id=98
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   29 and name   HA) 3.516 1.484 1.484 ! spec=N15NOESY, no=128, id=99
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   29 and name  HB2) 3.095 1.150 1.150 ! spec=N15NOESY, no=129, id=100
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   28 and name HD12) 3.954 1.876 1.876 ! spec=N15NOESY, no=131, id=101
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   36 and name   HN) 3.790 1.723 1.723 ! spec=N15NOESY, no=132, id=102
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   10 and name   HN) 3.317 1.320 1.320 ! spec=N15NOESY, no=136, id=103
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   10 and name   HA) 4.245 2.162 2.162 ! spec=N15NOESY, no=138, id=104
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   11 and name   HA) 4.021 1.940 1.940 ! spec=N15NOESY, no=139, id=105
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   11 and name   HB) 3.044 1.112 1.112 ! spec=N15NOESY, no=140, id=106
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   10 and name  HB1) 3.625 1.576 1.576 ! spec=N15NOESY, no=141, id=107
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   11 and name HG11) 2.976 1.063 1.063 ! spec=N15NOESY, no=143, id=108
assign (segid "    " and resid   17 and name   HN) (segid "    " and resid   16 and name   HN) 3.957 1.879 1.879 ! spec=N15NOESY, no=145, id=110
assign (segid "    " and resid   19 and name   HN) (segid "    " and resid   19 and name   HA) 3.720 1.661 1.661 ! spec=N15NOESY, no=149, id=114
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   26 and name   HA) 4.288 2.206 2.206 ! spec=N15NOESY, no=151, id=115
assign (segid "    " and resid   19 and name   HN) (segid "    " and resid   18 and name  HA1) 4.284 2.202 2.202 ! spec=N15NOESY, no=152, id=116
assign (segid "    " and resid   17 and name   HN) (segid "    " and resid   16 and name  HA1) 2.029 0.494 0.494 ! spec=N15NOESY, no=153, id=117
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   25 and name   HA) 3.558 1.519 1.519 ! spec=N15NOESY, no=154, id=118
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   24 and name   HA) 4.129 2.046 2.046 ! spec=N15NOESY, no=155, id=119
assign (segid "    " and resid   19 and name   HN) (segid "    " and resid   19 and name  HB2) 4.049 1.967 1.967 ! spec=N15NOESY, no=156, id=120
assign (segid "    " and resid   17 and name   HN) (segid "    " and resid   17 and name  HG2) 2.348 0.662 0.662 ! spec=N15NOESY, no=157, id=121
assign (segid "    " and resid   17 and name   HN) (segid "    " and resid   17 and name  HB1) 3.308 1.313 1.313 ! spec=N15NOESY, no=158, id=122
assign (segid "    " and resid   19 and name   HN) (segid "    " and resid   19 and name  HB1) 3.600 1.555 1.555 ! spec=N15NOESY, no=159, id=123
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   24 and name   HB) 3.604 1.559 1.559 ! spec=N15NOESY, no=160, id=124
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   25 and name  HD2) 3.081 1.139 1.139 ! spec=N15NOESY, no=161, id=125
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   25 and name  HB1) 2.969 1.058 1.058 ! spec=N15NOESY, no=162, id=126
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   24 and name HG12) 2.974 1.061 1.061 ! spec=N15NOESY, no=163, id=127
assign (segid "    " and resid   19 and name   HN) (segid "    " and resid   24 and name HG22) 4.232 2.150 2.150 ! spec=N15NOESY, no=164, id=128
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   33 and name   HN) 2.282 0.625 0.625 ! spec=N15NOESY, no=165, id=129
assign (segid "    " and resid   35 and name   HN) (segid "    " and resid   34 and name   HN) 4.632 2.574 2.574 ! spec=N15NOESY, no=166, id=130
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   34 and name   HA) 4.420 2.344 2.344 ! spec=N15NOESY, no=167, id=131
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   34 and name  HB2) 3.483 1.456 1.456 ! spec=N15NOESY, no=169, id=132
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   34 and name  HB1) 3.413 1.398 1.398 ! spec=N15NOESY, no=170, id=133
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   37 and name   HB) 4.576 2.513 2.513 ! spec=N15NOESY, no=171, id=134
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   31 and name  HB2) 3.741 1.679 1.679 ! spec=N15NOESY, no=172, id=135
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   14 and name   HN) 3.906 1.831 1.831 ! spec=N15NOESY, no=173, id=136
assign (segid "    " and resid   14 and name   HN) (segid "    " and resid   14 and name   HA) 3.646 1.595 1.595 ! spec=N15NOESY, no=175, id=138
assign (segid "    " and resid   14 and name   HN) (segid "    " and resid   11 and name   HA) 4.682 2.631 2.631 ! spec=N15NOESY, no=176, id=139
assign (segid "    " and resid   14 and name   HN) (segid "    " and resid   14 and name  HB2) 2.907 1.014 1.014 ! spec=N15NOESY, no=177, id=140
assign (segid "    " and resid   14 and name   HN) (segid "    " and resid   14 and name   HG) 3.013 1.090 1.090 ! spec=N15NOESY, no=178, id=141
assign (segid "    " and resid   14 and name   HN) (segid "    " and resid   14 and name  HB1) 3.483 1.456 1.456 ! spec=N15NOESY, no=180, id=142
assign (segid "    " and resid   14 and name   HN) (segid "    " and resid   11 and name HG22) 3.145 1.187 1.187 ! spec=N15NOESY, no=181, id=143
assign (segid "    " and resid   14 and name   HN) (segid "    " and resid   14 and name HD12) 3.323 1.325 1.325 ! spec=N15NOESY, no=182, id=144
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   32 and name   HA) 3.138 1.182 1.182 ! spec=N15NOESY, no=184, id=145
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   32 and name  HG2) 3.293 1.301 1.301 ! spec=N15NOESY, no=187, id=146
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   31 and name  HB2) 4.087 2.005 2.005 ! spec=N15NOESY, no=188, id=147
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   30 and name HG11) 4.386 2.308 2.308 ! spec=N15NOESY, no=189, id=148
assign (segid "    " and resid   24 and name   HN) (segid "    " and resid   23 and name   HN) 2.341 0.657 0.657 ! spec=N15NOESY, no=191, id=150
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   22 and name   HA) 4.400 2.323 2.323 ! spec=N15NOESY, no=193, id=151
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   23 and name  HG2) 2.044 0.501 0.501 ! spec=N15NOESY, no=194, id=152
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   22 and name  HB2) 2.197 0.579 0.579 ! spec=N15NOESY, no=196, id=153
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   20 and name  HB2) 1.875 0.422 0.422 ! spec=N15NOESY, no=197, id=154
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   24 and name HG22) 4.328 2.248 2.248 ! spec=N15NOESY, no=198, id=155
assign (segid "    " and resid   25 and name   HN) (segid "    " and resid   26 and name   HN) 2.705 0.878 0.878 ! spec=N15NOESY, no=199, id=156
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   25 and name   HA) 4.165 2.081 2.081 ! spec=N15NOESY, no=201, id=157
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   26 and name  HD1) 4.485 2.414 2.414 ! spec=N15NOESY, no=202, id=158
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   26 and name  HB2) 2.726 0.892 0.892 ! spec=N15NOESY, no=203, id=159
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   26 and name  HG2) 2.674 0.858 0.858 ! spec=N15NOESY, no=204, id=160
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   25 and name  HB2) 3.010 1.087 1.087 ! spec=N15NOESY, no=205, id=161
assign (segid "    " and resid   26 and name   HN) (segid "    " and resid   25 and name  HB1) 3.148 1.189 1.189 ! spec=N15NOESY, no=206, id=162
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   40 and name   HN) 3.850 1.778 1.778 ! spec=N15NOESY, no=207, id=163
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   36 and name   HA) 4.072 1.990 1.990 ! spec=N15NOESY, no=208, id=164
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   38 and name   HA) 2.936 1.035 1.035 ! spec=N15NOESY, no=209, id=165
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   39 and name   HA) 3.581 1.539 1.539 ! spec=N15NOESY, no=210, id=166
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   35 and name   HA) 2.963 1.053 1.053 ! spec=N15NOESY, no=211, id=167
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   39 and name  HB2) 3.252 1.269 1.269 ! spec=N15NOESY, no=212, id=168
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   42 and name   HG) 4.692 2.642 2.642 ! spec=N15NOESY, no=213, id=169
assign (segid "    " and resid   44 and name   HN) (segid "    " and resid   43 and name   HN) 3.235 1.256 1.256 ! spec=N15NOESY, no=214, id=170
assign (segid "    " and resid   44 and name   HN) (segid "    " and resid   43 and name   HA) 3.530 1.495 1.495 ! spec=N15NOESY, no=216, id=171
assign (segid "    " and resid   44 and name   HN) (segid "    " and resid   44 and name  HB2) 3.180 1.213 1.213 ! spec=N15NOESY, no=217, id=172
assign (segid "    " and resid   44 and name   HN) (segid "    " and resid   43 and name  HG2) 3.188 1.220 1.220 ! spec=N15NOESY, no=218, id=173
assign (segid "    " and resid   31 and name   HN) (segid "    " and resid   31 and name   HA) 2.252 0.609 0.609 ! spec=N15NOESY, no=221, id=175
assign (segid "    " and resid   31 and name   HN) (segid "    " and resid   30 and name   HB) 2.083 0.521 0.521 ! spec=N15NOESY, no=223, id=176
assign (segid "    " and resid   31 and name   HN) (segid "    " and resid   31 and name  HB2) 3.509 1.478 1.478 ! spec=N15NOESY, no=224, id=177
assign (segid "    " and resid   31 and name   HN) (segid "    " and resid   30 and name HG22) 3.819 1.750 1.750 ! spec=N15NOESY, no=225, id=178
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   43 and name   HA) 3.725 1.665 1.665 ! spec=N15NOESY, no=229, id=181
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   29 and name   HA) 4.086 2.004 2.004 ! spec=N15NOESY, no=230, id=182
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   28 and name   HA) 3.655 1.603 1.603 ! spec=N15NOESY, no=231, id=183
assign (segid "    " and resid   43 and name   HN) (segid "    " and resid   43 and name  HB2) 3.293 1.301 1.301 ! spec=N15NOESY, no=232, id=184
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   28 and name  HB2) 2.977 1.064 1.064 ! spec=N15NOESY, no=233, id=185
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   28 and name   HG) 2.969 1.058 1.058 ! spec=N15NOESY, no=234, id=186
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   28 and name HD22) 3.118 1.166 1.166 ! spec=N15NOESY, no=235, id=187
assign (segid "    " and resid   23 and name   HN) (segid "    " and resid   22 and name   HN) 3.646 1.595 1.595 ! spec=N15NOESY, no=237, id=189
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   21 and name   HA) 4.355 2.276 2.276 ! spec=N15NOESY, no=238, id=190
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   22 and name   HA) 3.471 1.446 1.446 ! spec=N15NOESY, no=239, id=191
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   21 and name  HB1) 3.646 1.595 1.595 ! spec=N15NOESY, no=240, id=192
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   22 and name  HG1) 3.190 1.221 1.221 ! spec=N15NOESY, no=241, id=193
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   22 and name  HB2) 3.286 1.296 1.296 ! spec=N15NOESY, no=242, id=194
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   20 and name  HB2) 4.127 2.044 2.044 ! spec=N15NOESY, no=243, id=195
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   40 and name   HA) 3.730 1.670 1.670 ! spec=N15NOESY, no=244, id=196
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   39 and name  HB2) 3.720 1.661 1.661 ! spec=N15NOESY, no=245, id=197
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   33 and name   HA) 3.102 1.155 1.155 ! spec=N15NOESY, no=249, id=201
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   33 and name  HB2) 4.280 2.198 2.198 ! spec=N15NOESY, no=251, id=202
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   33 and name  HB1) 4.237 2.155 2.155 ! spec=N15NOESY, no=252, id=203
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   31 and name  HB2) 3.807 1.739 1.739 ! spec=N15NOESY, no=253, id=204
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   28 and name HD22) 4.121 2.038 2.038 ! spec=N15NOESY, no=254, id=205
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   16 and name   HN) 3.903 1.828 1.828 ! spec=N15NOESY, no=255, id=206
assign (segid "    " and resid   16 and name   HN) (segid "    " and resid   16 and name  HA1) 3.188 1.220 1.220 ! spec=N15NOESY, no=257, id=208
assign (segid "    " and resid   16 and name   HN) (segid "    " and resid   15 and name  HB2) 3.646 1.595 1.595 ! spec=N15NOESY, no=258, id=209
assign (segid "    " and resid   16 and name   HN) (segid "    " and resid   15 and name  HB1) 3.540 1.504 1.504 ! spec=N15NOESY, no=259, id=210
assign (segid "    " and resid   17 and name   HN) (segid "    " and resid   18 and name   HN) 3.673 1.618 1.618 ! spec=N15NOESY, no=260, id=211
assign (segid "    " and resid   19 and name   HN) (segid "    " and resid   18 and name   HN) 3.604 1.559 1.559 ! spec=N15NOESY, no=261, id=212
assign (segid "    " and resid   18 and name   HN) (segid "    " and resid   17 and name   HA) 2.925 1.027 1.027 ! spec=N15NOESY, no=262, id=213
assign (segid "    " and resid   18 and name   HN) (segid "    " and resid   18 and name  HA1) 3.544 1.507 1.507 ! spec=N15NOESY, no=263, id=214
assign (segid "    " and resid   18 and name   HN) (segid "    " and resid   18 and name  HA2) 3.551 1.513 1.513 ! spec=N15NOESY, no=264, id=215
assign (segid "    " and resid   18 and name   HN) (segid "    " and resid   19 and name  HB1) 3.965 1.887 1.887 ! spec=N15NOESY, no=265, id=216
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   24 and name   HA) 4.219 2.136 2.136 ! spec=N15NOESY, no=266, id=217
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   26 and name   HN) 2.159 0.559 0.559 ! spec=N15NOESY, no=268, id=218
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   32 and name  HB2) 3.979 1.899 1.899 ! spec=N15NOESY, no=269, id=219
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   28 and name  HB2) 3.222 1.246 1.246 ! spec=N15NOESY, no=271, id=220
assign (segid "    " and resid   19 and name   HN) (segid "    " and resid   18 and name  HA2) 4.313 2.232 2.232 ! spec=N15NOESY, no=274, id=221
assign (segid "    " and resid   37 and name   HN) (segid "    " and resid   31 and name  HB2) 4.593 2.532 2.532 ! spec=N15NOESY, no=275, id=222
    or (segid "    " and resid   37 and name   HN) (segid "    " and resid   31 and name  HB1)
    or (segid "    " and resid   37 and name   HN) (segid "    " and resid   31 and name  HB3)
assign (segid "    " and resid   37 and name   HN) (segid "    " and resid   36 and name   HA) 4.529 2.461 2.461 ! spec=N15NOESY, no=276, id=223
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   38 and name   HN) 2.582 0.800 0.800 ! spec=N15NOESY, no=277, id=224
assign (segid "    " and resid   11 and name   HN) (segid "    " and resid   11 and name HG12) 1.759 0.371 0.371 ! spec=N15NOESY, no=279, id=225
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   28 and name HD22) 4.788 2.751 2.751 ! spec=N15NOESY, no=280, id=226
assign (segid "    " and resid   27 and name   HN) (segid "    " and resid   27 and name   HA) 3.054 1.119 1.119 ! spec=N15NOESY, no=281, id=227
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid    7 and name   HA) 2.226 0.595 0.595 ! spec=N15NOESY, no=282, id=228
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid    6 and name  HB2) 3.655 1.603 1.603 ! spec=N15NOESY, no=283, id=229
assign (segid "    " and resid    7 and name   HN) (segid "    " and resid    6 and name   HA) 3.116 1.165 1.165 ! spec=N15NOESY, no=284, id=230
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid    7 and name HG12) 3.960 1.882 1.882 ! spec=N15NOESY, no=285, id=231
assign (segid "    " and resid   10 and name   HN) (segid "    " and resid   11 and name HG11) 4.346 2.266 2.266 ! spec=N15NOESY, no=286, id=232
assign (segid "    " and resid   46 and name   HN) (segid "    " and resid   46 and name   HA) 2.850 0.975 0.975 ! spec=N15NOESY, no=288, id=233
assign (segid "    " and resid   46 and name   HN) (segid "    " and resid   46 and name  HB2) 2.556 0.784 0.784 ! spec=N15NOESY, no=289, id=234
assign (segid "    " and resid   29 and name   HN) (segid "    " and resid   30 and name   HA) 4.133 2.049 2.049 ! spec=N15NOESY, no=290, id=235
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   39 and name  HG2) 3.933 1.856 1.856 ! spec=N15NOESY, no=291, id=236
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   38 and name  HB2) 3.262 1.277 1.277 ! spec=N15NOESY, no=292, id=237
assign (segid "    " and resid   13 and name   HN) (segid "    " and resid    9 and name   HA) 2.939 1.037 1.037 ! spec=N15NOESY, no=295, id=238
assign (segid "    " and resid   13 and name   HN) (segid "    " and resid   10 and name   HA) 2.736 0.899 0.899 ! spec=N15NOESY, no=296, id=239
assign (segid "    " and resid   36 and name   HN) (segid "    " and resid   36 and name   HA) 3.145 1.187 1.187 ! spec=N15NOESY, no=298, id=240
assign (segid "    " and resid   14 and name   HN) (segid "    " and resid   13 and name   HN) 3.540 1.504 1.504 ! spec=N15NOESY, no=299, id=241
assign (segid "    " and resid   13 and name   HN) (segid "    " and resid   13 and name   HA) 3.197 1.226 1.226 ! spec=N15NOESY, no=300, id=242
assign (segid "    " and resid   13 and name   HN) (segid "    " and resid   13 and name  HB2) 2.688 0.867 0.867 ! spec=N15NOESY, no=301, id=243
assign (segid "    " and resid   13 and name   HN) (segid "    " and resid   14 and name HD12) 4.703 2.654 2.654 ! spec=N15NOESY, no=302, id=244
assign (segid "    " and resid   14 and name   HN) (segid "    " and resid   13 and name   HA) 3.402 1.389 1.389 ! spec=N15NOESY, no=304, id=245
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   14 and name   HA) 3.018 1.093 1.093 ! spec=N15NOESY, no=305, id=246
assign (segid "    " and resid   15 and name   HN) (segid "    " and resid   14 and name  HB2) 3.268 1.281 1.281 ! spec=N15NOESY, no=306, id=247
assign (segid "    " and resid   22 and name   HN) (segid "    " and resid   21 and name  HB2) 3.301 1.308 1.308 ! spec=N15NOESY, no=309, id=248
assign (segid "    " and resid   28 and name   HN) (segid "    " and resid   25 and name   HA) 3.347 1.344 1.344 ! spec=N15NOESY, no=310, id=249
assign (segid "    " and resid   32 and name   HN) (segid "    " and resid   32 and name  HB2) 3.192 1.222 1.222 ! spec=N15NOESY, no=311, id=250
assign (segid "    " and resid   33 and name   HN) (segid "    " and resid   32 and name   HA) 2.944 1.040 1.040 ! spec=N15NOESY, no=312, id=251
assign (segid "    " and resid   39 and name   HN) (segid "    " and resid   14 and name HD12) 3.356 1.352 1.352 ! spec=N15NOESY, no=313, id=252
assign (segid "    " and resid   31 and name   HN) (segid "    " and resid   30 and name   HA) 4.183 2.099 2.099 ! spec=N15NOESY, no=316, id=253
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   39 and name   HA) 2.720 0.888 0.888 ! spec=N15NOESY, no=318, id=254
assign (segid "    " and resid   40 and name   HN) (segid "    " and resid   40 and name  HB1) 3.441 1.421 1.421 ! spec=N15NOESY, no=319, id=255
assign (segid "    " and resid   19 and name   HN) (segid "    " and resid   20 and name   HN) 4.521 2.453 2.453 ! spec=N15NOESY, no=321, id=256
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   42 and name  HB1) 3.209 1.236 1.236 ! spec=N15NOESY, no=323, id=257
assign (segid "    " and resid   42 and name   HN) (segid "    " and resid   42 and name   HG) 3.374 1.366 1.366 ! spec=N15NOESY, no=324, id=258
assign (segid "    " and resid   34 and name   HN) (segid "    " and resid   35 and name HG12) 4.267 2.184 2.184 ! spec=N15NOESY, no=325, id=259

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   ALA   3           HA       ALA   3  12.155  14.859  -7.960
    2    HB1  ALA   3           3HB      ALA   3   9.210  14.301  -8.290
    3    HB2  ALA   3           1HB      ALA   3  10.449  14.027  -9.514
    4    HB3  ALA   3           2HB      ALA   3  10.097  15.666  -8.967
    5    H    LEU   4           H        LEU   4   9.352  14.050  -5.916
    6    HA   LEU   4           HA       LEU   4  10.176  16.072  -3.999
    7    HG   LEU   4           HG       LEU   4   9.132  18.224  -3.683
    8    HB2  LEU   4           2HB      LEU   4   8.542  17.014  -5.819
    9    HB3  LEU   4           1HB      LEU   4   7.324  16.142  -4.910
   10   HD11  LEU   4          1HD1      LEU   4   7.774  19.244  -5.431
   11   HD12  LEU   4          2HD1      LEU   4   7.232  19.748  -3.830
   12   HD13  LEU   4          3HD1      LEU   4   6.321  18.533  -4.728
   13   HD21  LEU   4          3HD2      LEU   4   8.191  16.663  -2.081
   14   HD22  LEU   4          1HD2      LEU   4   6.576  16.927  -2.739
   15   HD23  LEU   4          2HD2      LEU   4   7.420  18.240  -1.917
   16    H    GLU   5           H        GLU   5   7.490  13.888  -4.842
   17    HA   GLU   5           HA       GLU   5   7.067  13.223  -2.054
   18    HB2  GLU   5           2HB      GLU   5   5.226  11.828  -2.906
   19    HB3  GLU   5           1HB      GLU   5   5.130  13.477  -3.509
   20    HG2  GLU   5           2HG      GLU   5   6.148  12.728  -5.625
   21    HG3  GLU   5           1HG      GLU   5   6.130  11.073  -5.016
   22    H    ASN   6           H        ASN   6   7.382  11.204  -1.116
   23    HA   ASN   6           HA       ASN   6   9.110   9.368  -2.643
   24    HB2  ASN   6           2HB      ASN   6   9.168  10.042   0.304
   25    HB3  ASN   6           1HB      ASN   6  10.098   8.736  -0.426
   26   HD21  ASN   6          1HD2      ASN   6  11.823   9.228  -1.773
   27   HD22  ASN   6          2HD2      ASN   6  12.539  10.800  -1.813
   28    H    VAL   7           H        VAL   7   7.360   9.133   0.451
   29    HA   VAL   7           HA       VAL   7   6.644   6.428   0.027
   30    HB   VAL   7           HB       VAL   7   5.157   6.715   1.990
   31   HG11  VAL   7          1HG1      VAL   7   7.931   7.856   2.284
   32   HG12  VAL   7          2HG1      VAL   7   7.485   6.149   2.322
   33   HG13  VAL   7          3HG1      VAL   7   6.938   7.232   3.602
   34   HG21  VAL   7          3HG2      VAL   7   6.049   9.593   1.831
   35   HG22  VAL   7          1HG2      VAL   7   5.180   8.871   3.186
   36   HG23  VAL   7          2HG2      VAL   7   4.407   8.987   1.606
   37    H    ASP   8           H        ASP   8   5.080   9.464  -0.678
   38    HA   ASP   8           HA       ASP   8   2.439   8.662  -1.007
   39    HB2  ASP   8           2HB      ASP   8   3.950  10.691  -2.658
   40    HB3  ASP   8           1HB      ASP   8   2.201  10.598  -2.479
   41    H    ALA   9           H        ALA   9   5.183   8.357  -3.195
   42    HA   ALA   9           HA       ALA   9   3.783   7.613  -5.509
   43    HB1  ALA   9           3HB      ALA   9   6.114   8.220  -5.609
   44    HB2  ALA   9           1HB      ALA   9   5.918   6.576  -6.219
   45    HB3  ALA   9           2HB      ALA   9   6.546   6.845  -4.594
   46    H    LYS  10           H        LYS  10   4.990   5.713  -2.789
   47    HA   LYS  10           HA       LYS  10   4.287   3.178  -3.861
   48    HB2  LYS  10           2HB      LYS  10   4.514   3.864  -0.930
   49    HB3  LYS  10           1HB      LYS  10   4.771   2.302  -1.696
   50    HG2  LYS  10           2HG      LYS  10   6.508   4.525  -2.582
   51    HG3  LYS  10           1HG      LYS  10   6.765   3.903  -0.953
   52    HD2  LYS  10           2HD      LYS  10   8.203   2.750  -2.532
   53    HD3  LYS  10           1HD      LYS  10   7.009   1.635  -1.874
   54    HE2  LYS  10           2HE      LYS  10   5.717   1.725  -3.868
   55    HE3  LYS  10           1HE      LYS  10   6.684   3.054  -4.508
   56    HZ1  LYS  10           3HZ      LYS  10   8.568   1.588  -4.687
   57    HZ2  LYS  10           1HZ      LYS  10   7.255   0.899  -5.500
   58    HZ3  LYS  10           2HZ      LYS  10   7.708   0.316  -3.979
   59    H    ILE  11           H        ILE  11   2.747   5.325  -1.489
   60    HA   ILE  11           HA       ILE  11   0.489   3.814  -0.936
   61    HB   ILE  11           HB       ILE  11   0.621   6.826  -1.143
   62   HG12  ILE  11          2HG1      ILE  11   1.093   5.040   1.256
   63   HG13  ILE  11          1HG1      ILE  11   2.372   5.802   0.319
   64   HG21  ILE  11          1HG2      ILE  11  -1.126   5.477   0.817
   65   HG22  ILE  11          2HG2      ILE  11  -1.597   5.323  -0.877
   66   HG23  ILE  11          3HG2      ILE  11  -1.412   6.924  -0.152
   67   HD11  ILE  11          3HD1      ILE  11   1.879   7.018   2.380
   68   HD12  ILE  11          1HD1      ILE  11   0.223   7.269   1.829
   69   HD13  ILE  11          2HD1      ILE  11   1.566   7.996   0.945
   70    H    ALA  12           H        ALA  12   0.799   6.454  -3.303
   71    HA   ALA  12           HA       ALA  12  -1.680   6.198  -4.519
   72    HB1  ALA  12           3HB      ALA  12   0.915   7.018  -5.826
   73    HB2  ALA  12           1HB      ALA  12  -0.157   8.083  -4.916
   74    HB3  ALA  12           2HB      ALA  12  -0.707   7.361  -6.427
   75    H    LYS  13           H        LYS  13   1.336   4.475  -5.064
   76    HA   LYS  13           HA       LYS  13   0.688   3.091  -7.388
   77    HB2  LYS  13           2HB      LYS  13   2.926   3.130  -6.255
   78    HB3  LYS  13           1HB      LYS  13   2.292   1.990  -5.077
   79    HG2  LYS  13           2HG      LYS  13   3.599   0.855  -6.780
   80    HG3  LYS  13           1HG      LYS  13   1.905   0.359  -6.850
   81    HD2  LYS  13           2HD      LYS  13   1.509   1.627  -8.791
   82    HD3  LYS  13           1HD      LYS  13   2.997   2.551  -8.585
   83    HE2  LYS  13           2HE      LYS  13   4.304   0.546  -9.013
   84    HE3  LYS  13           1HE      LYS  13   2.822  -0.382  -9.240
   85    HZ1  LYS  13           3HZ      LYS  13   3.722   0.256 -11.363
   86    HZ2  LYS  13           1HZ      LYS  13   3.752   1.888 -10.915
   87    HZ3  LYS  13           2HZ      LYS  13   2.273   1.092 -11.108
   88    H    LEU  14           H        LEU  14  -0.230   2.561  -4.046
   89    HA   LEU  14           HA       LEU  14  -1.595   0.070  -4.698
   90    HG   LEU  14           HG       LEU  14  -0.557  -1.245  -3.060
   91    HB2  LEU  14           2HB      LEU  14  -1.072   1.580  -2.164
   92    HB3  LEU  14           1HB      LEU  14  -2.345   0.375  -2.208
   93   HD11  LEU  14          1HD1      LEU  14   1.110   0.440  -3.645
   94   HD12  LEU  14          2HD1      LEU  14   1.736  -0.718  -2.471
   95   HD13  LEU  14          3HD1      LEU  14   1.245   0.893  -1.947
   96   HD21  LEU  14          3HD2      LEU  14  -0.261  -0.176  -0.260
   97   HD22  LEU  14          1HD2      LEU  14   0.153  -1.794  -0.826
   98   HD23  LEU  14          2HD2      LEU  14  -1.533  -1.276  -0.793
   99    H    MET  15           H        MET  15  -2.267   3.433  -4.376
  100    HA   MET  15           HA       MET  15  -5.030   3.320  -3.809
  101    HB2  MET  15           2HB      MET  15  -3.328   5.398  -5.187
  102    HB3  MET  15           1HB      MET  15  -5.044   5.628  -4.879
  103    HG2  MET  15           2HG      MET  15  -2.962   5.112  -2.769
  104    HG3  MET  15           1HG      MET  15  -3.610   6.695  -3.195
  105    HE1  MET  15           3HE      MET  15  -7.361   6.355  -2.142
  106    HE2  MET  15           1HE      MET  15  -6.690   5.990  -3.732
  107    HE3  MET  15           2HE      MET  15  -6.128   7.405  -2.841
  108    H    GLY  16           H        GLY  16  -3.175   2.912  -6.723
  109    HA2  GLY  16           2HA      GLY  16  -4.980   3.376  -8.737
  110    HA3  GLY  16           1HA      GLY  16  -3.798   2.076  -8.772
  111    H    GLU  17           H        GLU  17  -4.554   0.263  -7.080
  112    HA   GLU  17           HA       GLU  17  -6.694  -1.059  -8.275
  113    HB2  GLU  17           2HB      GLU  17  -5.357  -1.441  -5.600
  114    HB3  GLU  17           1HB      GLU  17  -6.618  -2.520  -6.195
  115    HG2  GLU  17           2HG      GLU  17  -5.297  -3.329  -7.918
  116    HG3  GLU  17           1HG      GLU  17  -4.201  -1.941  -7.854
  117    H    GLY  18           H        GLY  18  -6.571   1.021  -5.440
  118    HA2  GLY  18           2HA      GLY  18  -8.326   2.325  -4.619
  119    HA3  GLY  18           1HA      GLY  18  -9.448   1.404  -5.608
  120    H    TYR  19           H        TYR  19  -7.934   1.716  -2.530
  121    HA   TYR  19           HA       TYR  19  -9.876  -0.070  -1.359
  122    HD1  TYR  19           1HD      TYR  19  -9.190  -2.750  -2.751
  123    HD2  TYR  19           2HD      TYR  19  -8.405  -1.986   1.360
  124    HE1  TYR  19           1HE      TYR  19 -10.429  -4.784  -2.142
  125    HE2  TYR  19           2HE      TYR  19  -9.641  -4.020   1.980
  126    HH   TYR  19           HH       TYR  19 -10.545  -6.382  -0.281
  127    HB2  TYR  19           2HB      TYR  19  -7.425  -1.172  -2.040
  128    HB3  TYR  19           1HB      TYR  19  -7.231  -0.771  -0.337
  129    H    ALA  20           H        ALA  20  -9.157  -0.262   1.164
  130    HA   ALA  20           HA       ALA  20  -9.548   2.248   2.271
  131    HB1  ALA  20           3HB      ALA  20  -9.699  -0.165   3.300
  132    HB2  ALA  20           1HB      ALA  20  -9.402   1.240   4.327
  133    HB3  ALA  20           2HB      ALA  20  -8.059   0.201   3.847
  134    H    PHE  21           H        PHE  21  -8.150   3.611   3.527
  135    HA   PHE  21           HA       PHE  21  -5.550   3.929   2.292
  136    HD1  PHE  21           1HD      PHE  21  -5.718   6.657   1.169
  137    HD2  PHE  21           2HD      PHE  21  -9.053   5.785   3.665
  138    HE1  PHE  21           1HE      PHE  21  -7.213   7.746  -0.453
  139    HE2  PHE  21           2HE      PHE  21 -10.554   6.871   2.046
  140    HZ   PHE  21           HZ       PHE  21  -9.635   7.853  -0.017
  141    HB2  PHE  21           2HB      PHE  21  -6.827   5.569   4.494
  142    HB3  PHE  21           1HB      PHE  21  -5.434   6.025   3.520
  143    H    GLU  22           H        GLU  22  -6.873   3.296   5.508
  144    HA   GLU  22           HA       GLU  22  -4.474   3.229   6.934
  145    HB2  GLU  22           2HB      GLU  22  -6.941   1.558   7.450
  146    HB3  GLU  22           1HB      GLU  22  -5.688   1.957   8.618
  147    HG2  GLU  22           2HG      GLU  22  -7.548   3.916   7.288
  148    HG3  GLU  22           1HG      GLU  22  -7.682   3.314   8.940
  149    H    GLU  23           H        GLU  23  -6.148   0.694   5.120
  150    HA   GLU  23           HA       GLU  23  -4.453  -1.430   5.894
  151    HB2  GLU  23           2HB      GLU  23  -6.250  -1.054   3.504
  152    HB3  GLU  23           1HB      GLU  23  -5.379  -2.549   3.829
  153    HG2  GLU  23           2HG      GLU  23  -6.507  -2.592   6.069
  154    HG3  GLU  23           1HG      GLU  23  -7.519  -1.267   5.498
  155    H    VAL  24           H        VAL  24  -4.276   0.936   3.303
  156    HA   VAL  24           HA       VAL  24  -2.214  -0.336   1.826
  157    HB   VAL  24           HB       VAL  24  -3.155   2.529   1.889
  158   HG11  VAL  24          1HG1      VAL  24  -1.252   1.303  -0.102
  159   HG12  VAL  24          2HG1      VAL  24  -0.759   2.364   1.211
  160   HG13  VAL  24          3HG1      VAL  24  -1.819   2.970  -0.058
  161   HG21  VAL  24          3HG2      VAL  24  -3.459   0.485  -0.295
  162   HG22  VAL  24          1HG2      VAL  24  -4.309   2.018  -0.108
  163   HG23  VAL  24          2HG2      VAL  24  -4.644   0.681   0.994
  164    H    LYS  25           H        LYS  25  -2.016   2.647   3.798
  165    HA   LYS  25           HA       LYS  25   0.741   2.880   3.802
  166    HB2  LYS  25           2HB      LYS  25  -1.308   3.731   5.839
  167    HB3  LYS  25           1HB      LYS  25   0.401   4.094   6.027
  168    HG2  LYS  25           2HG      LYS  25  -0.523   6.013   5.083
  169    HG3  LYS  25           1HG      LYS  25   0.271   5.184   3.750
  170    HD2  LYS  25           2HD      LYS  25  -1.801   4.377   2.905
  171    HD3  LYS  25           1HD      LYS  25  -2.658   4.880   4.364
  172    HE2  LYS  25           2HE      LYS  25  -1.355   6.709   2.350
  173    HE3  LYS  25           1HE      LYS  25  -3.085   6.410   2.508
  174    HZ1  LYS  25           3HZ      LYS  25  -1.346   7.647   4.574
  175    HZ2  LYS  25           1HZ      LYS  25  -3.005   7.353   4.735
  176    HZ3  LYS  25           2HZ      LYS  25  -2.450   8.468   3.591
  177    H    ARG  26           H        ARG  26  -1.295   1.125   6.145
  178    HA   ARG  26           HA       ARG  26   0.844   0.344   7.806
  179    HE   ARG  26           HE       ARG  26  -3.909  -3.130   6.658
  180    HB2  ARG  26           2HB      ARG  26  -0.670  -1.049   8.921
  181    HB3  ARG  26           1HB      ARG  26  -1.669   0.262   8.312
  182    HG2  ARG  26           2HG      ARG  26  -2.281  -1.206   6.389
  183    HG3  ARG  26           1HG      ARG  26  -1.433  -2.524   7.206
  184    HD2  ARG  26           2HD      ARG  26  -2.894  -2.215   9.160
  185    HD3  ARG  26           1HD      ARG  26  -3.752  -0.945   8.294
  186   HH11  ARG  26          1HH1      ARG  26  -4.781  -2.439   9.960
  187   HH12  ARG  26          2HH1      ARG  26  -6.113  -3.546   9.976
  188   HH21  ARG  26          1HH2      ARG  26  -5.663  -4.591   6.670
  189   HH22  ARG  26          2HH2      ARG  26  -6.614  -4.769   8.106
  190    H    ALA  27           H        ALA  27  -0.581  -1.106   4.927
  191    HA   ALA  27           HA       ALA  27   0.887  -3.547   5.101
  192    HB1  ALA  27           3HB      ALA  27  -1.183  -3.383   3.811
  193    HB2  ALA  27           1HB      ALA  27   0.158  -3.925   2.801
  194    HB3  ALA  27           2HB      ALA  27  -0.405  -2.257   2.700
  195    H    LEU  28           H        LEU  28   1.670  -0.369   4.142
  196    HA   LEU  28           HA       LEU  28   3.851  -1.101   2.401
  197    HG   LEU  28           HG       LEU  28   1.817   0.478   1.360
  198    HB2  LEU  28           2HB      LEU  28   2.778   1.487   3.473
  199    HB3  LEU  28           1HB      LEU  28   4.348   1.429   2.690
  200   HD11  LEU  28          1HD1      LEU  28   1.949   2.634   0.113
  201   HD12  LEU  28          2HD1      LEU  28   3.158   3.173   1.280
  202   HD13  LEU  28          3HD1      LEU  28   1.517   2.809   1.815
  203   HD21  LEU  28          3HD2      LEU  28   4.338   1.388   0.031
  204   HD22  LEU  28          1HD2      LEU  28   3.068   0.332  -0.588
  205   HD23  LEU  28          2HD2      LEU  28   4.190  -0.260   0.639
  206    H    GLU  29           H        GLU  29   3.596   0.515   5.571
  207    HA   GLU  29           HA       GLU  29   6.357   0.583   6.086
  208    HB2  GLU  29           2HB      GLU  29   4.067   0.556   8.057
  209    HB3  GLU  29           1HB      GLU  29   5.720   1.037   8.414
  210    HG2  GLU  29           2HG      GLU  29   3.849   2.409   6.497
  211    HG3  GLU  29           1HG      GLU  29   4.289   2.971   8.110
  212    H    ILE  30           H        ILE  30   3.869  -1.665   7.307
  213    HA   ILE  30           HA       ILE  30   5.533  -3.299   8.823
  214    HB   ILE  30           HB       ILE  30   3.048  -4.101   7.310
  215   HG12  ILE  30          2HG1      ILE  30   3.421  -3.209  10.179
  216   HG13  ILE  30          1HG1      ILE  30   2.734  -2.221   8.894
  217   HG21  ILE  30          1HG2      ILE  30   3.694  -5.505   9.789
  218   HG22  ILE  30          2HG2      ILE  30   4.869  -5.766   8.501
  219   HG23  ILE  30          3HG2      ILE  30   3.166  -6.141   8.230
  220   HD11  ILE  30          3HD1      ILE  30   0.998  -3.151  10.307
  221   HD12  ILE  30          1HD1      ILE  30   1.571  -4.783   9.965
  222   HD13  ILE  30          2HD1      ILE  30   0.885  -3.801   8.672
  223    H    ALA  31           H        ALA  31   4.713  -3.518   5.379
  224    HA   ALA  31           HA       ALA  31   6.179  -5.948   4.994
  225    HB1  ALA  31           3HB      ALA  31   5.691  -5.672   2.647
  226    HB2  ALA  31           1HB      ALA  31   5.191  -4.002   2.918
  227    HB3  ALA  31           2HB      ALA  31   4.246  -5.326   3.599
  228    H    GLN  32           H        GLN  32   7.464  -3.273   5.945
  229    HA   GLN  32           HA       GLN  32   9.513  -2.304   5.820
  230    HB2  GLN  32           2HB      GLN  32  10.218  -4.658   4.056
  231    HB3  GLN  32           1HB      GLN  32  11.357  -3.581   4.855
  232    HG2  GLN  32           2HG      GLN  32   9.420  -5.438   6.217
  233    HG3  GLN  32           1HG      GLN  32  11.156  -5.687   6.041
  234   HE21  GLN  32          1HE2      GLN  32   8.665  -3.877   7.652
  235   HE22  GLN  32          2HE2      GLN  32   9.668  -3.212   8.892
  236    H    ASN  33           H        ASN  33   7.762  -1.078   4.283
  237    HA   ASN  33           HA       ASN  33   7.487   0.328   2.522
  238    HB2  ASN  33           2HB      ASN  33  10.483   0.014   2.250
  239    HB3  ASN  33           1HB      ASN  33   9.512   1.289   1.522
  240   HD21  ASN  33          1HD2      ASN  33  11.730   1.451   3.410
  241   HD22  ASN  33          2HD2      ASN  33  11.126   2.307   4.783
  242    H    ASN  34           H        ASN  34   7.181  -2.498   2.019
  243    HA   ASN  34           HA       ASN  34   8.064  -2.694  -0.776
  244    HB2  ASN  34           2HB      ASN  34   7.299  -4.765   1.255
  245    HB3  ASN  34           1HB      ASN  34   7.302  -5.143  -0.463
  246   HD21  ASN  34          1HD2      ASN  34   9.243  -5.218  -1.573
  247   HD22  ASN  34          2HD2      ASN  34  10.768  -5.295  -0.764
  248    H    VAL  35           H        VAL  35   6.635  -2.333  -2.316
  249    HA   VAL  35           HA       VAL  35   3.833  -2.050  -1.664
  250    HB   VAL  35           HB       VAL  35   4.419  -0.359  -3.110
  251   HG11  VAL  35          1HG1      VAL  35   6.157  -2.378  -4.483
  252   HG12  VAL  35          2HG1      VAL  35   6.613  -0.878  -3.675
  253   HG13  VAL  35          3HG1      VAL  35   5.772  -0.824  -5.223
  254   HG21  VAL  35          3HG2      VAL  35   3.576  -2.441  -5.118
  255   HG22  VAL  35          1HG2      VAL  35   3.305  -0.701  -5.190
  256   HG23  VAL  35          2HG2      VAL  35   2.467  -1.676  -3.982
  257    H    GLU  36           H        GLU  36   5.885  -4.267  -3.458
  258    HA   GLU  36           HA       GLU  36   3.876  -5.691  -4.803
  259    HB2  GLU  36           2HB      GLU  36   6.494  -6.767  -3.764
  260    HB3  GLU  36           1HB      GLU  36   5.516  -7.468  -5.044
  261    HG2  GLU  36           2HG      GLU  36   5.890  -5.451  -6.399
  262    HG3  GLU  36           1HG      GLU  36   6.927  -4.812  -5.125
  263    H    VAL  37           H        VAL  37   5.484  -6.401  -1.703
  264    HA   VAL  37           HA       VAL  37   3.940  -8.645  -1.042
  265    HB   VAL  37           HB       VAL  37   5.247  -6.653   0.824
  266   HG11  VAL  37          1HG1      VAL  37   4.225  -9.446   1.324
  267   HG12  VAL  37          2HG1      VAL  37   3.607  -7.948   2.022
  268   HG13  VAL  37          3HG1      VAL  37   5.219  -8.520   2.451
  269   HG21  VAL  37          3HG2      VAL  37   6.254  -9.252  -0.326
  270   HG22  VAL  37          1HG2      VAL  37   7.074  -8.305   0.916
  271   HG23  VAL  37          2HG2      VAL  37   6.849  -7.634  -0.699
  272    H    ALA  38           H        ALA  38   3.529  -5.211  -0.236
  273    HA   ALA  38           HA       ALA  38   1.253  -5.397   1.341
  274    HB1  ALA  38           3HB      ALA  38   0.971  -3.095   1.002
  275    HB2  ALA  38           1HB      ALA  38   1.685  -3.156  -0.611
  276    HB3  ALA  38           2HB      ALA  38   2.705  -3.357   0.811
  277    H    ARG  39           H        ARG  39   1.583  -5.164  -2.167
  278    HA   ARG  39           HA       ARG  39  -1.147  -4.998  -2.797
  279    HE   ARG  39           HE       ARG  39  -0.601  -5.139  -6.859
  280    HB2  ARG  39           2HB      ARG  39   1.294  -5.861  -4.318
  281    HB3  ARG  39           1HB      ARG  39  -0.303  -6.045  -5.031
  282    HG2  ARG  39           2HG      ARG  39  -0.690  -3.649  -4.795
  283    HG3  ARG  39           1HG      ARG  39   0.904  -3.465  -4.060
  284    HD2  ARG  39           2HD      ARG  39   1.006  -2.856  -6.393
  285    HD3  ARG  39           1HD      ARG  39   1.928  -4.333  -6.110
  286   HH11  ARG  39          1HH1      ARG  39   1.989  -3.276  -8.261
  287   HH12  ARG  39          2HH1      ARG  39   1.600  -3.724  -9.889
  288   HH21  ARG  39          1HH2      ARG  39  -1.120  -5.731  -8.997
  289   HH22  ARG  39          2HH2      ARG  39  -0.169  -5.115 -10.308
  290    H    SER  40           H        SER  40   0.982  -7.728  -2.210
  291    HA   SER  40           HA       SER  40  -0.707  -9.779  -3.114
  292    HG   SER  40           HG       SER  40   1.683 -10.723  -3.552
  293    HB2  SER  40           2HB      SER  40   1.346  -9.858  -0.886
  294    HB3  SER  40           1HB      SER  40   0.646 -11.267  -1.685
  295    H    ILE  41           H        ILE  41  -0.444  -8.149   0.008
  296    HA   ILE  41           HA       ILE  41  -2.627  -9.757   1.092
  297    HB   ILE  41           HB       ILE  41  -2.211  -8.552   3.200
  298   HG12  ILE  41          2HG1      ILE  41   0.071  -7.238   1.704
  299   HG13  ILE  41          1HG1      ILE  41  -1.426  -6.428   2.155
  300   HG21  ILE  41          1HG2      ILE  41   0.256  -9.733   1.929
  301   HG22  ILE  41          2HG2      ILE  41  -1.032 -10.628   2.736
  302   HG23  ILE  41          3HG2      ILE  41  -0.009  -9.527   3.660
  303   HD11  ILE  41          3HD1      ILE  41   0.614  -7.582   4.042
  304   HD12  ILE  41          1HD1      ILE  41  -0.905  -6.824   4.519
  305   HD13  ILE  41          2HD1      ILE  41   0.338  -5.873   3.704
  306    H    LEU  42           H        LEU  42  -2.247  -6.899  -0.628
  307    HA   LEU  42           HA       LEU  42  -4.294  -5.323   0.579
  308    HG   LEU  42           HG       LEU  42  -3.240  -2.610  -1.627
  309    HB2  LEU  42           2HB      LEU  42  -2.324  -4.686  -1.048
  310    HB3  LEU  42           1HB      LEU  42  -3.497  -5.046  -2.294
  311   HD11  LEU  42          1HD1      LEU  42  -5.987  -3.843  -1.434
  312   HD12  LEU  42          2HD1      LEU  42  -5.134  -3.448  -2.925
  313   HD13  LEU  42          3HD1      LEU  42  -5.625  -2.162  -1.822
  314   HD21  LEU  42          3HD2      LEU  42  -4.784  -3.541   0.792
  315   HD22  LEU  42          1HD2      LEU  42  -4.465  -1.867   0.345
  316   HD23  LEU  42          2HD2      LEU  42  -3.131  -2.928   0.790
  317    H    ARG  43           H        ARG  43  -4.162  -7.704  -1.986
  318    HA   ARG  43           HA       ARG  43  -6.967  -7.310  -2.660
  319    HE   ARG  43           HE       ARG  43  -5.758  -8.662  -6.978
  320    HB2  ARG  43           2HB      ARG  43  -4.967  -9.301  -3.750
  321    HB3  ARG  43           1HB      ARG  43  -6.573  -8.983  -4.398
  322    HG2  ARG  43           2HG      ARG  43  -4.872  -6.619  -4.161
  323    HG3  ARG  43           1HG      ARG  43  -4.295  -7.837  -5.303
  324    HD2  ARG  43           2HD      ARG  43  -7.098  -6.770  -5.261
  325    HD3  ARG  43           1HD      ARG  43  -5.829  -6.090  -6.260
  326   HH11  ARG  43          1HH1      ARG  43  -8.424  -6.449  -6.611
  327   HH12  ARG  43          2HH1      ARG  43  -9.393  -7.212  -7.827
  328   HH21  ARG  43          1HH2      ARG  43  -7.024  -9.673  -8.582
  329   HH22  ARG  43          2HH2      ARG  43  -8.597  -9.045  -8.948
  330    H    GLU  44           H        GLU  44  -5.136  -9.062  -0.468
  331    HA   GLU  44           HA       GLU  44  -6.885 -11.373  -0.339
  332    HB2  GLU  44           2HB      GLU  44  -4.374 -11.414   0.093
  333    HB3  GLU  44           1HB      GLU  44  -4.718 -10.612   1.618
  334    HG2  GLU  44           2HG      GLU  44  -6.065 -12.491   2.337
  335    HG3  GLU  44           1HG      GLU  44  -5.818 -13.287   0.784
  336    H    PHE  45           H        PHE  45  -7.669  -8.474   0.276
  337    HA   PHE  45           HA       PHE  45  -9.135  -7.400   1.630
  338    HD1  PHE  45           1HD      PHE  45 -12.009  -7.737   1.347
  339    HD2  PHE  45           2HD      PHE  45 -10.420  -9.227   5.003
  340    HE1  PHE  45           1HE      PHE  45 -13.824  -6.629   2.584
  341    HE2  PHE  45           2HE      PHE  45 -12.233  -8.123   6.246
  342    HZ   PHE  45           HZ       PHE  45 -13.940  -6.821   5.036
  343    HB2  PHE  45           2HB      PHE  45 -10.388  -9.569   1.389
  344    HB3  PHE  45           1HB      PHE  45  -9.660 -10.087   2.907
  345    H    ALA  46           H        ALA  46  -8.289  -9.877   4.016
  346    HA   ALA  46           HA       ALA  46  -7.548  -7.828   5.906
  347    HB1  ALA  46           3HB      ALA  46  -7.340  -9.635   7.504
  348    HB2  ALA  46           1HB      ALA  46  -7.450 -10.827   6.207
  349    HB3  ALA  46           2HB      ALA  46  -8.838  -9.810   6.591
  Start of MODEL    2
    1    HA   ALA   3           HA       ALA   3  13.141  17.555  -0.568
    2    HB1  ALA   3           3HB      ALA   3  13.210  19.292  -2.274
    3    HB2  ALA   3           1HB      ALA   3  13.866  18.139  -3.436
    4    HB3  ALA   3           2HB      ALA   3  14.811  18.597  -2.019
    5    H    LEU   4           H        LEU   4  12.437  15.403  -3.154
    6    HA   LEU   4           HA       LEU   4   9.696  16.414  -3.396
    7    HG   LEU   4           HG       LEU   4   9.944  17.092  -5.743
    8    HB2  LEU   4           2HB      LEU   4  11.323  14.497  -5.049
    9    HB3  LEU   4           1HB      LEU   4   9.589  14.653  -5.250
   10   HD11  LEU   4          1HD1      LEU   4  12.199  17.794  -6.401
   11   HD12  LEU   4          2HD1      LEU   4  12.838  16.252  -5.832
   12   HD13  LEU   4          3HD1      LEU   4  12.111  17.380  -4.689
   13   HD21  LEU   4          3HD2      LEU   4  10.718  16.706  -8.028
   14   HD22  LEU   4          1HD2      LEU   4   9.585  15.457  -7.513
   15   HD23  LEU   4          2HD2      LEU   4  11.314  15.113  -7.560
   16    H    GLU   5           H        GLU   5   8.255  14.249  -4.028
   17    HA   GLU   5           HA       GLU   5   7.772  13.036  -1.517
   18    HB2  GLU   5           2HB      GLU   5   6.091  11.699  -2.725
   19    HB3  GLU   5           1HB      GLU   5   5.976  13.411  -3.111
   20    HG2  GLU   5           2HG      GLU   5   7.170  13.021  -5.205
   21    HG3  GLU   5           1HG      GLU   5   7.284  11.305  -4.817
   22    H    ASN   6           H        ASN   6   7.454  10.536  -1.455
   23    HA   ASN   6           HA       ASN   6   9.412   8.994  -2.890
   24    HB2  ASN   6           2HB      ASN   6  10.865   9.993  -1.208
   25    HB3  ASN   6           1HB      ASN   6   9.775   9.477   0.075
   26   HD21  ASN   6          1HD2      ASN   6  11.367   8.281   1.098
   27   HD22  ASN   6          2HD2      ASN   6  11.950   6.784   0.462
   28    H    VAL   7           H        VAL   7   7.724   8.850   0.252
   29    HA   VAL   7           HA       VAL   7   6.970   6.120  -0.179
   30    HB   VAL   7           HB       VAL   7   5.716   6.360   1.953
   31   HG11  VAL   7          1HG1      VAL   7   8.575   7.315   1.970
   32   HG12  VAL   7          2HG1      VAL   7   8.021   5.641   1.993
   33   HG13  VAL   7          3HG1      VAL   7   7.704   6.693   3.373
   34   HG21  VAL   7          3HG2      VAL   7   5.980   8.422   3.257
   35   HG22  VAL   7          1HG2      VAL   7   5.086   8.704   1.762
   36   HG23  VAL   7          2HG2      VAL   7   6.779   9.184   1.880
   37    H    ASP   8           H        ASP   8   5.397   9.257  -0.360
   38    HA   ASP   8           HA       ASP   8   2.735   8.512  -0.511
   39    HB2  ASP   8           2HB      ASP   8   3.557  10.854  -0.414
   40    HB3  ASP   8           1HB      ASP   8   4.082  10.712  -2.089
   41    H    ALA   9           H        ALA   9   5.216   8.464  -3.005
   42    HA   ALA   9           HA       ALA   9   3.603   8.024  -5.242
   43    HB1  ALA   9           3HB      ALA   9   5.922   8.563  -5.511
   44    HB2  ALA   9           1HB      ALA   9   5.638   6.979  -6.236
   45    HB3  ALA   9           2HB      ALA   9   6.408   7.101  -4.654
   46    H    LYS  10           H        LYS  10   5.122   5.668  -3.045
   47    HA   LYS  10           HA       LYS  10   4.081   3.395  -4.361
   48    HB2  LYS  10           2HB      LYS  10   4.879   3.645  -1.460
   49    HB3  LYS  10           1HB      LYS  10   4.751   2.156  -2.383
   50    HG2  LYS  10           2HG      LYS  10   6.789   4.340  -2.630
   51    HG3  LYS  10           1HG      LYS  10   7.047   2.636  -2.258
   52    HD2  LYS  10           2HD      LYS  10   6.147   3.785  -4.898
   53    HD3  LYS  10           1HD      LYS  10   7.740   3.124  -4.537
   54    HE2  LYS  10           2HE      LYS  10   6.570   0.946  -4.006
   55    HE3  LYS  10           1HE      LYS  10   5.114   1.661  -4.702
   56    HZ1  LYS  10           3HZ      LYS  10   7.697   1.329  -6.133
   57    HZ2  LYS  10           1HZ      LYS  10   6.259   1.931  -6.790
   58    HZ3  LYS  10           2HZ      LYS  10   6.355   0.315  -6.304
   59    H    ILE  11           H        ILE  11   2.878   5.426  -1.745
   60    HA   ILE  11           HA       ILE  11   0.732   3.830  -0.933
   61    HB   ILE  11           HB       ILE  11   0.836   6.850  -1.019
   62   HG12  ILE  11          2HG1      ILE  11   1.597   4.878   1.152
   63   HG13  ILE  11          1HG1      ILE  11   2.704   5.897   0.244
   64   HG21  ILE  11          1HG2      ILE  11  -0.739   5.456   1.038
   65   HG22  ILE  11          2HG2      ILE  11  -1.353   5.305  -0.609
   66   HG23  ILE  11          3HG2      ILE  11  -1.119   6.905   0.104
   67   HD11  ILE  11          3HD1      ILE  11   2.380   6.848   2.407
   68   HD12  ILE  11          1HD1      ILE  11   0.628   6.797   2.221
   69   HD13  ILE  11          2HD1      ILE  11   1.588   7.884   1.220
   70    H    ALA  12           H        ALA  12   0.708   6.578  -3.209
   71    HA   ALA  12           HA       ALA  12  -1.889   6.196  -4.164
   72    HB1  ALA  12           3HB      ALA  12  -0.600   8.236  -4.596
   73    HB2  ALA  12           1HB      ALA  12  -1.198   7.534  -6.100
   74    HB3  ALA  12           2HB      ALA  12   0.493   7.328  -5.642
   75    H    LYS  13           H        LYS  13   1.194   4.798  -5.081
   76    HA   LYS  13           HA       LYS  13   0.475   3.459  -7.409
   77    HB2  LYS  13           2HB      LYS  13   2.790   3.599  -6.662
   78    HB3  LYS  13           1HB      LYS  13   2.421   2.641  -5.239
   79    HG2  LYS  13           2HG      LYS  13   3.599   1.368  -6.979
   80    HG3  LYS  13           1HG      LYS  13   2.021   0.689  -6.588
   81    HD2  LYS  13           2HD      LYS  13   1.098   1.895  -8.570
   82    HD3  LYS  13           1HD      LYS  13   2.751   2.350  -8.996
   83    HE2  LYS  13           2HE      LYS  13   1.733  -0.457  -8.662
   84    HE3  LYS  13           1HE      LYS  13   1.953   0.357 -10.210
   85    HZ1  LYS  13           3HZ      LYS  13   4.319   0.556  -9.708
   86    HZ2  LYS  13           1HZ      LYS  13   3.830  -1.064  -9.712
   87    HZ3  LYS  13           2HZ      LYS  13   4.093  -0.265  -8.246
   88    H    LEU  14           H        LEU  14  -0.226   2.789  -4.064
   89    HA   LEU  14           HA       LEU  14  -1.338   0.165  -4.666
   90    HG   LEU  14           HG       LEU  14  -0.500  -1.183  -3.030
   91    HB2  LEU  14           2HB      LEU  14  -0.696   1.701  -2.219
   92    HB3  LEU  14           1HB      LEU  14  -2.087   0.639  -2.112
   93   HD11  LEU  14          1HD1      LEU  14   1.313   0.324  -3.667
   94   HD12  LEU  14          2HD1      LEU  14   1.842  -0.872  -2.485
   95   HD13  LEU  14          3HD1      LEU  14   1.520   0.786  -1.978
   96   HD21  LEU  14          3HD2      LEU  14  -0.145  -0.076  -0.250
   97   HD22  LEU  14          1HD2      LEU  14   0.257  -1.713  -0.770
   98   HD23  LEU  14          2HD2      LEU  14  -1.423  -1.172  -0.778
   99    H    MET  15           H        MET  15  -2.332   3.447  -4.130
  100    HA   MET  15           HA       MET  15  -5.065   3.044  -3.592
  101    HB2  MET  15           2HB      MET  15  -3.395   5.223  -3.771
  102    HB3  MET  15           1HB      MET  15  -4.428   5.430  -5.179
  103    HG2  MET  15           2HG      MET  15  -5.359   5.109  -2.336
  104    HG3  MET  15           1HG      MET  15  -5.297   6.618  -3.244
  105    HE1  MET  15           3HE      MET  15  -7.832   7.043  -2.589
  106    HE2  MET  15           1HE      MET  15  -7.917   5.505  -1.732
  107    HE3  MET  15           2HE      MET  15  -9.143   5.913  -2.933
  108    H    GLY  16           H        GLY  16  -3.198   2.799  -6.477
  109    HA2  GLY  16           2HA      GLY  16  -4.946   3.294  -8.525
  110    HA3  GLY  16           1HA      GLY  16  -3.787   1.971  -8.544
  111    H    GLU  17           H        GLU  17  -4.615   0.161  -6.882
  112    HA   GLU  17           HA       GLU  17  -6.738  -1.131  -8.125
  113    HB2  GLU  17           2HB      GLU  17  -5.439  -1.497  -5.437
  114    HB3  GLU  17           1HB      GLU  17  -6.783  -2.516  -5.951
  115    HG2  GLU  17           2HG      GLU  17  -5.560  -3.437  -7.720
  116    HG3  GLU  17           1HG      GLU  17  -4.323  -2.174  -7.630
  117    H    GLY  18           H        GLY  18  -6.679   1.066  -5.404
  118    HA2  GLY  18           2HA      GLY  18  -8.419   2.378  -4.609
  119    HA3  GLY  18           1HA      GLY  18  -9.529   1.496  -5.647
  120    H    TYR  19           H        TYR  19  -7.942   1.588  -2.549
  121    HA   TYR  19           HA       TYR  19 -10.047  -0.068  -1.420
  122    HD1  TYR  19           1HD      TYR  19  -8.642  -2.349  -3.495
  123    HD2  TYR  19           2HD      TYR  19  -9.383  -2.621   0.686
  124    HE1  TYR  19           1HE      TYR  19  -9.877  -4.443  -3.857
  125    HE2  TYR  19           2HE      TYR  19 -10.620  -4.718   0.335
  126    HH   TYR  19           HH       TYR  19 -10.493  -6.468  -2.534
  127    HB2  TYR  19           2HB      TYR  19  -7.340  -1.029  -1.858
  128    HB3  TYR  19           1HB      TYR  19  -7.770  -1.064  -0.152
  129    H    ALA  20           H        ALA  20  -9.315  -0.335   1.119
  130    HA   ALA  20           HA       ALA  20  -9.623   2.191   2.248
  131    HB1  ALA  20           3HB      ALA  20 -10.022  -0.107   3.304
  132    HB2  ALA  20           1HB      ALA  20  -9.383   1.167   4.343
  133    HB3  ALA  20           2HB      ALA  20  -8.305  -0.077   3.710
  134    H    PHE  21           H        PHE  21  -8.240   3.758   2.918
  135    HA   PHE  21           HA       PHE  21  -5.576   3.735   1.910
  136    HD1  PHE  21           1HD      PHE  21  -9.021   5.546   3.235
  137    HD2  PHE  21           2HD      PHE  21  -5.390   6.295   5.325
  138    HE1  PHE  21           1HE      PHE  21 -10.307   6.235   5.216
  139    HE2  PHE  21           2HE      PHE  21  -6.669   6.984   7.310
  140    HZ   PHE  21           HZ       PHE  21  -9.131   6.954   7.257
  141    HB2  PHE  21           2HB      PHE  21  -5.368   5.937   2.985
  142    HB3  PHE  21           1HB      PHE  21  -6.859   5.817   2.059
  143    H    GLU  22           H        GLU  22  -7.088   3.029   4.942
  144    HA   GLU  22           HA       GLU  22  -4.802   3.150   6.603
  145    HB2  GLU  22           2HB      GLU  22  -7.324   1.502   6.878
  146    HB3  GLU  22           1HB      GLU  22  -6.123   1.712   8.144
  147    HG2  GLU  22           2HG      GLU  22  -6.561   4.110   8.171
  148    HG3  GLU  22           1HG      GLU  22  -7.759   3.907   6.894
  149    H    GLU  23           H        GLU  23  -6.306   0.501   4.785
  150    HA   GLU  23           HA       GLU  23  -4.530  -1.517   5.644
  151    HB2  GLU  23           2HB      GLU  23  -6.301  -1.268   3.221
  152    HB3  GLU  23           1HB      GLU  23  -5.333  -2.702   3.544
  153    HG2  GLU  23           2HG      GLU  23  -6.475  -2.849   5.767
  154    HG3  GLU  23           1HG      GLU  23  -7.563  -1.577   5.212
  155    H    VAL  24           H        VAL  24  -4.334   0.910   3.164
  156    HA   VAL  24           HA       VAL  24  -2.270  -0.246   1.613
  157    HB   VAL  24           HB       VAL  24  -3.076   2.641   1.954
  158   HG11  VAL  24          1HG1      VAL  24  -1.279   1.415  -0.133
  159   HG12  VAL  24          2HG1      VAL  24  -0.757   2.468   1.179
  160   HG13  VAL  24          3HG1      VAL  24  -1.818   3.092  -0.083
  161   HG21  VAL  24          3HG2      VAL  24  -3.635   0.746  -0.320
  162   HG22  VAL  24          1HG2      VAL  24  -4.286   2.368  -0.093
  163   HG23  VAL  24          2HG2      VAL  24  -4.762   1.064   0.994
  164    H    LYS  25           H        LYS  25  -2.055   2.537   3.854
  165    HA   LYS  25           HA       LYS  25   0.720   2.680   3.909
  166    HB2  LYS  25           2HB      LYS  25  -1.362   3.505   5.916
  167    HB3  LYS  25           1HB      LYS  25   0.351   3.748   6.220
  168    HG2  LYS  25           2HG      LYS  25  -0.400   5.779   5.363
  169    HG3  LYS  25           1HG      LYS  25   0.411   4.991   4.016
  170    HD2  LYS  25           2HD      LYS  25  -1.669   4.362   3.030
  171    HD3  LYS  25           1HD      LYS  25  -2.562   4.862   4.468
  172    HE2  LYS  25           2HE      LYS  25  -1.863   7.188   4.069
  173    HE3  LYS  25           1HE      LYS  25  -1.027   6.670   2.606
  174    HZ1  LYS  25           3HZ      LYS  25  -3.160   5.916   1.719
  175    HZ2  LYS  25           1HZ      LYS  25  -3.186   7.571   2.072
  176    HZ3  LYS  25           2HZ      LYS  25  -3.946   6.473   3.110
  177    H    ARG  26           H        ARG  26  -1.438   0.841   6.082
  178    HA   ARG  26           HA       ARG  26   0.591  -0.094   7.786
  179    HE   ARG  26           HE       ARG  26  -4.445  -3.050   6.065
  180    HB2  ARG  26           2HB      ARG  26  -0.970  -1.721   8.576
  181    HB3  ARG  26           1HB      ARG  26  -1.870  -0.250   8.239
  182    HG2  ARG  26           2HG      ARG  26  -2.856  -1.158   6.324
  183    HG3  ARG  26           1HG      ARG  26  -1.686  -2.474   6.240
  184    HD2  ARG  26           2HD      ARG  26  -2.591  -3.424   8.285
  185    HD3  ARG  26           1HD      ARG  26  -3.753  -2.103   8.401
  186   HH11  ARG  26          1HH1      ARG  26  -3.473  -4.856   8.879
  187   HH12  ARG  26          2HH1      ARG  26  -4.454  -6.231   8.495
  188   HH21  ARG  26          1HH2      ARG  26  -5.741  -4.857   5.548
  189   HH22  ARG  26          2HH2      ARG  26  -5.742  -6.233   6.602
  190    H    ALA  27           H        ALA  27  -0.611  -1.293   4.701
  191    HA   ALA  27           HA       ALA  27   0.832  -3.750   4.770
  192    HB1  ALA  27           3HB      ALA  27  -1.141  -3.408   3.342
  193    HB2  ALA  27           1HB      ALA  27   0.263  -3.941   2.416
  194    HB3  ALA  27           2HB      ALA  27  -0.227  -2.248   2.378
  195    H    LEU  28           H        LEU  28   1.568  -0.500   3.739
  196    HA   LEU  28           HA       LEU  28   4.012  -1.237   2.393
  197    HG   LEU  28           HG       LEU  28   1.885   0.089   1.096
  198    HB2  LEU  28           2HB      LEU  28   2.755   1.405   3.115
  199    HB3  LEU  28           1HB      LEU  28   4.340   1.284   2.364
  200   HD11  LEU  28          1HD1      LEU  28   2.931   2.666   0.116
  201   HD12  LEU  28          2HD1      LEU  28   2.039   2.712   1.637
  202   HD13  LEU  28          3HD1      LEU  28   1.274   2.062   0.184
  203   HD21  LEU  28          3HD2      LEU  28   4.364   1.107  -0.247
  204   HD22  LEU  28          1HD2      LEU  28   3.176  -0.051  -0.841
  205   HD23  LEU  28          2HD2      LEU  28   4.303  -0.518   0.432
  206    H    GLU  29           H        GLU  29   3.030  -0.305   5.575
  207    HA   GLU  29           HA       GLU  29   5.635   0.544   6.434
  208    HB2  GLU  29           2HB      GLU  29   3.606   1.464   7.459
  209    HB3  GLU  29           1HB      GLU  29   3.168  -0.135   8.045
  210    HG2  GLU  29           2HG      GLU  29   4.125   1.197   9.822
  211    HG3  GLU  29           1HG      GLU  29   5.170  -0.173   9.444
  212    H    ILE  30           H        ILE  30   3.559  -2.226   7.299
  213    HA   ILE  30           HA       ILE  30   5.320  -3.631   8.880
  214    HB   ILE  30           HB       ILE  30   3.297  -4.777   6.955
  215   HG12  ILE  30          2HG1      ILE  30   3.086  -4.141   9.906
  216   HG13  ILE  30          1HG1      ILE  30   2.396  -3.165   8.615
  217   HG21  ILE  30          1HG2      ILE  30   3.816  -6.309   9.357
  218   HG22  ILE  30          2HG2      ILE  30   5.268  -6.125   8.372
  219   HG23  ILE  30          3HG2      ILE  30   3.810  -6.827   7.669
  220   HD11  ILE  30          3HD1      ILE  30   0.712  -4.563   9.661
  221   HD12  ILE  30          1HD1      ILE  30   1.649  -6.005   9.272
  222   HD13  ILE  30          2HD1      ILE  30   0.956  -5.028   7.977
  223    H    ALA  31           H        ALA  31   4.912  -3.953   5.352
  224    HA   ALA  31           HA       ALA  31   7.177  -5.732   5.177
  225    HB1  ALA  31           3HB      ALA  31   5.518  -4.485   2.989
  226    HB2  ALA  31           1HB      ALA  31   5.241  -6.063   3.724
  227    HB3  ALA  31           2HB      ALA  31   6.705  -5.774   2.783
  228    H    GLN  32           H        GLN  32   7.834  -3.212   6.274
  229    HA   GLN  32           HA       GLN  32   9.404  -1.581   6.150
  230    HB2  GLN  32           2HB      GLN  32  10.411  -3.179   3.791
  231    HB3  GLN  32           1HB      GLN  32  11.306  -1.920   4.631
  232    HG2  GLN  32           2HG      GLN  32  11.223  -3.265   6.687
  233    HG3  GLN  32           1HG      GLN  32  10.394  -4.540   5.796
  234   HE21  GLN  32          1HE2      GLN  32  11.971  -4.058   3.375
  235   HE22  GLN  32          2HE2      GLN  32  13.530  -4.735   3.684
  236    H    ASN  33           H        ASN  33   9.414  -2.140   2.663
  237    HA   ASN  33           HA       ASN  33   7.758   0.206   2.206
  238    HB2  ASN  33           2HB      ASN  33  10.623   0.029   1.256
  239    HB3  ASN  33           1HB      ASN  33   9.458   1.228   0.700
  240   HD21  ASN  33          1HD2      ASN  33  11.419   0.147   3.355
  241   HD22  ASN  33          2HD2      ASN  33  11.269   1.579   4.311
  242    H    ASN  34           H        ASN  34   8.729  -2.860   1.386
  243    HA   ASN  34           HA       ASN  34   8.530  -2.887  -1.410
  244    HB2  ASN  34           2HB      ASN  34   7.943  -5.041   0.613
  245    HB3  ASN  34           1HB      ASN  34   8.011  -5.318  -1.122
  246   HD21  ASN  34          1HD2      ASN  34   9.646  -6.442   1.006
  247   HD22  ASN  34          2HD2      ASN  34  11.280  -6.033   0.623
  248    H    VAL  35           H        VAL  35   6.870  -2.700  -2.749
  249    HA   VAL  35           HA       VAL  35   4.206  -2.359  -1.644
  250    HB   VAL  35           HB       VAL  35   4.487  -0.684  -3.166
  251   HG11  VAL  35          1HG1      VAL  35   6.178  -2.611  -4.718
  252   HG12  VAL  35          2HG1      VAL  35   6.637  -1.086  -3.954
  253   HG13  VAL  35          3HG1      VAL  35   5.637  -1.079  -5.409
  254   HG21  VAL  35          3HG2      VAL  35   3.532  -2.836  -5.050
  255   HG22  VAL  35          1HG2      VAL  35   3.214  -1.104  -5.156
  256   HG23  VAL  35          2HG2      VAL  35   2.517  -2.052  -3.841
  257    H    GLU  36           H        GLU  36   5.979  -4.644  -3.618
  258    HA   GLU  36           HA       GLU  36   3.892  -6.055  -4.782
  259    HB2  GLU  36           2HB      GLU  36   6.483  -7.162  -3.709
  260    HB3  GLU  36           1HB      GLU  36   5.429  -7.971  -4.857
  261    HG2  GLU  36           2HG      GLU  36   5.823  -6.210  -6.484
  262    HG3  GLU  36           1HG      GLU  36   6.847  -5.358  -5.328
  263    H    VAL  37           H        VAL  37   5.477  -6.705  -1.656
  264    HA   VAL  37           HA       VAL  37   3.729  -8.775  -0.879
  265    HB   VAL  37           HB       VAL  37   5.290  -6.896   0.906
  266   HG11  VAL  37          1HG1      VAL  37   3.524  -8.148   2.073
  267   HG12  VAL  37          2HG1      VAL  37   5.140  -8.639   2.579
  268   HG13  VAL  37          3HG1      VAL  37   4.216  -9.655   1.474
  269   HG21  VAL  37          3HG2      VAL  37   6.703  -8.040  -0.748
  270   HG22  VAL  37          1HG2      VAL  37   6.078  -9.592  -0.192
  271   HG23  VAL  37          2HG2      VAL  37   7.032  -8.584   0.897
  272    H    ALA  38           H        ALA  38   3.705  -5.286  -0.340
  273    HA   ALA  38           HA       ALA  38   1.506  -5.160   1.397
  274    HB1  ALA  38           3HB      ALA  38   2.777  -3.217   1.286
  275    HB2  ALA  38           1HB      ALA  38   1.320  -2.783   0.392
  276    HB3  ALA  38           2HB      ALA  38   2.795  -3.213  -0.478
  277    H    ARG  39           H        ARG  39   1.773  -5.522  -2.046
  278    HA   ARG  39           HA       ARG  39  -0.933  -4.848  -2.670
  279    HE   ARG  39           HE       ARG  39  -0.524  -4.976  -6.998
  280    HB2  ARG  39           2HB      ARG  39   1.328  -6.144  -4.161
  281    HB3  ARG  39           1HB      ARG  39  -0.300  -6.180  -4.829
  282    HG2  ARG  39           2HG      ARG  39  -0.381  -3.766  -4.853
  283    HG3  ARG  39           1HG      ARG  39   1.198  -3.681  -4.069
  284    HD2  ARG  39           2HD      ARG  39   1.421  -3.301  -6.448
  285    HD3  ARG  39           1HD      ARG  39   2.204  -4.813  -5.986
  286   HH11  ARG  39          1HH1      ARG  39   2.889  -5.358  -7.580
  287   HH12  ARG  39          2HH1      ARG  39   2.671  -6.365  -8.973
  288   HH21  ARG  39          1HH2      ARG  39  -0.822  -6.300  -8.834
  289   HH22  ARG  39          2HH2      ARG  39   0.563  -6.900  -9.684
  290    H    SER  40           H        SER  40   0.844  -7.828  -2.035
  291    HA   SER  40           HA       SER  40  -1.181  -9.654  -2.678
  292    HG   SER  40           HG       SER  40   2.115 -10.951  -2.249
  293    HB2  SER  40           2HB      SER  40   0.999  -9.895  -0.587
  294    HB3  SER  40           1HB      SER  40   0.040 -11.234  -1.218
  295    H    ILE  41           H        ILE  41  -0.501  -7.826   0.249
  296    HA   ILE  41           HA       ILE  41  -2.641  -9.083   1.736
  297    HB   ILE  41           HB       ILE  41  -1.042  -6.616   2.440
  298   HG12  ILE  41          2HG1      ILE  41  -0.603  -9.479   3.316
  299   HG13  ILE  41          1HG1      ILE  41   0.351  -8.658   2.085
  300   HG21  ILE  41          1HG2      ILE  41  -1.754  -7.103   4.737
  301   HG22  ILE  41          2HG2      ILE  41  -2.729  -8.447   4.144
  302   HG23  ILE  41          3HG2      ILE  41  -3.130  -6.795   3.677
  303   HD11  ILE  41          3HD1      ILE  41   1.086  -7.029   3.756
  304   HD12  ILE  41          1HD1      ILE  41   1.510  -8.679   4.209
  305   HD13  ILE  41          2HD1      ILE  41   0.145  -7.876   4.984
  306    H    LEU  42           H        LEU  42  -2.145  -6.193  -0.157
  307    HA   LEU  42           HA       LEU  42  -4.372  -4.704   0.714
  308    HG   LEU  42           HG       LEU  42  -3.343  -2.128  -1.710
  309    HB2  LEU  42           2HB      LEU  42  -2.328  -4.044  -0.762
  310    HB3  LEU  42           1HB      LEU  42  -3.315  -4.602  -2.094
  311   HD11  LEU  42          1HD1      LEU  42  -6.042  -3.422  -1.398
  312   HD12  LEU  42          2HD1      LEU  42  -5.137  -3.370  -2.910
  313   HD13  LEU  42          3HD1      LEU  42  -5.674  -1.871  -2.151
  314   HD21  LEU  42          3HD2      LEU  42  -4.930  -2.869   0.746
  315   HD22  LEU  42          1HD2      LEU  42  -4.678  -1.240   0.117
  316   HD23  LEU  42          2HD2      LEU  42  -3.313  -2.166   0.738
  317    H    ARG  43           H        ARG  43  -3.978  -7.204  -1.725
  318    HA   ARG  43           HA       ARG  43  -6.354  -6.954  -3.127
  319    HE   ARG  43           HE       ARG  43  -7.801 -10.066  -6.044
  320    HB2  ARG  43           2HB      ARG  43  -4.479  -8.502  -3.680
  321    HB3  ARG  43           1HB      ARG  43  -5.007  -9.555  -2.374
  322    HG2  ARG  43           2HG      ARG  43  -6.196 -10.594  -3.948
  323    HG3  ARG  43           1HG      ARG  43  -7.299  -9.220  -3.828
  324    HD2  ARG  43           2HD      ARG  43  -5.950  -8.080  -5.566
  325    HD3  ARG  43           1HD      ARG  43  -5.030  -9.556  -5.769
  326   HH11  ARG  43          1HH1      ARG  43  -5.085  -8.662  -7.714
  327   HH12  ARG  43          2HH1      ARG  43  -5.728  -8.975  -9.291
  328   HH21  ARG  43          1HH2      ARG  43  -8.656 -10.484  -8.113
  329   HH22  ARG  43          2HH2      ARG  43  -7.760 -10.011  -9.519
  330    H    GLU  44           H        GLU  44  -5.822  -9.343  -0.524
  331    HA   GLU  44           HA       GLU  44  -8.641  -8.975   0.247
  332    HB2  GLU  44           2HB      GLU  44  -7.079 -11.563   0.208
  333    HB3  GLU  44           1HB      GLU  44  -8.715 -11.376   0.821
  334    HG2  GLU  44           2HG      GLU  44  -9.471 -10.717  -1.411
  335    HG3  GLU  44           1HG      GLU  44  -7.831 -10.932  -2.021
  336    H    PHE  45           H        PHE  45  -5.917 -10.827   1.599
  337    HA   PHE  45           HA       PHE  45  -5.574  -9.061   3.817
  338    HD1  PHE  45           2HD      PHE  45  -5.637 -13.129   4.914
  339    HD2  PHE  45           1HD      PHE  45  -9.089 -11.199   3.344
  340    HE1  PHE  45           2HE      PHE  45  -6.551 -15.315   4.248
  341    HE2  PHE  45           1HE      PHE  45 -10.010 -13.380   2.676
  342    HZ   PHE  45           HZ       PHE  45  -8.741 -15.441   3.128
  343    HB2  PHE  45           2HB      PHE  45  -6.254 -10.805   5.537
  344    HB3  PHE  45           1HB      PHE  45  -7.568  -9.995   4.692
  345    H    ALA  46           H        ALA  46  -4.865 -11.927   2.057
  346    HA   ALA  46           HA       ALA  46  -2.302 -12.158   3.494
  347    HB1  ALA  46           3HB      ALA  46  -2.324 -14.558   3.101
  348    HB2  ALA  46           1HB      ALA  46  -3.882 -14.425   2.286
  349    HB3  ALA  46           2HB      ALA  46  -3.753 -14.066   4.008
  Start of MODEL    3
    1    HA   ALA   3           HA       ALA   3  15.489  10.605  -5.589
    2    HB1  ALA   3           3HB      ALA   3  16.632  12.111  -7.937
    3    HB2  ALA   3           1HB      ALA   3  17.555  11.189  -6.751
    4    HB3  ALA   3           2HB      ALA   3  16.672  12.632  -6.251
    5    H    LEU   4           H        LEU   4  13.355  10.277  -7.910
    6    HA   LEU   4           HA       LEU   4  12.031  12.865  -7.449
    7    HG   LEU   4           HG       LEU   4   9.531  12.154  -9.172
    8    HB2  LEU   4           2HB      LEU   4  12.478  12.356  -9.806
    9    HB3  LEU   4           1HB      LEU   4  11.588  10.852  -9.655
   10   HD11  LEU   4          1HD1      LEU   4  11.263  14.527  -9.842
   11   HD12  LEU   4          2HD1      LEU   4  10.562  14.162  -8.266
   12   HD13  LEU   4          3HD1      LEU   4   9.513  14.555  -9.628
   13   HD21  LEU   4          3HD2      LEU   4  10.921  12.854 -11.755
   14   HD22  LEU   4          1HD2      LEU   4   9.184  12.938 -11.461
   15   HD23  LEU   4          2HD2      LEU   4  10.008  11.380 -11.433
   16    H    GLU   5           H        GLU   5  11.154   9.450  -8.022
   17    HA   GLU   5           HA       GLU   5   8.582   9.641  -6.916
   18    HB2  GLU   5           2HB      GLU   5   8.639   7.179  -6.831
   19    HB3  GLU   5           1HB      GLU   5   9.206   7.802  -8.373
   20    HG2  GLU   5           2HG      GLU   5  11.513   7.441  -7.681
   21    HG3  GLU   5           1HG      GLU   5  10.955   6.838  -6.121
   22    H    ASN   6           H        ASN   6   7.770   9.333  -4.904
   23    HA   ASN   6           HA       ASN   6   9.700   8.872  -2.728
   24    HB2  ASN   6           2HB      ASN   6   8.227  10.417  -1.353
   25    HB3  ASN   6           1HB      ASN   6   9.173  11.189  -2.621
   26   HD21  ASN   6          1HD2      ASN   6   7.767  12.940  -2.691
   27   HD22  ASN   6          2HD2      ASN   6   6.204  12.829  -3.420
   28    H    VAL   7           H        VAL   7   8.228   8.547  -0.580
   29    HA   VAL   7           HA       VAL   7   7.150   6.007  -0.755
   30    HB   VAL   7           HB       VAL   7   7.854   7.073   1.360
   31   HG11  VAL   7          1HG1      VAL   7   6.338   8.566   2.549
   32   HG12  VAL   7          2HG1      VAL   7   5.238   8.560   1.170
   33   HG13  VAL   7          3HG1      VAL   7   6.845   9.271   1.013
   34   HG21  VAL   7          3HG2      VAL   7   5.037   5.999   1.345
   35   HG22  VAL   7          1HG2      VAL   7   6.077   6.118   2.766
   36   HG23  VAL   7          2HG2      VAL   7   6.523   5.054   1.431
   37    H    ASP   8           H        ASP   8   5.553   9.125  -1.104
   38    HA   ASP   8           HA       ASP   8   2.885   8.304  -0.977
   39    HB2  ASP   8           2HB      ASP   8   4.054  10.481  -2.726
   40    HB3  ASP   8           1HB      ASP   8   2.369  10.336  -2.234
   41    H    ALA   9           H        ALA   9   5.129   8.403  -3.716
   42    HA   ALA   9           HA       ALA   9   3.390   7.727  -5.768
   43    HB1  ALA   9           3HB      ALA   9   5.694   8.389  -6.170
   44    HB2  ALA   9           1HB      ALA   9   5.363   6.835  -6.934
   45    HB3  ALA   9           2HB      ALA   9   6.269   6.900  -5.422
   46    H    LYS  10           H        LYS  10   4.941   5.694  -3.358
   47    HA   LYS  10           HA       LYS  10   4.138   3.215  -4.517
   48    HB2  LYS  10           2HB      LYS  10   4.777   3.685  -1.606
   49    HB3  LYS  10           1HB      LYS  10   4.953   2.197  -2.525
   50    HG2  LYS  10           2HG      LYS  10   6.510   4.541  -3.443
   51    HG3  LYS  10           1HG      LYS  10   7.007   3.774  -1.935
   52    HD2  LYS  10           2HD      LYS  10   8.218   2.827  -3.818
   53    HD3  LYS  10           1HD      LYS  10   7.164   1.616  -3.093
   54    HE2  LYS  10           2HE      LYS  10   5.580   1.835  -4.852
   55    HE3  LYS  10           1HE      LYS  10   6.409   3.246  -5.508
   56    HZ1  LYS  10           3HZ      LYS  10   7.510   0.488  -5.414
   57    HZ2  LYS  10           1HZ      LYS  10   8.294   1.842  -6.059
   58    HZ3  LYS  10           2HZ      LYS  10   6.887   1.251  -6.788
   59    H    ILE  11           H        ILE  11   2.872   5.328  -1.989
   60    HA   ILE  11           HA       ILE  11   0.766   3.713  -1.119
   61    HB   ILE  11           HB       ILE  11   0.820   6.733  -1.268
   62   HG12  ILE  11          2HG1      ILE  11   1.660   4.832   0.939
   63   HG13  ILE  11          1HG1      ILE  11   2.739   5.817  -0.039
   64   HG21  ILE  11          1HG2      ILE  11  -0.675   5.338   0.852
   65   HG22  ILE  11          2HG2      ILE  11  -1.332   5.167  -0.777
   66   HG23  ILE  11          3HG2      ILE  11  -1.101   6.775  -0.082
   67   HD11  ILE  11          3HD1      ILE  11   2.459   6.842   2.106
   68   HD12  ILE  11          1HD1      ILE  11   0.704   6.801   1.943
   69   HD13  ILE  11          2HD1      ILE  11   1.661   7.840   0.890
   70    H    ALA  12           H        ALA  12   0.635   6.426  -3.438
   71    HA   ALA  12           HA       ALA  12  -1.971   6.038  -4.314
   72    HB1  ALA  12           3HB      ALA  12   0.376   7.061  -5.916
   73    HB2  ALA  12           1HB      ALA  12  -0.658   8.029  -4.864
   74    HB3  ALA  12           2HB      ALA  12  -1.327   7.288  -6.317
   75    H    LYS  13           H        LYS  13   1.043   4.520  -5.297
   76    HA   LYS  13           HA       LYS  13   0.203   3.143  -7.556
   77    HB2  LYS  13           2HB      LYS  13   2.546   3.208  -6.824
   78    HB3  LYS  13           1HB      LYS  13   2.145   2.227  -5.423
   79    HG2  LYS  13           2HG      LYS  13   3.214   0.898  -7.155
   80    HG3  LYS  13           1HG      LYS  13   1.556   0.363  -6.874
   81    HD2  LYS  13           2HD      LYS  13   0.799   1.293  -8.882
   82    HD3  LYS  13           1HD      LYS  13   2.220   2.327  -9.039
   83    HE2  LYS  13           2HE      LYS  13   2.299   0.459 -10.610
   84    HE3  LYS  13           1HE      LYS  13   3.614   0.394  -9.438
   85    HZ1  LYS  13           3HZ      LYS  13   1.106  -1.193  -9.308
   86    HZ2  LYS  13           1HZ      LYS  13   2.371  -1.256  -8.184
   87    HZ3  LYS  13           2HZ      LYS  13   2.622  -1.782  -9.772
   88    H    LEU  14           H        LEU  14  -0.278   2.470  -4.139
   89    HA   LEU  14           HA       LEU  14  -1.557  -0.075  -4.677
   90    HG   LEU  14           HG       LEU  14  -0.567  -1.391  -3.079
   91    HB2  LEU  14           2HB      LEU  14  -0.853   1.484  -2.246
   92    HB3  LEU  14           1HB      LEU  14  -2.189   0.354  -2.119
   93   HD11  LEU  14          1HD1      LEU  14   1.139   0.208  -3.822
   94   HD12  LEU  14          2HD1      LEU  14   1.788  -0.980  -2.691
   95   HD13  LEU  14          3HD1      LEU  14   1.433   0.658  -2.142
   96   HD21  LEU  14          3HD2      LEU  14  -0.068  -0.255  -0.333
   97   HD22  LEU  14          1HD2      LEU  14   0.313  -1.890  -0.871
   98   HD23  LEU  14          2HD2      LEU  14  -1.368  -1.366  -0.769
   99    H    MET  15           H        MET  15  -2.462   3.245  -4.171
  100    HA   MET  15           HA       MET  15  -5.189   2.874  -3.554
  101    HB2  MET  15           2HB      MET  15  -3.784   5.172  -4.929
  102    HB3  MET  15           1HB      MET  15  -5.454   5.219  -4.381
  103    HG2  MET  15           2HG      MET  15  -4.670   4.804  -2.076
  104    HG3  MET  15           1HG      MET  15  -3.008   4.878  -2.661
  105    HE1  MET  15           3HE      MET  15  -5.945   8.437  -2.676
  106    HE2  MET  15           1HE      MET  15  -6.319   6.846  -2.010
  107    HE3  MET  15           2HE      MET  15  -6.123   7.050  -3.752
  108    H    GLY  16           H        GLY  16  -3.398   2.545  -6.469
  109    HA2  GLY  16           2HA      GLY  16  -5.207   3.036  -8.477
  110    HA3  GLY  16           1HA      GLY  16  -4.046   1.713  -8.514
  111    H    GLU  17           H        GLU  17  -4.827  -0.032  -6.741
  112    HA   GLU  17           HA       GLU  17  -6.966  -1.389  -7.892
  113    HB2  GLU  17           2HB      GLU  17  -5.653  -1.636  -5.189
  114    HB3  GLU  17           1HB      GLU  17  -6.946  -2.717  -5.705
  115    HG2  GLU  17           2HG      GLU  17  -5.656  -3.668  -7.385
  116    HG3  GLU  17           1HG      GLU  17  -4.508  -2.320  -7.392
  117    H    GLY  18           H        GLY  18  -6.849   0.923  -5.275
  118    HA2  GLY  18           2HA      GLY  18  -8.578   2.283  -4.528
  119    HA3  GLY  18           1HA      GLY  18  -9.716   1.312  -5.451
  120    H    TYR  19           H        TYR  19  -7.906   1.554  -2.463
  121    HA   TYR  19           HA       TYR  19  -9.974   0.001  -1.116
  122    HD1  TYR  19           1HD      TYR  19  -8.582  -2.254  -3.187
  123    HD2  TYR  19           2HD      TYR  19  -9.175  -2.547   1.017
  124    HE1  TYR  19           1HE      TYR  19  -9.764  -4.386  -3.507
  125    HE2  TYR  19           2HE      TYR  19 -10.359  -4.679   0.707
  126    HH   TYR  19           HH       TYR  19 -11.546  -5.897  -1.001
  127    HB2  TYR  19           2HB      TYR  19  -7.229  -0.920  -1.548
  128    HB3  TYR  19           1HB      TYR  19  -7.695  -0.914   0.149
  129    H    ALA  20           H        ALA  20  -9.275  -0.033   1.386
  130    HA   ALA  20           HA       ALA  20  -9.481   2.585   2.306
  131    HB1  ALA  20           3HB      ALA  20  -9.959   0.373   3.533
  132    HB2  ALA  20           1HB      ALA  20  -9.321   1.725   4.470
  133    HB3  ALA  20           2HB      ALA  20  -8.250   0.415   3.972
  134    H    PHE  21           H        PHE  21  -8.011   4.029   3.228
  135    HA   PHE  21           HA       PHE  21  -5.367   3.929   2.110
  136    HD1  PHE  21           2HD      PHE  21  -8.718   6.065   3.168
  137    HD2  PHE  21           1HD      PHE  21  -5.292   6.263   5.685
  138    HE1  PHE  21           2HE      PHE  21 -10.141   6.782   5.042
  139    HE2  PHE  21           1HE      PHE  21  -6.710   6.980   7.564
  140    HZ   PHE  21           HZ       PHE  21  -9.137   7.241   7.244
  141    HB2  PHE  21           2HB      PHE  21  -5.059   6.105   3.301
  142    HB3  PHE  21           1HB      PHE  21  -6.464   6.079   2.242
  143    H    GLU  22           H        GLU  22  -6.851   3.460   5.243
  144    HA   GLU  22           HA       GLU  22  -4.528   3.409   6.816
  145    HB2  GLU  22           2HB      GLU  22  -6.802   3.532   7.753
  146    HB3  GLU  22           1HB      GLU  22  -7.117   1.891   7.205
  147    HG2  GLU  22           2HG      GLU  22  -5.389   1.046   8.690
  148    HG3  GLU  22           1HG      GLU  22  -5.027   2.689   9.215
  149    H    GLU  23           H        GLU  23  -6.196   0.880   4.996
  150    HA   GLU  23           HA       GLU  23  -4.597  -1.272   5.892
  151    HB2  GLU  23           2HB      GLU  23  -6.296  -0.914   3.430
  152    HB3  GLU  23           1HB      GLU  23  -5.492  -2.425   3.838
  153    HG2  GLU  23           2HG      GLU  23  -6.700  -2.353   6.032
  154    HG3  GLU  23           1HG      GLU  23  -7.638  -1.007   5.386
  155    H    VAL  24           H        VAL  24  -4.239   1.048   3.294
  156    HA   VAL  24           HA       VAL  24  -2.200  -0.320   1.874
  157    HB   VAL  24           HB       VAL  24  -2.911   2.613   1.943
  158   HG11  VAL  24          1HG1      VAL  24  -1.207   1.189  -0.094
  159   HG12  VAL  24          2HG1      VAL  24  -0.560   2.169   1.218
  160   HG13  VAL  24          3HG1      VAL  24  -1.572   2.912  -0.018
  161   HG21  VAL  24          3HG2      VAL  24  -3.478   0.626  -0.239
  162   HG22  VAL  24          1HG2      VAL  24  -4.184   2.224   0.003
  163   HG23  VAL  24          2HG2      VAL  24  -4.596   0.901   1.095
  164    H    LYS  25           H        LYS  25  -1.905   2.654   3.841
  165    HA   LYS  25           HA       LYS  25   0.859   2.718   3.951
  166    HB2  LYS  25           2HB      LYS  25  -1.213   3.728   5.887
  167    HB3  LYS  25           1HB      LYS  25   0.504   3.991   6.140
  168    HG2  LYS  25           2HG      LYS  25  -0.299   5.946   5.134
  169    HG3  LYS  25           1HG      LYS  25   0.551   5.069   3.867
  170    HD2  LYS  25           2HD      LYS  25  -1.471   4.367   2.863
  171    HD3  LYS  25           1HD      LYS  25  -2.418   4.843   4.273
  172    HE2  LYS  25           2HE      LYS  25  -0.955   6.710   2.410
  173    HE3  LYS  25           1HE      LYS  25  -2.695   6.428   2.435
  174    HZ1  LYS  25           3HZ      LYS  25  -1.093   7.589   4.649
  175    HZ2  LYS  25           1HZ      LYS  25  -2.759   7.298   4.694
  176    HZ3  LYS  25           2HZ      LYS  25  -2.128   8.443   3.620
  177    H    ARG  26           H        ARG  26  -1.378   1.156   6.249
  178    HA   ARG  26           HA       ARG  26   0.608   0.290   8.035
  179    HE   ARG  26           HE       ARG  26  -4.184  -3.029   6.635
  180    HB2  ARG  26           2HB      ARG  26  -1.034  -1.021   9.065
  181    HB3  ARG  26           1HB      ARG  26  -1.934   0.320   8.375
  182    HG2  ARG  26           2HG      ARG  26  -2.512  -1.129   6.449
  183    HG3  ARG  26           1HG      ARG  26  -1.730  -2.475   7.284
  184    HD2  ARG  26           2HD      ARG  26  -3.262  -2.143   9.186
  185    HD3  ARG  26           1HD      ARG  26  -4.059  -0.854   8.287
  186   HH11  ARG  26          1HH1      ARG  26  -5.192  -2.344   9.900
  187   HH12  ARG  26          2HH1      ARG  26  -6.532  -3.440   9.853
  188   HH21  ARG  26          1HH2      ARG  26  -5.947  -4.474   6.565
  189   HH22  ARG  26          2HH2      ARG  26  -6.960  -4.651   7.959
  190    H    ALA  27           H        ALA  27  -0.716  -1.178   5.109
  191    HA   ALA  27           HA       ALA  27   0.626  -3.670   5.414
  192    HB1  ALA  27           3HB      ALA  27  -1.336  -3.408   3.971
  193    HB2  ALA  27           1HB      ALA  27   0.039  -4.060   3.081
  194    HB3  ALA  27           2HB      ALA  27  -0.407  -2.363   2.898
  195    H    LEU  28           H        LEU  28   1.547  -0.560   4.205
  196    HA   LEU  28           HA       LEU  28   3.815  -1.437   2.704
  197    HG   LEU  28           HG       LEU  28   1.916   0.186   1.532
  198    HB2  LEU  28           2HB      LEU  28   2.823   1.223   3.666
  199    HB3  LEU  28           1HB      LEU  28   4.421   1.069   2.955
  200   HD11  LEU  28          1HD1      LEU  28   2.146   2.312   0.267
  201   HD12  LEU  28          2HD1      LEU  28   3.347   2.835   1.450
  202   HD13  LEU  28          3HD1      LEU  28   1.683   2.539   1.955
  203   HD21  LEU  28          3HD2      LEU  28   4.535   0.994   0.321
  204   HD22  LEU  28          1HD2      LEU  28   3.256  -0.013  -0.361
  205   HD23  LEU  28          2HD2      LEU  28   4.287  -0.642   0.926
  206    H    GLU  29           H        GLU  29   3.463   0.205   5.849
  207    HA   GLU  29           HA       GLU  29   6.187   0.232   6.496
  208    HB2  GLU  29           2HB      GLU  29   4.548   1.616   7.662
  209    HB3  GLU  29           1HB      GLU  29   3.785   0.181   8.332
  210    HG2  GLU  29           2HG      GLU  29   5.794  -0.320   9.599
  211    HG3  GLU  29           1HG      GLU  29   6.604   1.079   8.893
  212    H    ILE  30           H        ILE  30   3.654  -2.130   7.284
  213    HA   ILE  30           HA       ILE  30   5.142  -3.809   8.938
  214    HB   ILE  30           HB       ILE  30   2.864  -4.442   7.068
  215   HG12  ILE  30          2HG1      ILE  30   2.961  -4.181  10.081
  216   HG13  ILE  30          1HG1      ILE  30   2.444  -2.900   8.989
  217   HG21  ILE  30          1HG2      ILE  30   3.024  -6.376   9.112
  218   HG22  ILE  30          2HG2      ILE  30   4.631  -6.254   8.394
  219   HG23  ILE  30          3HG2      ILE  30   3.233  -6.608   7.377
  220   HD11  ILE  30          3HD1      ILE  30   0.541  -4.039   9.961
  221   HD12  ILE  30          1HD1      ILE  30   1.117  -5.580   9.324
  222   HD13  ILE  30          2HD1      ILE  30   0.602  -4.307   8.218
  223    H    ALA  31           H        ALA  31   4.792  -3.851   5.407
  224    HA   ALA  31           HA       ALA  31   6.498  -6.151   5.137
  225    HB1  ALA  31           3HB      ALA  31   5.421  -4.278   3.034
  226    HB2  ALA  31           1HB      ALA  31   4.672  -5.783   3.570
  227    HB3  ALA  31           2HB      ALA  31   6.224  -5.819   2.735
  228    H    GLN  32           H        GLN  32   7.507  -3.589   6.371
  229    HA   GLN  32           HA       GLN  32   9.419  -2.370   6.443
  230    HB2  GLN  32           2HB      GLN  32  10.486  -4.521   4.607
  231    HB3  GLN  32           1HB      GLN  32  11.448  -3.401   5.560
  232    HG2  GLN  32           2HG      GLN  32  10.454  -4.374   7.609
  233    HG3  GLN  32           1HG      GLN  32   9.644  -5.570   6.599
  234   HE21  GLN  32          1HE2      GLN  32  12.686  -4.465   7.862
  235   HE22  GLN  32          2HE2      GLN  32  13.598  -5.877   7.463
  236    H    ASN  33           H        ASN  33   7.678  -1.212   4.824
  237    HA   ASN  33           HA       ASN  33   7.422   0.274   3.126
  238    HB2  ASN  33           2HB      ASN  33  10.447   0.235   3.085
  239    HB3  ASN  33           1HB      ASN  33   9.421   1.472   2.363
  240   HD21  ASN  33          1HD2      ASN  33   8.319   2.910   3.695
  241   HD22  ASN  33          2HD2      ASN  33   8.755   3.142   5.351
  242    H    ASN  34           H        ASN  34   6.835  -2.087   2.208
  243    HA   ASN  34           HA       ASN  34   8.139  -2.221  -0.426
  244    HB2  ASN  34           2HB      ASN  34   7.331  -4.493   1.371
  245    HB3  ASN  34           1HB      ASN  34   7.576  -4.713  -0.357
  246   HD21  ASN  34          1HD2      ASN  34   9.304  -6.090  -0.085
  247   HD22  ASN  34          2HD2      ASN  34  10.848  -5.553   0.473
  248    H    VAL  35           H        VAL  35   6.795  -1.991  -2.082
  249    HA   VAL  35           HA       VAL  35   3.959  -1.779  -1.589
  250    HB   VAL  35           HB       VAL  35   4.460  -0.145  -3.091
  251   HG11  VAL  35          1HG1      VAL  35   6.566  -1.997  -4.155
  252   HG12  VAL  35          2HG1      VAL  35   6.760  -0.432  -3.365
  253   HG13  VAL  35          3HG1      VAL  35   6.111  -0.518  -5.000
  254   HG21  VAL  35          3HG2      VAL  35   4.150  -2.321  -5.141
  255   HG22  VAL  35          1HG2      VAL  35   3.601  -0.648  -5.225
  256   HG23  VAL  35          2HG2      VAL  35   2.813  -1.782  -4.128
  257    H    GLU  36           H        GLU  36   6.042  -3.812  -3.641
  258    HA   GLU  36           HA       GLU  36   4.155  -5.353  -4.897
  259    HB2  GLU  36           2HB      GLU  36   5.923  -7.214  -4.750
  260    HB3  GLU  36           1HB      GLU  36   6.376  -5.709  -5.539
  261    HG2  GLU  36           2HG      GLU  36   7.446  -4.976  -3.439
  262    HG3  GLU  36           1HG      GLU  36   7.071  -6.548  -2.734
  263    H    VAL  37           H        VAL  37   5.687  -6.207  -1.772
  264    HA   VAL  37           HA       VAL  37   4.112  -8.463  -1.267
  265    HB   VAL  37           HB       VAL  37   5.264  -6.607   0.820
  266   HG11  VAL  37          1HG1      VAL  37   3.692  -8.276   1.681
  267   HG12  VAL  37          2HG1      VAL  37   5.341  -8.593   2.219
  268   HG13  VAL  37          3HG1      VAL  37   4.639  -9.555   0.920
  269   HG21  VAL  37          3HG2      VAL  37   6.568  -8.897  -0.647
  270   HG22  VAL  37          1HG2      VAL  37   7.252  -8.063   0.748
  271   HG23  VAL  37          2HG2      VAL  37   6.997  -7.190  -0.762
  272    H    ALA  38           H        ALA  38   3.718  -5.127  -0.083
  273    HA   ALA  38           HA       ALA  38   1.294  -5.560   1.276
  274    HB1  ALA  38           3HB      ALA  38   2.457  -3.624   1.865
  275    HB2  ALA  38           1HB      ALA  38   1.071  -3.020   0.955
  276    HB3  ALA  38           2HB      ALA  38   2.656  -3.124   0.185
  277    H    ARG  39           H        ARG  39   2.038  -5.290  -2.048
  278    HA   ARG  39           HA       ARG  39  -0.566  -4.398  -2.903
  279    HE   ARG  39           HE       ARG  39   0.564  -6.816  -6.213
  280    HB2  ARG  39           2HB      ARG  39   1.660  -4.009  -4.115
  281    HB3  ARG  39           1HB      ARG  39   1.535  -5.675  -4.656
  282    HG2  ARG  39           2HG      ARG  39  -0.890  -4.791  -5.372
  283    HG3  ARG  39           1HG      ARG  39   0.031  -3.287  -5.477
  284    HD2  ARG  39           2HD      ARG  39   0.149  -4.298  -7.613
  285    HD3  ARG  39           1HD      ARG  39   1.715  -4.527  -6.836
  286   HH11  ARG  39          1HH1      ARG  39   0.528  -5.091  -9.243
  287   HH12  ARG  39          2HH1      ARG  39   0.392  -6.525 -10.204
  288   HH21  ARG  39          1HH2      ARG  39   0.385  -8.705  -7.471
  289   HH22  ARG  39          2HH2      ARG  39   0.308  -8.580  -9.197
  290    H    SER  40           H        SER  40   1.127  -7.415  -2.458
  291    HA   SER  40           HA       SER  40  -0.755  -9.043  -3.852
  292    HG   SER  40           HG       SER  40  -0.519 -11.310  -2.280
  293    HB2  SER  40           2HB      SER  40   1.550  -9.801  -3.470
  294    HB3  SER  40           1HB      SER  40   1.275  -9.787  -1.728
  295    H    ILE  41           H        ILE  41  -0.331  -7.984  -0.525
  296    HA   ILE  41           HA       ILE  41  -2.517  -9.601   0.453
  297    HB   ILE  41           HB       ILE  41  -0.584  -9.071   1.895
  298   HG12  ILE  41          2HG1      ILE  41  -3.165  -7.883   2.941
  299   HG13  ILE  41          1HG1      ILE  41  -2.827  -9.609   2.845
  300   HG21  ILE  41          1HG2      ILE  41  -0.142  -6.814   1.086
  301   HG22  ILE  41          2HG2      ILE  41  -0.332  -6.832   2.839
  302   HG23  ILE  41          3HG2      ILE  41  -1.645  -6.250   1.815
  303   HD11  ILE  41          3HD1      ILE  41  -2.482  -8.798   5.092
  304   HD12  ILE  41          1HD1      ILE  41  -1.336  -7.592   4.507
  305   HD13  ILE  41          2HD1      ILE  41  -0.947  -9.309   4.390
  306    H    LEU  42           H        LEU  42  -2.072  -6.403  -0.803
  307    HA   LEU  42           HA       LEU  42  -4.278  -5.087   0.303
  308    HG   LEU  42           HG       LEU  42  -3.388  -2.217  -1.804
  309    HB2  LEU  42           2HB      LEU  42  -2.329  -4.228  -1.199
  310    HB3  LEU  42           1HB      LEU  42  -3.390  -4.633  -2.528
  311   HD11  LEU  42          1HD1      LEU  42  -5.190  -3.266  -3.143
  312   HD12  LEU  42          2HD1      LEU  42  -5.746  -1.934  -2.131
  313   HD13  LEU  42          3HD1      LEU  42  -6.061  -3.599  -1.646
  314   HD21  LEU  42          3HD2      LEU  42  -4.930  -3.306   0.550
  315   HD22  LEU  42          1HD2      LEU  42  -4.689  -1.605   0.153
  316   HD23  LEU  42          2HD2      LEU  42  -3.312  -2.606   0.616
  317    H    ARG  43           H        ARG  43  -4.010  -7.252  -2.455
  318    HA   ARG  43           HA       ARG  43  -6.818  -6.924  -3.135
  319    HE   ARG  43           HE       ARG  43  -8.471  -9.114  -6.936
  320    HB2  ARG  43           2HB      ARG  43  -5.173  -7.102  -4.937
  321    HB3  ARG  43           1HB      ARG  43  -4.679  -8.683  -4.347
  322    HG2  ARG  43           2HG      ARG  43  -6.129  -8.905  -6.265
  323    HG3  ARG  43           1HG      ARG  43  -6.926  -9.546  -4.827
  324    HD2  ARG  43           2HD      ARG  43  -8.248  -7.554  -4.619
  325    HD3  ARG  43           1HD      ARG  43  -7.349  -6.778  -5.908
  326   HH11  ARG  43          1HH1      ARG  43  -9.507  -6.033  -5.679
  327   HH12  ARG  43          2HH1      ARG  43 -10.946  -5.980  -6.640
  328   HH21  ARG  43          1HH2      ARG  43 -10.361  -9.053  -8.204
  329   HH22  ARG  43          2HH2      ARG  43 -11.433  -7.699  -8.076
  330    H    GLU  44           H        GLU  44  -4.672  -9.642  -2.276
  331    HA   GLU  44           HA       GLU  44  -6.613 -11.605  -2.008
  332    HB2  GLU  44           2HB      GLU  44  -4.210 -12.078  -2.009
  333    HB3  GLU  44           1HB      GLU  44  -4.043 -11.293  -0.444
  334    HG2  GLU  44           2HG      GLU  44  -5.462 -12.992   0.572
  335    HG3  GLU  44           1HG      GLU  44  -5.660 -13.773  -0.997
  336    H    PHE  45           H        PHE  45  -5.220  -9.570   0.565
  337    HA   PHE  45           HA       PHE  45  -6.032  -8.857   2.560
  338    HD1  PHE  45           2HD      PHE  45  -7.550  -6.852   3.529
  339    HD2  PHE  45           1HD      PHE  45 -10.099 -10.235   3.119
  340    HE1  PHE  45           2HE      PHE  45  -8.670  -6.259   5.638
  341    HE2  PHE  45           1HE      PHE  45 -11.224  -9.648   5.227
  342    HZ   PHE  45           HZ       PHE  45 -10.509  -7.657   6.489
  343    HB2  PHE  45           2HB      PHE  45  -7.955  -8.043   1.312
  344    HB3  PHE  45           1HB      PHE  45  -8.698  -9.637   1.362
  345    H    ALA  46           H        ALA  46  -6.094  -9.722   4.552
  346    HA   ALA  46           HA       ALA  46  -5.968 -12.540   4.845
  347    HB1  ALA  46           3HB      ALA  46  -4.725 -10.977   6.279
  348    HB2  ALA  46           1HB      ALA  46  -5.709 -12.102   7.216
  349    HB3  ALA  46           2HB      ALA  46  -6.248 -10.439   6.989
  Start of MODEL    4
    1    HA   ALA   3           HA       ALA   3  14.807   9.920   2.199
    2    HB1  ALA   3           3HB      ALA   3  12.877   7.649   2.665
    3    HB2  ALA   3           1HB      ALA   3  13.657   8.619   3.916
    4    HB3  ALA   3           2HB      ALA   3  14.628   7.581   2.870
    5    H    LEU   4           H        LEU   4  15.102  10.466  -0.016
    6    HA   LEU   4           HA       LEU   4  15.520  10.032  -2.203
    7    HG   LEU   4           HG       LEU   4  17.736   9.037  -2.049
    8    HB2  LEU   4           2HB      LEU   4  15.510   7.240  -1.090
    9    HB3  LEU   4           1HB      LEU   4  15.830   7.558  -2.783
   10   HD11  LEU   4          1HD1      LEU   4  17.029   9.462   0.230
   11   HD12  LEU   4          2HD1      LEU   4  18.612   8.684   0.215
   12   HD13  LEU   4          3HD1      LEU   4  17.173   7.748   0.616
   13   HD21  LEU   4          3HD2      LEU   4  19.242   7.173  -1.630
   14   HD22  LEU   4          1HD2      LEU   4  18.069   6.759  -2.880
   15   HD23  LEU   4          2HD2      LEU   4  17.871   6.135  -1.242
   16    H    GLU   5           H        GLU   5  13.641   7.072  -1.814
   17    HA   GLU   5           HA       GLU   5  11.978   7.740  -4.036
   18    HB2  GLU   5           2HB      GLU   5  10.857   5.612  -3.574
   19    HB3  GLU   5           1HB      GLU   5  12.605   5.424  -3.561
   20    HG2  GLU   5           2HG      GLU   5  12.570   5.509  -1.101
   21    HG3  GLU   5           1HG      GLU   5  10.811   5.615  -1.152
   22    H    ASN   6           H        ASN   6   9.879   8.404  -4.092
   23    HA   ASN   6           HA       ASN   6   8.891   9.824  -1.815
   24    HB2  ASN   6           2HB      ASN   6   7.573   9.238  -4.477
   25    HB3  ASN   6           1HB      ASN   6   6.984  10.386  -3.278
   26   HD21  ASN   6          1HD2      ASN   6   8.100  12.311  -2.949
   27   HD22  ASN   6          2HD2      ASN   6   9.245  12.913  -4.094
   28    H    VAL   7           H        VAL   7   7.920   8.874  -0.160
   29    HA   VAL   7           HA       VAL   7   6.931   6.259  -0.117
   30    HB   VAL   7           HB       VAL   7   7.547   7.484   1.918
   31   HG11  VAL   7          1HG1      VAL   7   6.668   9.677   1.345
   32   HG12  VAL   7          2HG1      VAL   7   6.011   9.132   2.888
   33   HG13  VAL   7          3HG1      VAL   7   5.019   9.057   1.432
   34   HG21  VAL   7          3HG2      VAL   7   4.689   6.526   1.878
   35   HG22  VAL   7          1HG2      VAL   7   5.673   6.740   3.326
   36   HG23  VAL   7          2HG2      VAL   7   6.127   5.536   2.119
   37    H    ASP   8           H        ASP   8   5.405   9.291  -0.936
   38    HA   ASP   8           HA       ASP   8   2.709   8.435  -0.823
   39    HB2  ASP   8           2HB      ASP   8   3.370  10.812  -0.881
   40    HB3  ASP   8           1HB      ASP   8   3.969  10.597  -2.525
   41    H    ALA   9           H        ALA   9   5.188   8.282  -3.308
   42    HA   ALA   9           HA       ALA   9   3.580   7.621  -5.499
   43    HB1  ALA   9           3HB      ALA   9   5.863   8.210  -5.858
   44    HB2  ALA   9           1HB      ALA   9   5.657   6.544  -6.400
   45    HB3  ALA   9           2HB      ALA   9   6.421   6.878  -4.847
   46    H    LYS  10           H        LYS  10   5.052   5.604  -2.998
   47    HA   LYS  10           HA       LYS  10   4.249   3.112  -4.069
   48    HB2  LYS  10           2HB      LYS  10   4.679   3.725  -1.145
   49    HB3  LYS  10           1HB      LYS  10   4.876   2.180  -1.960
   50    HG2  LYS  10           2HG      LYS  10   6.556   4.417  -2.916
   51    HG3  LYS  10           1HG      LYS  10   6.924   3.757  -1.322
   52    HD2  LYS  10           2HD      LYS  10   8.243   2.641  -3.031
   53    HD3  LYS  10           1HD      LYS  10   7.099   1.514  -2.305
   54    HE2  LYS  10           2HE      LYS  10   5.657   1.646  -4.194
   55    HE3  LYS  10           1HE      LYS  10   6.585   2.979  -4.884
   56    HZ1  LYS  10           3HZ      LYS  10   7.612   0.220  -4.481
   57    HZ2  LYS  10           1HZ      LYS  10   8.441   1.499  -5.214
   58    HZ3  LYS  10           2HZ      LYS  10   7.068   0.847  -5.955
   59    H    ILE  11           H        ILE  11   2.874   5.191  -1.545
   60    HA   ILE  11           HA       ILE  11   0.669   3.640  -0.881
   61    HB   ILE  11           HB       ILE  11   0.805   6.659  -0.951
   62   HG12  ILE  11          2HG1      ILE  11   1.370   4.753   1.334
   63   HG13  ILE  11          1HG1      ILE  11   2.617   5.517   0.358
   64   HG21  ILE  11          1HG2      ILE  11  -0.840   5.269   1.052
   65   HG22  ILE  11          2HG2      ILE  11  -1.402   5.114  -0.614
   66   HG23  ILE  11          3HG2      ILE  11  -1.188   6.715   0.102
   67   HD11  ILE  11          3HD1      ILE  11   2.202   6.622   2.538
   68   HD12  ILE  11          1HD1      ILE  11   0.585   7.034   1.971
   69   HD13  ILE  11          2HD1      ILE  11   2.001   7.684   1.145
   70    H    ALA  12           H        ALA  12   0.748   6.409  -3.127
   71    HA   ALA  12           HA       ALA  12  -1.814   6.137  -4.155
   72    HB1  ALA  12           3HB      ALA  12  -0.382   8.090  -4.567
   73    HB2  ALA  12           1HB      ALA  12  -1.034   7.433  -6.069
   74    HB3  ALA  12           2HB      ALA  12   0.641   7.113  -5.619
   75    H    LYS  13           H        LYS  13   1.172   4.490  -4.979
   76    HA   LYS  13           HA       LYS  13   0.410   3.249  -7.349
   77    HB2  LYS  13           2HB      LYS  13   2.705   3.210  -6.368
   78    HB3  LYS  13           1HB      LYS  13   2.138   2.046  -5.180
   79    HG2  LYS  13           2HG      LYS  13   3.328   0.946  -6.991
   80    HG3  LYS  13           1HG      LYS  13   1.632   0.458  -6.954
   81    HD2  LYS  13           2HD      LYS  13   1.111   1.746  -8.844
   82    HD3  LYS  13           1HD      LYS  13   2.598   2.686  -8.713
   83    HE2  LYS  13           2HE      LYS  13   3.905   0.729  -9.279
   84    HE3  LYS  13           1HE      LYS  13   2.439  -0.244  -9.385
   85    HZ1  LYS  13           3HZ      LYS  13   3.131   2.069 -11.118
   86    HZ2  LYS  13           1HZ      LYS  13   1.695   1.177 -11.209
   87    HZ3  LYS  13           2HZ      LYS  13   3.173   0.439 -11.571
   88    H    LEU  14           H        LEU  14  -0.273   2.460  -3.987
   89    HA   LEU  14           HA       LEU  14  -1.656   0.014  -4.703
   90    HG   LEU  14           HG       LEU  14  -0.661  -1.375  -3.136
   91    HB2  LEU  14           2HB      LEU  14  -1.052   1.440  -2.149
   92    HB3  LEU  14           1HB      LEU  14  -2.368   0.280  -2.175
   93   HD11  LEU  14          1HD1      LEU  14   1.038   0.310  -3.701
   94   HD12  LEU  14          2HD1      LEU  14   1.659  -0.953  -2.637
   95   HD13  LEU  14          3HD1      LEU  14   1.258   0.636  -1.982
   96   HD21  LEU  14          3HD2      LEU  14  -0.290  -0.391  -0.312
   97   HD22  LEU  14          1HD2      LEU  14   0.113  -1.994  -0.926
   98   HD23  LEU  14          2HD2      LEU  14  -1.572  -1.474  -0.858
   99    H    MET  15           H        MET  15  -2.402   3.353  -4.169
  100    HA   MET  15           HA       MET  15  -5.168   3.115  -3.642
  101    HB2  MET  15           2HB      MET  15  -3.498   5.340  -4.808
  102    HB3  MET  15           1HB      MET  15  -5.232   5.498  -4.563
  103    HG2  MET  15           2HG      MET  15  -4.942   5.115  -2.178
  104    HG3  MET  15           1HG      MET  15  -3.207   4.916  -2.412
  105    HE1  MET  15           3HE      MET  15  -4.858   7.154  -0.426
  106    HE2  MET  15           1HE      MET  15  -3.576   8.359  -0.533
  107    HE3  MET  15           2HE      MET  15  -3.170   6.649  -0.380
  108    H    GLY  16           H        GLY  16  -3.270   2.849  -6.516
  109    HA2  GLY  16           2HA      GLY  16  -5.014   3.444  -8.556
  110    HA3  GLY  16           1HA      GLY  16  -3.862   2.114  -8.615
  111    H    GLU  17           H        GLU  17  -4.711   0.297  -6.950
  112    HA   GLU  17           HA       GLU  17  -6.826  -0.980  -8.229
  113    HB2  GLU  17           2HB      GLU  17  -5.607  -1.376  -5.500
  114    HB3  GLU  17           1HB      GLU  17  -6.882  -2.421  -6.122
  115    HG2  GLU  17           2HG      GLU  17  -5.532  -3.297  -7.789
  116    HG3  GLU  17           1HG      GLU  17  -4.388  -1.948  -7.702
  117    H    GLY  18           H        GLY  18  -6.765   1.075  -5.374
  118    HA2  GLY  18           2HA      GLY  18  -8.524   2.467  -4.685
  119    HA3  GLY  18           1HA      GLY  18  -9.638   1.506  -5.647
  120    H    TYR  19           H        TYR  19  -7.714   1.507  -2.685
  121    HA   TYR  19           HA       TYR  19  -9.841  -0.011  -1.369
  122    HD1  TYR  19           2HD      TYR  19  -7.988  -1.817  -3.772
  123    HD2  TYR  19           1HD      TYR  19  -9.332  -2.949   0.102
  124    HE1  TYR  19           2HE      TYR  19  -9.022  -3.834  -4.727
  125    HE2  TYR  19           1HE      TYR  19 -10.368  -4.970  -0.841
  126    HH   TYR  19           HH       TYR  19  -9.726  -6.069  -3.987
  127    HB2  TYR  19           2HB      TYR  19  -6.998  -0.855  -1.668
  128    HB3  TYR  19           1HB      TYR  19  -7.788  -1.174  -0.128
  129    H    ALA  20           H        ALA  20  -9.234  -0.130   1.115
  130    HA   ALA  20           HA       ALA  20  -9.345   2.439   2.144
  131    HB1  ALA  20           3HB      ALA  20  -9.816   0.124   3.255
  132    HB2  ALA  20           1HB      ALA  20  -9.296   1.488   4.247
  133    HB3  ALA  20           2HB      ALA  20  -8.134   0.250   3.776
  134    H    PHE  21           H        PHE  21  -7.874   3.933   2.791
  135    HA   PHE  21           HA       PHE  21  -5.197   3.679   1.822
  136    HD1  PHE  21           1HD      PHE  21  -5.417   6.159   5.295
  137    HD2  PHE  21           2HD      PHE  21  -8.482   6.068   2.343
  138    HE1  PHE  21           1HE      PHE  21  -7.021   7.041   6.938
  139    HE2  PHE  21           2HE      PHE  21 -10.091   6.950   3.981
  140    HZ   PHE  21           HZ       PHE  21  -9.361   7.439   6.282
  141    HB2  PHE  21           2HB      PHE  21  -4.889   5.928   2.939
  142    HB3  PHE  21           1HB      PHE  21  -6.163   5.860   1.726
  143    H    GLU  22           H        GLU  22  -6.810   3.376   4.893
  144    HA   GLU  22           HA       GLU  22  -4.573   3.441   6.589
  145    HB2  GLU  22           2HB      GLU  22  -6.922   3.535   7.372
  146    HB3  GLU  22           1HB      GLU  22  -7.122   1.846   6.925
  147    HG2  GLU  22           2HG      GLU  22  -5.466   1.187   8.563
  148    HG3  GLU  22           1HG      GLU  22  -5.179   2.877   8.978
  149    H    GLU  23           H        GLU  23  -6.166   0.746   4.925
  150    HA   GLU  23           HA       GLU  23  -4.495  -1.287   5.935
  151    HB2  GLU  23           2HB      GLU  23  -6.185  -1.136   3.442
  152    HB3  GLU  23           1HB      GLU  23  -5.332  -2.590   3.945
  153    HG2  GLU  23           2HG      GLU  23  -6.566  -2.409   6.131
  154    HG3  GLU  23           1HG      GLU  23  -7.559  -1.168   5.368
  155    H    VAL  24           H        VAL  24  -4.150   0.968   3.305
  156    HA   VAL  24           HA       VAL  24  -2.107  -0.386   1.888
  157    HB   VAL  24           HB       VAL  24  -2.776   2.555   1.992
  158   HG11  VAL  24          1HG1      VAL  24  -1.128   1.167  -0.101
  159   HG12  VAL  24          2HG1      VAL  24  -0.422   2.003   1.278
  160   HG13  VAL  24          3HG1      VAL  24  -1.389   2.897   0.108
  161   HG21  VAL  24          3HG2      VAL  24  -3.328   0.750  -0.319
  162   HG22  VAL  24          1HG2      VAL  24  -4.152   2.230   0.171
  163   HG23  VAL  24          2HG2      VAL  24  -4.415   0.733   1.069
  164    H    LYS  25           H        LYS  25  -1.801   2.562   3.892
  165    HA   LYS  25           HA       LYS  25   0.952   2.626   4.035
  166    HB2  LYS  25           2HB      LYS  25  -1.131   3.554   6.002
  167    HB3  LYS  25           1HB      LYS  25   0.586   3.813   6.270
  168    HG2  LYS  25           2HG      LYS  25  -0.153   5.799   5.322
  169    HG3  LYS  25           1HG      LYS  25   0.601   4.932   3.990
  170    HD2  LYS  25           2HD      LYS  25  -1.494   4.321   3.075
  171    HD3  LYS  25           1HD      LYS  25  -2.350   4.802   4.541
  172    HE2  LYS  25           2HE      LYS  25  -0.922   6.638   2.624
  173    HE3  LYS  25           1HE      LYS  25  -2.667   6.446   2.774
  174    HZ1  LYS  25           3HZ      LYS  25  -1.917   8.405   3.946
  175    HZ2  LYS  25           1HZ      LYS  25  -0.843   7.485   4.875
  176    HZ3  LYS  25           2HZ      LYS  25  -2.511   7.270   5.051
  177    H    ARG  26           H        ARG  26  -1.275   0.945   6.276
  178    HA   ARG  26           HA       ARG  26   0.725   0.027   8.018
  179    HE   ARG  26           HE       ARG  26  -3.729  -0.542   8.880
  180    HB2  ARG  26           2HB      ARG  26  -0.878  -1.567   8.842
  181    HB3  ARG  26           1HB      ARG  26  -1.720  -0.063   8.501
  182    HG2  ARG  26           2HG      ARG  26  -2.701  -0.955   6.543
  183    HG3  ARG  26           1HG      ARG  26  -1.653  -2.374   6.587
  184    HD2  ARG  26           2HD      ARG  26  -3.900  -2.912   7.371
  185    HD3  ARG  26           1HD      ARG  26  -2.699  -3.110   8.645
  186   HH11  ARG  26          1HH1      ARG  26  -4.869  -3.825   9.128
  187   HH12  ARG  26          2HH1      ARG  26  -6.103  -3.445  10.282
  188   HH21  ARG  26          1HH2      ARG  26  -5.351  -0.034  10.400
  189   HH22  ARG  26          2HH2      ARG  26  -6.377  -1.292  11.004
  190    H    ALA  27           H        ALA  27  -0.540  -1.297   5.005
  191    HA   ALA  27           HA       ALA  27   0.845  -3.769   5.122
  192    HB1  ALA  27           3HB      ALA  27   0.073  -4.149   2.974
  193    HB2  ALA  27           1HB      ALA  27   0.159  -2.443   2.532
  194    HB3  ALA  27           2HB      ALA  27  -1.121  -3.012   3.599
  195    H    LEU  28           H        LEU  28   1.655  -0.590   3.898
  196    HA   LEU  28           HA       LEU  28   4.040  -1.337   2.555
  197    HG   LEU  28           HG       LEU  28   1.637   0.553   1.803
  198    HB2  LEU  28           2HB      LEU  28   3.068   1.330   3.594
  199    HB3  LEU  28           1HB      LEU  28   4.495   1.122   2.590
  200   HD11  LEU  28          1HD1      LEU  28   2.067   2.337   0.142
  201   HD12  LEU  28          2HD1      LEU  28   3.624   2.637   0.916
  202   HD13  LEU  28          3HD1      LEU  28   2.128   2.904   1.811
  203   HD21  LEU  28          3HD2      LEU  28   2.783   0.254  -0.493
  204   HD22  LEU  28          1HD2      LEU  28   2.814  -1.086   0.656
  205   HD23  LEU  28          2HD2      LEU  28   4.236  -0.064   0.454
  206    H    GLU  29           H        GLU  29   3.650   0.637   5.492
  207    HA   GLU  29           HA       GLU  29   6.245   0.714   6.338
  208    HB2  GLU  29           2HB      GLU  29   3.796   0.482   8.091
  209    HB3  GLU  29           1HB      GLU  29   5.368   1.079   8.604
  210    HG2  GLU  29           2HG      GLU  29   5.184   2.955   7.085
  211    HG3  GLU  29           1HG      GLU  29   3.647   2.338   6.481
  212    H    ILE  30           H        ILE  30   3.838  -1.725   7.358
  213    HA   ILE  30           HA       ILE  30   5.513  -3.244   8.974
  214    HB   ILE  30           HB       ILE  30   3.143  -4.102   7.320
  215   HG12  ILE  30          2HG1      ILE  30   3.434  -3.588  10.289
  216   HG13  ILE  30          1HG1      ILE  30   2.763  -2.438   9.138
  217   HG21  ILE  30          1HG2      ILE  30   3.556  -5.855   9.503
  218   HG22  ILE  30          2HG2      ILE  30   5.080  -5.736   8.623
  219   HG23  ILE  30          3HG2      ILE  30   3.611  -6.224   7.778
  220   HD11  ILE  30          3HD1      ILE  30   1.000  -3.575  10.329
  221   HD12  ILE  30          1HD1      ILE  30   1.632  -5.141   9.823
  222   HD13  ILE  30          2HD1      ILE  30   0.969  -4.028   8.625
  223    H    ALA  31           H        ALA  31   4.914  -3.540   5.486
  224    HA   ALA  31           HA       ALA  31   6.729  -5.764   5.250
  225    HB1  ALA  31           3HB      ALA  31   4.739  -5.583   3.822
  226    HB2  ALA  31           1HB      ALA  31   6.226  -5.691   2.881
  227    HB3  ALA  31           2HB      ALA  31   5.418  -4.135   3.078
  228    H    GLN  32           H        GLN  32   7.723  -3.132   6.244
  229    HA   GLN  32           HA       GLN  32   9.543  -1.788   6.052
  230    HB2  GLN  32           2HB      GLN  32  10.542  -4.061   4.326
  231    HB3  GLN  32           1HB      GLN  32  11.544  -2.788   5.010
  232    HG2  GLN  32           2HG      GLN  32  10.945  -3.535   7.263
  233    HG3  GLN  32           1HG      GLN  32   9.966  -4.824   6.566
  234   HE21  GLN  32          1HE2      GLN  32  13.184  -3.658   7.148
  235   HE22  GLN  32          2HE2      GLN  32  14.006  -5.134   6.783
  236    H    ASN  33           H        ASN  33   7.595  -0.881   4.489
  237    HA   ASN  33           HA       ASN  33   7.103   0.441   2.710
  238    HB2  ASN  33           2HB      ASN  33   9.123   1.629   3.530
  239    HB3  ASN  33           1HB      ASN  33  10.110   0.659   2.443
  240   HD21  ASN  33          1HD2      ASN  33   6.925   1.848   1.636
  241   HD22  ASN  33          2HD2      ASN  33   7.440   2.975   0.432
  242    H    ASN  34           H        ASN  34   6.609  -1.959   1.960
  243    HA   ASN  34           HA       ASN  34   7.859  -2.257  -0.689
  244    HB2  ASN  34           2HB      ASN  34   7.117  -4.352   1.321
  245    HB3  ASN  34           1HB      ASN  34   7.170  -4.745  -0.392
  246   HD21  ASN  34          1HD2      ASN  34   9.350  -2.893  -0.932
  247   HD22  ASN  34          2HD2      ASN  34  10.775  -3.629  -0.292
  248    H    VAL  35           H        VAL  35   6.527  -2.314  -2.385
  249    HA   VAL  35           HA       VAL  35   3.682  -1.987  -1.884
  250    HB   VAL  35           HB       VAL  35   4.346  -0.368  -3.394
  251   HG11  VAL  35          1HG1      VAL  35   6.090  -2.479  -4.619
  252   HG12  VAL  35          2HG1      VAL  35   6.556  -0.959  -3.855
  253   HG13  VAL  35          3HG1      VAL  35   5.758  -0.945  -5.426
  254   HG21  VAL  35          3HG2      VAL  35   3.554  -2.560  -5.301
  255   HG22  VAL  35          1HG2      VAL  35   3.272  -0.828  -5.463
  256   HG23  VAL  35          2HG2      VAL  35   2.413  -1.748  -4.229
  257    H    GLU  36           H        GLU  36   5.883  -4.222  -3.484
  258    HA   GLU  36           HA       GLU  36   4.003  -5.772  -4.848
  259    HB2  GLU  36           2HB      GLU  36   6.610  -6.656  -3.628
  260    HB3  GLU  36           1HB      GLU  36   5.705  -7.540  -4.847
  261    HG2  GLU  36           2HG      GLU  36   5.979  -5.579  -6.361
  262    HG3  GLU  36           1HG      GLU  36   7.046  -4.866  -5.152
  263    H    VAL  37           H        VAL  37   5.571  -6.621  -1.747
  264    HA   VAL  37           HA       VAL  37   3.924  -8.778  -1.136
  265    HB   VAL  37           HB       VAL  37   5.193  -6.892   0.858
  266   HG11  VAL  37          1HG1      VAL  37   3.530  -8.411   1.826
  267   HG12  VAL  37          2HG1      VAL  37   5.163  -8.791   2.370
  268   HG13  VAL  37          3HG1      VAL  37   4.392  -9.786   1.135
  269   HG21  VAL  37          3HG2      VAL  37   6.318  -9.313  -0.544
  270   HG22  VAL  37          1HG2      VAL  37   7.064  -8.534   0.851
  271   HG23  VAL  37          2HG2      VAL  37   6.889  -7.649  -0.664
  272    H    ALA  38           H        ALA  38   3.559  -5.349  -0.346
  273    HA   ALA  38           HA       ALA  38   1.269  -5.560   1.255
  274    HB1  ALA  38           3HB      ALA  38   2.353  -3.508   1.364
  275    HB2  ALA  38           1HB      ALA  38   0.909  -3.138   0.422
  276    HB3  ALA  38           2HB      ALA  38   2.460  -3.362  -0.390
  277    H    ARG  39           H        ARG  39   1.703  -5.358  -2.227
  278    HA   ARG  39           HA       ARG  39  -0.987  -4.909  -2.929
  279    HE   ARG  39           HE       ARG  39  -0.274  -4.738  -7.391
  280    HB2  ARG  39           2HB      ARG  39   1.434  -5.906  -4.368
  281    HB3  ARG  39           1HB      ARG  39  -0.139  -6.108  -5.128
  282    HG2  ARG  39           2HG      ARG  39  -0.521  -3.743  -5.104
  283    HG3  ARG  39           1HG      ARG  39   0.948  -3.474  -4.164
  284    HD2  ARG  39           2HD      ARG  39   1.329  -2.953  -6.500
  285    HD3  ARG  39           1HD      ARG  39   2.287  -4.348  -6.008
  286   HH11  ARG  39          1HH1      ARG  39   3.191  -5.083  -7.273
  287   HH12  ARG  39          2HH1      ARG  39   3.258  -6.165  -8.625
  288   HH21  ARG  39          1HH2      ARG  39  -0.196  -6.159  -9.171
  289   HH22  ARG  39          2HH2      ARG  39   1.333  -6.775  -9.705
  290    H    SER  40           H        SER  40   0.873  -7.877  -2.426
  291    HA   SER  40           HA       SER  40  -1.080  -9.674  -3.350
  292    HG   SER  40           HG       SER  40   1.959  -9.897  -0.884
  293    HB2  SER  40           2HB      SER  40   0.162 -11.395  -2.226
  294    HB3  SER  40           1HB      SER  40   1.330 -10.232  -2.850
  295    H    ILE  41           H        ILE  41  -0.413  -8.429  -0.081
  296    HA   ILE  41           HA       ILE  41  -2.669  -9.804   1.054
  297    HB   ILE  41           HB       ILE  41  -2.200  -8.427   3.080
  298   HG12  ILE  41          2HG1      ILE  41   0.138  -7.400   1.457
  299   HG13  ILE  41          1HG1      ILE  41  -1.295  -6.456   1.852
  300   HG21  ILE  41          1HG2      ILE  41  -1.172 -10.607   2.783
  301   HG22  ILE  41          2HG2      ILE  41  -0.055  -9.505   3.588
  302   HG23  ILE  41          3HG2      ILE  41   0.155  -9.877   1.877
  303   HD11  ILE  41          3HD1      ILE  41   0.566  -5.923   3.321
  304   HD12  ILE  41          1HD1      ILE  41   0.652  -7.607   3.836
  305   HD13  ILE  41          2HD1      ILE  41  -0.771  -6.640   4.221
  306    H    LEU  42           H        LEU  42  -2.324  -6.978  -0.761
  307    HA   LEU  42           HA       LEU  42  -4.460  -5.473   0.426
  308    HG   LEU  42           HG       LEU  42  -3.386  -2.637  -1.635
  309    HB2  LEU  42           2HB      LEU  42  -2.413  -4.677  -0.972
  310    HB3  LEU  42           1HB      LEU  42  -3.412  -5.062  -2.352
  311   HD11  LEU  42          1HD1      LEU  42  -5.100  -3.574  -3.106
  312   HD12  LEU  42          2HD1      LEU  42  -5.760  -2.326  -2.048
  313   HD13  LEU  42          3HD1      LEU  42  -6.061  -4.028  -1.698
  314   HD21  LEU  42          3HD2      LEU  42  -5.092  -3.695   0.618
  315   HD22  LEU  42          1HD2      LEU  42  -4.817  -1.998   0.228
  316   HD23  LEU  42          2HD2      LEU  42  -3.479  -3.003   0.782
  317    H    ARG  43           H        ARG  43  -4.065  -7.399  -2.536
  318    HA   ARG  43           HA       ARG  43  -6.907  -7.149  -3.120
  319    HE   ARG  43           HE       ARG  43  -5.658  -6.878  -7.294
  320    HB2  ARG  43           2HB      ARG  43  -5.352  -6.884  -4.964
  321    HB3  ARG  43           1HB      ARG  43  -4.664  -8.474  -4.654
  322    HG2  ARG  43           2HG      ARG  43  -6.066  -9.077  -6.309
  323    HG3  ARG  43           1HG      ARG  43  -7.248  -9.129  -4.999
  324    HD2  ARG  43           2HD      ARG  43  -8.247  -7.874  -6.725
  325    HD3  ARG  43           1HD      ARG  43  -7.737  -6.730  -5.498
  326   HH11  ARG  43          1HH1      ARG  43  -9.025  -5.990  -7.375
  327   HH12  ARG  43          2HH1      ARG  43  -8.825  -4.848  -8.663
  328   HH21  ARG  43          1HH2      ARG  43  -5.385  -5.377  -8.985
  329   HH22  ARG  43          2HH2      ARG  43  -6.755  -4.499  -9.577
  330    H    GLU  44           H        GLU  44  -4.649  -9.913  -3.130
  331    HA   GLU  44           HA       GLU  44  -6.505 -11.939  -3.043
  332    HB2  GLU  44           2HB      GLU  44  -3.786 -11.909  -1.729
  333    HB3  GLU  44           1HB      GLU  44  -4.726 -13.350  -2.083
  334    HG2  GLU  44           2HG      GLU  44  -4.590 -12.868  -4.465
  335    HG3  GLU  44           1HG      GLU  44  -3.670 -11.404  -4.121
  336    H    PHE  45           H        PHE  45  -4.645 -11.007  -0.145
  337    HA   PHE  45           HA       PHE  45  -6.279 -12.312   1.683
  338    HD1  PHE  45           1HD      PHE  45  -5.221 -13.022   3.947
  339    HD2  PHE  45           2HD      PHE  45  -5.350  -8.769   4.038
  340    HE1  PHE  45           1HE      PHE  45  -5.818 -13.096   6.332
  341    HE2  PHE  45           2HE      PHE  45  -5.947  -8.836   6.424
  342    HZ   PHE  45           HZ       PHE  45  -6.181 -11.001   7.575
  343    HB2  PHE  45           2HB      PHE  45  -4.031 -11.497   2.228
  344    HB3  PHE  45           1HB      PHE  45  -4.602  -9.836   2.130
  345    H    ALA  46           H        ALA  46  -6.128  -8.757   1.491
  346    HA   ALA  46           HA       ALA  46  -8.698  -8.467   2.682
  347    HB1  ALA  46           3HB      ALA  46  -8.399  -6.088   2.323
  348    HB2  ALA  46           1HB      ALA  46  -7.049  -6.400   1.232
  349    HB3  ALA  46           2HB      ALA  46  -6.909  -6.800   2.944
  Start of MODEL    5
    1    HA   ALA   3           HA       ALA   3  13.358  12.611  -1.056
    2    HB1  ALA   3           3HB      ALA   3  14.718  11.849   0.847
    3    HB2  ALA   3           1HB      ALA   3  12.990  11.774   1.187
    4    HB3  ALA   3           2HB      ALA   3  13.966  13.080   1.860
    5    H    LEU   4           H        LEU   4  11.822  13.994  -1.940
    6    HA   LEU   4           HA       LEU   4  10.405  15.779  -0.095
    7    HG   LEU   4           HG       LEU   4  12.371  16.571  -2.395
    8    HB2  LEU   4           2HB      LEU   4  10.230  15.556  -3.102
    9    HB3  LEU   4           1HB      LEU   4   9.367  16.723  -2.118
   10   HD11  LEU   4          1HD1      LEU   4  11.324  17.295  -4.460
   11   HD12  LEU   4          2HD1      LEU   4  12.129  18.651  -3.672
   12   HD13  LEU   4          3HD1      LEU   4  10.375  18.493  -3.582
   13   HD21  LEU   4          3HD2      LEU   4  12.343  18.736  -1.239
   14   HD22  LEU   4          1HD2      LEU   4  11.694  17.445  -0.228
   15   HD23  LEU   4          2HD2      LEU   4  10.600  18.586  -1.012
   16    H    GLU   5           H        GLU   5   9.381  13.769  -2.857
   17    HA   GLU   5           HA       GLU   5   7.234  12.691  -1.161
   18    HB2  GLU   5           2HB      GLU   5   5.816  12.684  -3.273
   19    HB3  GLU   5           1HB      GLU   5   6.116  14.250  -2.535
   20    HG2  GLU   5           2HG      GLU   5   7.893  14.668  -4.175
   21    HG3  GLU   5           1HG      GLU   5   7.543  13.114  -4.929
   22    H    ASN   6           H        ASN   6   8.338  10.776  -0.806
   23    HA   ASN   6           HA       ASN   6   8.828   9.106  -3.183
   24    HB2  ASN   6           2HB      ASN   6  10.838   9.519  -1.838
   25    HB3  ASN   6           1HB      ASN   6  10.024   8.886  -0.410
   26   HD21  ASN   6          1HD2      ASN   6  11.532   7.268  -0.113
   27   HD22  ASN   6          2HD2      ASN   6  11.635   5.890  -1.150
   28    H    VAL   7           H        VAL   7   7.560   9.060   0.130
   29    HA   VAL   7           HA       VAL   7   6.574   6.414   0.040
   30    HB   VAL   7           HB       VAL   7   5.107   7.158   1.959
   31   HG11  VAL   7          1HG1      VAL   7   8.068   7.694   2.120
   32   HG12  VAL   7          2HG1      VAL   7   7.265   6.140   2.341
   33   HG13  VAL   7          3HG1      VAL   7   7.006   7.440   3.504
   34   HG21  VAL   7          3HG2      VAL   7   6.611   9.747   1.581
   35   HG22  VAL   7          1HG2      VAL   7   5.558   9.351   2.939
   36   HG23  VAL   7          2HG2      VAL   7   4.884   9.508   1.317
   37    H    ASP   8           H        ASP   8   5.070   9.544  -0.651
   38    HA   ASP   8           HA       ASP   8   2.430   8.779  -0.959
   39    HB2  ASP   8           2HB      ASP   8   3.951  10.810  -2.608
   40    HB3  ASP   8           1HB      ASP   8   2.199  10.719  -2.454
   41    H    ALA   9           H        ALA   9   5.097   8.504  -3.254
   42    HA   ALA   9           HA       ALA   9   3.628   7.763  -5.517
   43    HB1  ALA   9           3HB      ALA   9   5.953   8.364  -5.697
   44    HB2  ALA   9           1HB      ALA   9   5.740   6.719  -6.296
   45    HB3  ALA   9           2HB      ALA   9   6.422   6.992  -4.693
   46    H    LYS  10           H        LYS  10   4.950   5.808  -2.880
   47    HA   LYS  10           HA       LYS  10   4.172   3.311  -3.984
   48    HB2  LYS  10           2HB      LYS  10   4.526   3.867  -1.044
   49    HB3  LYS  10           1HB      LYS  10   4.787   2.357  -1.899
   50    HG2  LYS  10           2HG      LYS  10   6.498   4.815  -1.929
   51    HG3  LYS  10           1HG      LYS  10   6.924   3.205  -1.383
   52    HD2  LYS  10           2HD      LYS  10   6.245   3.897  -4.230
   53    HD3  LYS  10           1HD      LYS  10   7.886   3.897  -3.585
   54    HE2  LYS  10           2HE      LYS  10   5.993   1.581  -3.841
   55    HE3  LYS  10           1HE      LYS  10   7.544   1.823  -4.632
   56    HZ1  LYS  10           3HZ      LYS  10   8.629   1.671  -2.467
   57    HZ2  LYS  10           1HZ      LYS  10   7.765   0.261  -2.826
   58    HZ3  LYS  10           2HZ      LYS  10   7.134   1.385  -1.731
   59    H    ILE  11           H        ILE  11   2.691   5.556  -1.694
   60    HA   ILE  11           HA       ILE  11   0.499   4.005  -0.946
   61    HB   ILE  11           HB       ILE  11   0.559   7.007  -1.286
   62   HG12  ILE  11          2HG1      ILE  11   1.230   5.263   1.101
   63   HG13  ILE  11          1HG1      ILE  11   2.372   6.209   0.158
   64   HG21  ILE  11          1HG2      ILE  11  -1.103   5.771   0.798
   65   HG22  ILE  11          2HG2      ILE  11  -1.604   5.417  -0.857
   66   HG23  ILE  11          3HG2      ILE  11  -1.469   7.094  -0.312
   67   HD11  ILE  11          3HD1      ILE  11   1.848   7.312   2.249
   68   HD12  ILE  11          1HD1      ILE  11   0.135   7.318   1.833
   69   HD13  ILE  11          2HD1      ILE  11   1.277   8.264   0.878
   70    H    ALA  12           H        ALA  12   0.606   6.568  -3.433
   71    HA   ALA  12           HA       ALA  12  -1.907   6.112  -4.528
   72    HB1  ALA  12           3HB      ALA  12   0.594   7.060  -5.933
   73    HB2  ALA  12           1HB      ALA  12  -0.578   8.075  -5.093
   74    HB3  ALA  12           2HB      ALA  12  -1.049   7.211  -6.556
   75    H    LYS  13           H        LYS  13   1.194   4.577  -5.137
   76    HA   LYS  13           HA       LYS  13   0.599   3.045  -7.361
   77    HB2  LYS  13           2HB      LYS  13   2.830   3.230  -6.239
   78    HB3  LYS  13           1HB      LYS  13   2.247   2.128  -5.001
   79    HG2  LYS  13           2HG      LYS  13   3.607   0.964  -6.638
   80    HG3  LYS  13           1HG      LYS  13   1.938   0.389  -6.682
   81    HD2  LYS  13           2HD      LYS  13   1.490   1.515  -8.694
   82    HD3  LYS  13           1HD      LYS  13   2.918   2.537  -8.533
   83    HE2  LYS  13           2HE      LYS  13   4.349   0.602  -8.855
   84    HE3  LYS  13           1HE      LYS  13   2.932  -0.435  -9.015
   85    HZ1  LYS  13           3HZ      LYS  13   3.703   1.784 -10.834
   86    HZ2  LYS  13           1HZ      LYS  13   2.285   0.872 -10.971
   87    HZ3  LYS  13           2HZ      LYS  13   3.791   0.131 -11.178
   88    H    LEU  14           H        LEU  14  -0.263   2.580  -3.984
   89    HA   LEU  14           HA       LEU  14  -1.499   0.006  -4.526
   90    HG   LEU  14           HG       LEU  14  -0.530  -1.207  -2.843
   91    HB2  LEU  14           2HB      LEU  14  -1.017   1.658  -2.092
   92    HB3  LEU  14           1HB      LEU  14  -2.320   0.485  -2.052
   93   HD11  LEU  14          1HD1      LEU  14   1.157   0.536  -3.354
   94   HD12  LEU  14          2HD1      LEU  14   1.733  -0.714  -2.252
   95   HD13  LEU  14          3HD1      LEU  14   1.275   0.870  -1.626
   96   HD21  LEU  14          3HD2      LEU  14  -0.447  -0.052  -0.061
   97   HD22  LEU  14          1HD2      LEU  14   0.113  -1.656  -0.534
   98   HD23  LEU  14          2HD2      LEU  14  -1.599  -1.248  -0.656
   99    H    MET  15           H        MET  15  -2.403   3.345  -4.248
  100    HA   MET  15           HA       MET  15  -5.159   3.032  -3.770
  101    HB2  MET  15           2HB      MET  15  -3.637   5.230  -5.179
  102    HB3  MET  15           1HB      MET  15  -5.348   5.321  -4.788
  103    HG2  MET  15           2HG      MET  15  -4.815   5.104  -2.413
  104    HG3  MET  15           1HG      MET  15  -3.100   5.027  -2.809
  105    HE1  MET  15           3HE      MET  15  -5.795   7.298  -4.574
  106    HE2  MET  15           1HE      MET  15  -5.721   8.750  -3.574
  107    HE3  MET  15           2HE      MET  15  -6.339   7.242  -2.897
  108    H    GLY  16           H        GLY  16  -3.217   2.549  -6.571
  109    HA2  GLY  16           2HA      GLY  16  -4.882   2.922  -8.706
  110    HA3  GLY  16           1HA      GLY  16  -3.766   1.568  -8.584
  111    H    GLU  17           H        GLU  17  -4.703  -0.095  -6.835
  112    HA   GLU  17           HA       GLU  17  -6.854  -1.377  -8.065
  113    HB2  GLU  17           2HB      GLU  17  -5.587  -1.679  -5.351
  114    HB3  GLU  17           1HB      GLU  17  -6.955  -2.677  -5.844
  115    HG2  GLU  17           2HG      GLU  17  -5.742  -3.720  -7.538
  116    HG3  GLU  17           1HG      GLU  17  -4.487  -2.471  -7.528
  117    H    GLY  18           H        GLY  18  -6.749   0.699  -5.200
  118    HA2  GLY  18           2HA      GLY  18  -8.490   2.196  -4.622
  119    HA3  GLY  18           1HA      GLY  18  -9.617   1.198  -5.530
  120    H    TYR  19           H        TYR  19  -7.881   1.564  -2.520
  121    HA   TYR  19           HA       TYR  19  -9.939   0.032  -1.159
  122    HD1  TYR  19           1HD      TYR  19  -9.658  -2.397   0.741
  123    HD2  TYR  19           2HD      TYR  19  -8.093  -2.387  -3.216
  124    HE1  TYR  19           1HE      TYR  19 -10.851  -4.495   0.269
  125    HE2  TYR  19           2HE      TYR  19  -9.285  -4.483  -3.699
  126    HH   TYR  19           HH       TYR  19 -11.700  -5.738  -1.665
  127    HB2  TYR  19           2HB      TYR  19  -7.181  -0.922  -1.543
  128    HB3  TYR  19           1HB      TYR  19  -7.746  -0.974   0.125
  129    H    ALA  20           H        ALA  20  -9.237  -0.015   1.331
  130    HA   ALA  20           HA       ALA  20  -9.392   2.594   2.268
  131    HB1  ALA  20           3HB      ALA  20  -9.867   0.366   3.476
  132    HB2  ALA  20           1HB      ALA  20  -9.231   1.713   4.420
  133    HB3  ALA  20           2HB      ALA  20  -8.156   0.411   3.911
  134    H    PHE  21           H        PHE  21  -7.924   4.094   2.981
  135    HA   PHE  21           HA       PHE  21  -5.278   3.930   1.917
  136    HD1  PHE  21           1HD      PHE  21  -8.617   5.935   3.222
  137    HD2  PHE  21           2HD      PHE  21  -4.947   6.543   5.287
  138    HE1  PHE  21           1HE      PHE  21  -9.862   6.713   5.197
  139    HE2  PHE  21           2HE      PHE  21  -6.184   7.321   7.266
  140    HZ   PHE  21           HZ       PHE  21  -8.645   7.407   7.222
  141    HB2  PHE  21           2HB      PHE  21  -4.951   6.143   2.952
  142    HB3  PHE  21           1HB      PHE  21  -6.451   6.079   2.034
  143    H    GLU  22           H        GLU  22  -6.792   3.372   4.978
  144    HA   GLU  22           HA       GLU  22  -4.523   3.425   6.641
  145    HB2  GLU  22           2HB      GLU  22  -7.085   1.835   6.890
  146    HB3  GLU  22           1HB      GLU  22  -5.888   2.002   8.167
  147    HG2  GLU  22           2HG      GLU  22  -6.269   4.394   8.244
  148    HG3  GLU  22           1HG      GLU  22  -7.420   4.270   6.914
  149    H    GLU  23           H        GLU  23  -6.031   0.835   4.763
  150    HA   GLU  23           HA       GLU  23  -4.303  -1.226   5.651
  151    HB2  GLU  23           2HB      GLU  23  -6.024  -0.972   3.189
  152    HB3  GLU  23           1HB      GLU  23  -5.148  -2.436   3.620
  153    HG2  GLU  23           2HG      GLU  23  -6.367  -2.404   5.804
  154    HG3  GLU  23           1HG      GLU  23  -7.365  -1.107   5.147
  155    H    VAL  24           H        VAL  24  -4.044   1.229   3.223
  156    HA   VAL  24           HA       VAL  24  -2.022   0.039   1.633
  157    HB   VAL  24           HB       VAL  24  -2.741   2.938   2.003
  158   HG11  VAL  24          1HG1      VAL  24  -1.062   1.631  -0.132
  159   HG12  VAL  24          2HG1      VAL  24  -0.477   2.714   1.127
  160   HG13  VAL  24          3HG1      VAL  24  -1.570   3.319  -0.117
  161   HG21  VAL  24          3HG2      VAL  24  -3.418   1.319  -0.408
  162   HG22  VAL  24          1HG2      VAL  24  -4.232   2.731   0.261
  163   HG23  VAL  24          2HG2      VAL  24  -4.409   1.157   1.041
  164    H    LYS  25           H        LYS  25  -1.815   2.652   4.063
  165    HA   LYS  25           HA       LYS  25   1.030   2.659   4.018
  166    HB2  LYS  25           2HB      LYS  25  -1.022   3.961   5.770
  167    HB3  LYS  25           1HB      LYS  25   0.687   4.032   6.184
  168    HG2  LYS  25           2HG      LYS  25   0.273   6.001   5.001
  169    HG3  LYS  25           1HG      LYS  25   1.056   4.928   3.851
  170    HD2  LYS  25           2HD      LYS  25  -0.689   5.802   2.612
  171    HD3  LYS  25           1HD      LYS  25  -1.326   4.266   3.177
  172    HE2  LYS  25           2HE      LYS  25  -2.994   6.005   3.445
  173    HE3  LYS  25           1HE      LYS  25  -2.464   5.420   5.021
  174    HZ1  LYS  25           3HZ      LYS  25  -0.993   7.347   5.180
  175    HZ2  LYS  25           1HZ      LYS  25  -2.609   7.817   5.010
  176    HZ3  LYS  25           2HZ      LYS  25  -1.555   7.916   3.691
  177    H    ARG  26           H        ARG  26  -1.364   1.026   6.009
  178    HA   ARG  26           HA       ARG  26   0.465   0.210   8.023
  179    HE   ARG  26           HE       ARG  26  -2.527  -2.489   9.641
  180    HB2  ARG  26           2HB      ARG  26  -1.268  -0.993   8.945
  181    HB3  ARG  26           1HB      ARG  26  -2.169   0.177   7.995
  182    HG2  ARG  26           2HG      ARG  26  -2.346  -1.513   6.186
  183    HG3  ARG  26           1HG      ARG  26  -1.584  -2.683   7.269
  184    HD2  ARG  26           2HD      ARG  26  -4.147  -1.196   7.789
  185    HD3  ARG  26           1HD      ARG  26  -4.024  -2.883   7.291
  186   HH11  ARG  26          1HH1      ARG  26  -5.831  -2.617   8.539
  187   HH12  ARG  26          2HH1      ARG  26  -6.455  -3.150  10.065
  188   HH21  ARG  26          1HH2      ARG  26  -3.340  -3.189  11.653
  189   HH22  ARG  26          2HH2      ARG  26  -5.039  -3.474  11.835
  190    H    ALA  27           H        ALA  27  -0.524  -1.088   4.919
  191    HA   ALA  27           HA       ALA  27   0.801  -3.608   5.249
  192    HB1  ALA  27           3HB      ALA  27  -1.070  -3.333   3.693
  193    HB2  ALA  27           1HB      ALA  27   0.373  -3.926   2.871
  194    HB3  ALA  27           2HB      ALA  27  -0.096  -2.234   2.717
  195    H    LEU  28           H        LEU  28   1.666  -0.475   3.923
  196    HA   LEU  28           HA       LEU  28   4.124  -1.329   2.749
  197    HG   LEU  28           HG       LEU  28   1.996   0.204   1.523
  198    HB2  LEU  28           2HB      LEU  28   3.073   1.396   3.491
  199    HB3  LEU  28           1HB      LEU  28   4.612   1.136   2.688
  200   HD11  LEU  28          1HD1      LEU  28   3.399   2.632   0.538
  201   HD12  LEU  28          2HD1      LEU  28   2.390   2.764   1.977
  202   HD13  LEU  28          3HD1      LEU  28   1.690   2.202   0.457
  203   HD21  LEU  28          3HD2      LEU  28   4.524   0.848   0.054
  204   HD22  LEU  28          1HD2      LEU  28   3.187  -0.197  -0.429
  205   HD23  LEU  28          2HD2      LEU  28   4.311  -0.722   0.827
  206    H    GLU  29           H        GLU  29   3.144  -0.092   5.869
  207    HA   GLU  29           HA       GLU  29   5.770   0.455   6.829
  208    HB2  GLU  29           2HB      GLU  29   3.751   1.522   7.764
  209    HB3  GLU  29           1HB      GLU  29   3.219  -0.038   8.377
  210    HG2  GLU  29           2HG      GLU  29   5.196  -0.145   9.811
  211    HG3  GLU  29           1HG      GLU  29   5.716   1.425   9.202
  212    H    ILE  30           H        ILE  30   3.467  -2.191   7.470
  213    HA   ILE  30           HA       ILE  30   5.110  -3.714   9.137
  214    HB   ILE  30           HB       ILE  30   2.944  -4.653   7.256
  215   HG12  ILE  30          2HG1      ILE  30   2.877  -4.103  10.229
  216   HG13  ILE  30          1HG1      ILE  30   2.276  -2.996   9.000
  217   HG21  ILE  30          1HG2      ILE  30   3.391  -6.280   9.604
  218   HG22  ILE  30          2HG2      ILE  30   4.831  -6.199   8.590
  219   HG23  ILE  30          3HG2      ILE  30   3.302  -6.754   7.908
  220   HD11  ILE  30          3HD1      ILE  30   0.477  -4.266  10.045
  221   HD12  ILE  30          1HD1      ILE  30   1.229  -5.770   9.513
  222   HD13  ILE  30          2HD1      ILE  30   0.609  -4.624   8.323
  223    H    ALA  31           H        ALA  31   4.657  -3.924   5.613
  224    HA   ALA  31           HA       ALA  31   6.693  -5.952   5.369
  225    HB1  ALA  31           3HB      ALA  31   4.710  -5.961   3.918
  226    HB2  ALA  31           1HB      ALA  31   6.211  -5.889   2.995
  227    HB3  ALA  31           2HB      ALA  31   5.237  -4.435   3.210
  228    H    GLN  32           H        GLN  32   7.529  -3.421   6.499
  229    HA   GLN  32           HA       GLN  32   9.310  -2.025   6.441
  230    HB2  GLN  32           2HB      GLN  32  10.135  -3.806   4.144
  231    HB3  GLN  32           1HB      GLN  32  11.152  -2.534   4.808
  232    HG2  GLN  32           2HG      GLN  32  11.111  -3.653   6.986
  233    HG3  GLN  32           1HG      GLN  32  10.114  -4.935   6.299
  234   HE21  GLN  32          1HE2      GLN  32  11.647  -6.505   6.770
  235   HE22  GLN  32          2HE2      GLN  32  13.120  -6.652   5.882
  236    H    ASN  33           H        ASN  33   9.050  -2.575   2.928
  237    HA   ASN  33           HA       ASN  33   7.680  -0.113   2.458
  238    HB2  ASN  33           2HB      ASN  33   9.525   0.997   1.220
  239    HB3  ASN  33           1HB      ASN  33   9.858   0.842   2.943
  240   HD21  ASN  33          1HD2      ASN  33  11.419  -0.618   3.642
  241   HD22  ASN  33          2HD2      ASN  33  12.602  -1.275   2.568
  242    H    ASN  34           H        ASN  34   7.873  -3.072   1.740
  243    HA   ASN  34           HA       ASN  34   8.264  -3.015  -1.129
  244    HB2  ASN  34           2HB      ASN  34   7.359  -5.230   0.708
  245    HB3  ASN  34           1HB      ASN  34   7.669  -5.421  -1.012
  246   HD21  ASN  34          1HD2      ASN  34   9.943  -3.634  -1.025
  247   HD22  ASN  34          2HD2      ASN  34  11.237  -4.483  -0.258
  248    H    VAL  35           H        VAL  35   6.723  -2.251  -2.410
  249    HA   VAL  35           HA       VAL  35   3.982  -2.095  -1.561
  250    HB   VAL  35           HB       VAL  35   4.421  -0.269  -2.864
  251   HG11  VAL  35          1HG1      VAL  35   6.226  -2.077  -4.412
  252   HG12  VAL  35          2HG1      VAL  35   6.590  -0.572  -3.563
  253   HG13  VAL  35          3HG1      VAL  35   5.708  -0.533  -5.091
  254   HG21  VAL  35          3HG2      VAL  35   3.571  -2.180  -5.036
  255   HG22  VAL  35          1HG2      VAL  35   3.290  -0.440  -4.969
  256   HG23  VAL  35          2HG2      VAL  35   2.481  -1.509  -3.823
  257    H    GLU  36           H        GLU  36   5.856  -4.091  -3.775
  258    HA   GLU  36           HA       GLU  36   3.778  -5.351  -5.135
  259    HB2  GLU  36           2HB      GLU  36   6.378  -6.623  -4.290
  260    HB3  GLU  36           1HB      GLU  36   5.354  -7.124  -5.626
  261    HG2  GLU  36           2HG      GLU  36   5.800  -5.001  -6.757
  262    HG3  GLU  36           1HG      GLU  36   6.843  -4.516  -5.421
  263    H    VAL  37           H        VAL  37   5.527  -6.579  -2.276
  264    HA   VAL  37           HA       VAL  37   3.818  -8.750  -1.799
  265    HB   VAL  37           HB       VAL  37   5.440  -7.216   0.242
  266   HG11  VAL  37          1HG1      VAL  37   3.755  -8.727   1.210
  267   HG12  VAL  37          2HG1      VAL  37   5.402  -9.260   1.539
  268   HG13  VAL  37          3HG1      VAL  37   4.449 -10.064   0.293
  269   HG21  VAL  37          3HG2      VAL  37   6.195  -9.551  -1.512
  270   HG22  VAL  37          1HG2      VAL  37   7.168  -8.937  -0.174
  271   HG23  VAL  37          2HG2      VAL  37   6.859  -7.918  -1.580
  272    H    ALA  38           H        ALA  38   3.791  -5.430  -0.573
  273    HA   ALA  38           HA       ALA  38   1.666  -5.698   1.235
  274    HB1  ALA  38           3HB      ALA  38   2.885  -3.742   1.483
  275    HB2  ALA  38           1HB      ALA  38   1.401  -3.169   0.723
  276    HB3  ALA  38           2HB      ALA  38   2.861  -3.391  -0.244
  277    H    ARG  39           H        ARG  39   1.773  -5.363  -2.223
  278    HA   ARG  39           HA       ARG  39  -0.992  -4.668  -2.536
  279    HE   ARG  39           HE       ARG  39  -0.857  -4.227  -6.670
  280    HB2  ARG  39           2HB      ARG  39   1.241  -5.413  -4.392
  281    HB3  ARG  39           1HB      ARG  39  -0.417  -5.469  -4.980
  282    HG2  ARG  39           2HG      ARG  39  -0.711  -3.121  -4.425
  283    HG3  ARG  39           1HG      ARG  39   0.931  -3.059  -3.782
  284    HD2  ARG  39           2HD      ARG  39   0.896  -2.150  -6.017
  285    HD3  ARG  39           1HD      ARG  39   1.801  -3.664  -5.991
  286   HH11  ARG  39          1HH1      ARG  39   1.937  -2.616  -7.992
  287   HH12  ARG  39          2HH1      ARG  39   1.495  -2.926  -9.638
  288   HH21  ARG  39          1HH2      ARG  39  -1.447  -4.634  -8.833
  289   HH22  ARG  39          2HH2      ARG  39  -0.429  -4.070 -10.116
  290    H    SER  40           H        SER  40   0.910  -7.600  -2.491
  291    HA   SER  40           HA       SER  40  -1.035  -9.362  -3.522
  292    HG   SER  40           HG       SER  40   1.056  -9.809  -4.369
  293    HB2  SER  40           2HB      SER  40   1.211  -9.912  -1.563
  294    HB3  SER  40           1HB      SER  40   0.307 -11.140  -2.448
  295    H    ILE  41           H        ILE  41  -0.355  -8.141  -0.297
  296    HA   ILE  41           HA       ILE  41  -2.458  -9.758   0.890
  297    HB   ILE  41           HB       ILE  41  -0.421  -9.400   2.178
  298   HG12  ILE  41          2HG1      ILE  41  -2.716  -7.886   3.441
  299   HG13  ILE  41          1HG1      ILE  41  -2.633  -9.641   3.331
  300   HG21  ILE  41          1HG2      ILE  41   0.236  -7.242   1.296
  301   HG22  ILE  41          2HG2      ILE  41   0.147  -7.178   3.056
  302   HG23  ILE  41          3HG2      ILE  41  -1.145  -6.476   2.081
  303   HD11  ILE  41          3HD1      ILE  41  -1.964  -8.818   5.530
  304   HD12  ILE  41          1HD1      ILE  41  -0.663  -7.890   4.783
  305   HD13  ILE  41          2HD1      ILE  41  -0.641  -9.652   4.712
  306    H    LEU  42           H        LEU  42  -2.012  -6.576  -0.387
  307    HA   LEU  42           HA       LEU  42  -3.960  -5.120   0.950
  308    HG   LEU  42           HG       LEU  42  -3.318  -2.383  -1.383
  309    HB2  LEU  42           2HB      LEU  42  -2.246  -4.346  -0.772
  310    HB3  LEU  42           1HB      LEU  42  -3.373  -4.883  -1.996
  311   HD11  LEU  42          1HD1      LEU  42  -5.709  -2.158  -1.779
  312   HD12  LEU  42          2HD1      LEU  42  -5.945  -3.862  -1.393
  313   HD13  LEU  42          3HD1      LEU  42  -5.009  -3.402  -2.815
  314   HD21  LEU  42          3HD2      LEU  42  -4.995  -3.396   0.911
  315   HD22  LEU  42          1HD2      LEU  42  -4.737  -1.711   0.466
  316   HD23  LEU  42          2HD2      LEU  42  -3.390  -2.684   1.052
  317    H    ARG  43           H        ARG  43  -4.257  -7.418  -1.694
  318    HA   ARG  43           HA       ARG  43  -7.030  -6.874  -2.176
  319    HE   ARG  43           HE       ARG  43  -9.490  -9.136  -5.158
  320    HB2  ARG  43           2HB      ARG  43  -5.513  -7.767  -3.914
  321    HB3  ARG  43           1HB      ARG  43  -5.379  -9.268  -3.006
  322    HG2  ARG  43           2HG      ARG  43  -7.005  -9.882  -4.459
  323    HG3  ARG  43           1HG      ARG  43  -8.029  -9.143  -3.224
  324    HD2  ARG  43           2HD      ARG  43  -7.775  -6.993  -4.495
  325    HD3  ARG  43           1HD      ARG  43  -7.085  -7.936  -5.799
  326   HH11  ARG  43          1HH1      ARG  43  -8.405  -6.043  -6.339
  327   HH12  ARG  43          2HH1      ARG  43  -9.861  -5.724  -7.221
  328   HH21  ARG  43          1HH2      ARG  43 -11.411  -8.724  -6.319
  329   HH22  ARG  43          2HH2      ARG  43 -11.568  -7.248  -7.211
  330    H    GLU  44           H        GLU  44  -5.210  -9.087  -0.171
  331    HA   GLU  44           HA       GLU  44  -7.233 -10.944   0.402
  332    HB2  GLU  44           2HB      GLU  44  -4.825 -11.248   0.949
  333    HB3  GLU  44           1HB      GLU  44  -4.992 -10.050   2.224
  334    HG2  GLU  44           2HG      GLU  44  -5.064 -12.274   3.151
  335    HG3  GLU  44           1HG      GLU  44  -6.628 -11.484   3.347
  336    H    PHE  45           H        PHE  45  -6.041  -8.542   2.744
  337    HA   PHE  45           HA       PHE  45  -8.407  -8.603   4.286
  338    HD1  PHE  45           1HD      PHE  45  -4.561  -8.609   4.497
  339    HD2  PHE  45           2HD      PHE  45  -7.756  -7.861   7.206
  340    HE1  PHE  45           1HE      PHE  45  -3.533 -10.137   6.126
  341    HE2  PHE  45           2HE      PHE  45  -6.734  -9.389   8.840
  342    HZ   PHE  45           HZ       PHE  45  -4.618 -10.528   8.302
  343    HB2  PHE  45           2HB      PHE  45  -6.061  -6.714   4.199
  344    HB3  PHE  45           1HB      PHE  45  -7.418  -6.456   5.291
  345    H    ALA  46           H        ALA  46 -10.153  -7.243   4.387
  346    HA   ALA  46           HA       ALA  46 -10.303  -4.973   2.563
  347    HB1  ALA  46           3HB      ALA  46 -12.400  -5.714   1.569
  348    HB2  ALA  46           1HB      ALA  46 -12.314  -7.221   2.482
  349    HB3  ALA  46           2HB      ALA  46 -11.111  -6.871   1.241
  Start of MODEL    6
    1    HA   ALA   3           HA       ALA   3  10.715  13.310  -8.612
    2    HB1  ALA   3           3HB      ALA   3  11.630  16.097  -9.312
    3    HB2  ALA   3           1HB      ALA   3  11.648  14.707 -10.398
    4    HB3  ALA   3           2HB      ALA   3  12.667  14.715  -8.958
    5    H    LEU   4           H        LEU   4   8.671  14.998  -7.030
    6    HA   LEU   4           HA       LEU   4  10.428  15.815  -4.821
    7    HG   LEU   4           HG       LEU   4  10.036  18.184  -5.343
    8    HB2  LEU   4           2HB      LEU   4   7.552  16.480  -5.440
    9    HB3  LEU   4           1HB      LEU   4   8.336  16.912  -3.933
   10   HD11  LEU   4          1HD1      LEU   4   9.572  17.169  -7.493
   11   HD12  LEU   4          2HD1      LEU   4   9.255  18.902  -7.560
   12   HD13  LEU   4          3HD1      LEU   4   7.912  17.764  -7.441
   13   HD21  LEU   4          3HD2      LEU   4   8.573  20.128  -5.553
   14   HD22  LEU   4          1HD2      LEU   4   8.297  19.280  -4.031
   15   HD23  LEU   4          2HD2      LEU   4   7.160  19.090  -5.366
   16    H    GLU   5           H        GLU   5   7.259  14.240  -5.283
   17    HA   GLU   5           HA       GLU   5   7.094  13.132  -2.715
   18    HB2  GLU   5           2HB      GLU   5   5.375  11.646  -3.665
   19    HB3  GLU   5           1HB      GLU   5   5.147  13.318  -4.158
   20    HG2  GLU   5           2HG      GLU   5   6.123  12.837  -6.326
   21    HG3  GLU   5           1HG      GLU   5   6.426  11.171  -5.835
   22    H    ASN   6           H        ASN   6   7.586  11.130  -1.876
   23    HA   ASN   6           HA       ASN   6   9.256   9.365  -3.536
   24    HB2  ASN   6           2HB      ASN   6  10.730  10.664  -2.073
   25    HB3  ASN   6           1HB      ASN   6   9.794  10.167  -0.666
   26   HD21  ASN   6          1HD2      ASN   6   9.982   8.072   0.103
   27   HD22  ASN   6          2HD2      ASN   6  11.273   7.027  -0.373
   28    H    VAL   7           H        VAL   7   7.571   9.568  -0.402
   29    HA   VAL   7           HA       VAL   7   7.089   6.726  -0.387
   30    HB   VAL   7           HB       VAL   7   5.850   7.191   1.730
   31   HG11  VAL   7          1HG1      VAL   7   8.651   8.289   1.538
   32   HG12  VAL   7          2HG1      VAL   7   8.196   6.604   1.792
   33   HG13  VAL   7          3HG1      VAL   7   7.845   7.809   3.031
   34   HG21  VAL   7          3HG2      VAL   7   6.769  10.024   1.245
   35   HG22  VAL   7          1HG2      VAL   7   6.013   9.423   2.721
   36   HG23  VAL   7          2HG2      VAL   7   5.099   9.456   1.213
   37    H    ASP   8           H        ASP   8   5.330   9.667  -1.067
   38    HA   ASP   8           HA       ASP   8   2.707   8.698  -1.009
   39    HB2  ASP   8           2HB      ASP   8   3.269  11.089  -1.186
   40    HB3  ASP   8           1HB      ASP   8   3.895  10.819  -2.810
   41    H    ALA   9           H        ALA   9   5.142   8.638  -3.569
   42    HA   ALA   9           HA       ALA   9   3.598   7.781  -5.701
   43    HB1  ALA   9           3HB      ALA   9   5.879   8.407  -6.047
   44    HB2  ALA   9           1HB      ALA   9   5.702   6.724  -6.545
   45    HB3  ALA   9           2HB      ALA   9   6.446   7.111  -4.994
   46    H    LYS  10           H        LYS  10   5.030   5.902  -3.077
   47    HA   LYS  10           HA       LYS  10   4.276   3.363  -4.112
   48    HB2  LYS  10           2HB      LYS  10   4.717   3.995  -1.198
   49    HB3  LYS  10           1HB      LYS  10   4.972   2.467  -2.021
   50    HG2  LYS  10           2HG      LYS  10   6.646   4.951  -2.137
   51    HG3  LYS  10           1HG      LYS  10   7.112   3.337  -1.615
   52    HD2  LYS  10           2HD      LYS  10   6.367   4.089  -4.440
   53    HD3  LYS  10           1HD      LYS  10   8.018   3.951  -3.837
   54    HE2  LYS  10           2HE      LYS  10   7.546   1.587  -3.258
   55    HE3  LYS  10           1HE      LYS  10   5.959   1.764  -4.005
   56    HZ1  LYS  10           3HZ      LYS  10   7.546   0.762  -5.524
   57    HZ2  LYS  10           1HZ      LYS  10   8.563   2.108  -5.391
   58    HZ3  LYS  10           2HZ      LYS  10   7.037   2.267  -6.105
   59    H    ILE  11           H        ILE  11   2.859   5.582  -1.746
   60    HA   ILE  11           HA       ILE  11   0.701   4.019  -0.944
   61    HB   ILE  11           HB       ILE  11   0.740   7.022  -1.281
   62   HG12  ILE  11          2HG1      ILE  11   1.457   5.271   1.089
   63   HG13  ILE  11          1HG1      ILE  11   2.580   6.223   0.127
   64   HG21  ILE  11          1HG2      ILE  11  -0.895   5.673   0.788
   65   HG22  ILE  11          2HG2      ILE  11  -1.440   5.525  -0.884
   66   HG23  ILE  11          3HG2      ILE  11  -1.233   7.124  -0.159
   67   HD11  ILE  11          3HD1      ILE  11   2.090   7.313   2.235
   68   HD12  ILE  11          1HD1      ILE  11   0.370   7.321   1.848
   69   HD13  ILE  11          2HD1      ILE  11   1.495   8.274   0.881
   70    H    ALA  12           H        ALA  12   0.705   6.580  -3.427
   71    HA   ALA  12           HA       ALA  12  -1.834   6.121  -4.447
   72    HB1  ALA  12           3HB      ALA  12   0.608   7.049  -5.963
   73    HB2  ALA  12           1HB      ALA  12  -0.478   8.081  -5.032
   74    HB3  ALA  12           2HB      ALA  12  -1.068   7.252  -6.473
   75    H    LYS  13           H        LYS  13   1.245   4.584  -5.149
   76    HA   LYS  13           HA       LYS  13   0.578   3.063  -7.365
   77    HB2  LYS  13           2HB      LYS  13   2.848   3.270  -6.315
   78    HB3  LYS  13           1HB      LYS  13   2.322   2.140  -5.077
   79    HG2  LYS  13           2HG      LYS  13   3.604   0.959  -6.712
   80    HG3  LYS  13           1HG      LYS  13   1.917   0.460  -6.849
   81    HD2  LYS  13           2HD      LYS  13   1.630   1.523  -8.868
   82    HD3  LYS  13           1HD      LYS  13   2.903   2.702  -8.544
   83    HE2  LYS  13           2HE      LYS  13   3.561   1.109 -10.283
   84    HE3  LYS  13           1HE      LYS  13   4.593   1.010  -8.857
   85    HZ1  LYS  13           3HZ      LYS  13   3.346  -0.928  -8.131
   86    HZ2  LYS  13           1HZ      LYS  13   4.003  -1.184  -9.670
   87    HZ3  LYS  13           2HZ      LYS  13   2.356  -0.833  -9.500
   88    H    LEU  14           H        LEU  14  -0.175   2.609  -3.967
   89    HA   LEU  14           HA       LEU  14  -1.373   0.006  -4.434
   90    HG   LEU  14           HG       LEU  14  -0.384  -1.151  -2.719
   91    HB2  LEU  14           2HB      LEU  14  -0.908   1.730  -2.047
   92    HB3  LEU  14           1HB      LEU  14  -2.186   0.531  -1.965
   93   HD11  LEU  14          1HD1      LEU  14   1.256   0.620  -3.329
   94   HD12  LEU  14          2HD1      LEU  14   1.881  -0.609  -2.230
   95   HD13  LEU  14          3HD1      LEU  14   1.427   0.979  -1.610
   96   HD21  LEU  14          3HD2      LEU  14  -0.181   0.094   0.018
   97   HD22  LEU  14          1HD2      LEU  14   0.287  -1.545  -0.432
   98   HD23  LEU  14          2HD2      LEU  14  -1.410  -1.068  -0.485
   99    H    MET  15           H        MET  15  -2.356   3.336  -4.151
  100    HA   MET  15           HA       MET  15  -5.098   2.987  -3.675
  101    HB2  MET  15           2HB      MET  15  -3.341   5.144  -4.550
  102    HB3  MET  15           1HB      MET  15  -4.928   5.230  -5.299
  103    HG2  MET  15           2HG      MET  15  -4.366   5.114  -2.345
  104    HG3  MET  15           1HG      MET  15  -4.843   6.542  -3.262
  105    HE1  MET  15           3HE      MET  15  -8.478   5.545  -4.398
  106    HE2  MET  15           1HE      MET  15  -6.963   5.320  -5.274
  107    HE3  MET  15           2HE      MET  15  -7.265   6.825  -4.404
  108    H    GLY  16           H        GLY  16  -3.170   2.551  -6.516
  109    HA2  GLY  16           2HA      GLY  16  -4.895   2.816  -8.616
  110    HA3  GLY  16           1HA      GLY  16  -3.706   1.524  -8.509
  111    H    GLU  17           H        GLU  17  -4.526  -0.166  -6.717
  112    HA   GLU  17           HA       GLU  17  -6.616  -1.582  -7.898
  113    HB2  GLU  17           2HB      GLU  17  -5.358  -1.769  -5.166
  114    HB3  GLU  17           1HB      GLU  17  -6.627  -2.872  -5.694
  115    HG2  GLU  17           2HG      GLU  17  -5.289  -3.832  -7.331
  116    HG3  GLU  17           1HG      GLU  17  -4.155  -2.472  -7.329
  117    H    GLY  18           H        GLY  18  -6.592   0.657  -5.179
  118    HA2  GLY  18           2HA      GLY  18  -8.376   2.012  -4.506
  119    HA3  GLY  18           1HA      GLY  18  -9.465   1.025  -5.470
  120    H    TYR  19           H        TYR  19  -7.911   1.424  -2.389
  121    HA   TYR  19           HA       TYR  19  -9.919  -0.271  -1.155
  122    HD1  TYR  19           2HD      TYR  19  -9.265  -2.952  -2.399
  123    HD2  TYR  19           1HD      TYR  19  -8.394  -2.101   1.676
  124    HE1  TYR  19           2HE      TYR  19 -10.496  -4.970  -1.722
  125    HE2  TYR  19           1HE      TYR  19  -9.622  -4.116   2.367
  126    HH   TYR  19           HH       TYR  19 -10.555  -6.535   0.196
  127    HB2  TYR  19           2HB      TYR  19  -7.437  -1.377  -1.727
  128    HB3  TYR  19           1HB      TYR  19  -7.296  -0.892  -0.043
  129    H    ALA  20           H        ALA  20  -9.145  -0.356   1.389
  130    HA   ALA  20           HA       ALA  20  -9.580   2.219   2.368
  131    HB1  ALA  20           3HB      ALA  20  -9.876  -0.034   3.558
  132    HB2  ALA  20           1HB      ALA  20  -9.304   1.331   4.518
  133    HB3  ALA  20           2HB      ALA  20  -8.164   0.106   3.963
  134    H    PHE  21           H        PHE  21  -8.228   3.776   3.275
  135    HA   PHE  21           HA       PHE  21  -5.609   3.931   2.121
  136    HD1  PHE  21           2HD      PHE  21  -5.321   6.396   0.892
  137    HD2  PHE  21           1HD      PHE  21  -9.034   6.189   2.961
  138    HE1  PHE  21           2HE      PHE  21  -6.446   7.445  -1.029
  139    HE2  PHE  21           1HE      PHE  21 -10.166   7.238   1.045
  140    HZ   PHE  21           HZ       PHE  21  -8.872   7.869  -0.953
  141    HB2  PHE  21           2HB      PHE  21  -7.034   5.725   4.099
  142    HB3  PHE  21           1HB      PHE  21  -5.469   6.087   3.379
  143    H    GLU  22           H        GLU  22  -6.973   3.302   5.285
  144    HA   GLU  22           HA       GLU  22  -4.576   3.373   6.769
  145    HB2  GLU  22           2HB      GLU  22  -7.122   1.818   7.261
  146    HB3  GLU  22           1HB      GLU  22  -5.826   2.005   8.433
  147    HG2  GLU  22           2HG      GLU  22  -6.177   4.422   8.437
  148    HG3  GLU  22           1HG      GLU  22  -7.478   4.232   7.263
  149    H    GLU  23           H        GLU  23  -6.190   0.807   4.967
  150    HA   GLU  23           HA       GLU  23  -4.488  -1.294   5.821
  151    HB2  GLU  23           2HB      GLU  23  -6.328  -0.983   3.461
  152    HB3  GLU  23           1HB      GLU  23  -5.392  -2.448   3.741
  153    HG2  GLU  23           2HG      GLU  23  -6.452  -2.590   5.995
  154    HG3  GLU  23           1HG      GLU  23  -7.508  -1.263   5.514
  155    H    VAL  24           H        VAL  24  -4.279   1.106   3.309
  156    HA   VAL  24           HA       VAL  24  -2.260  -0.144   1.754
  157    HB   VAL  24           HB       VAL  24  -3.136   2.729   1.986
  158   HG11  VAL  24          1HG1      VAL  24  -1.181   1.574   0.003
  159   HG12  VAL  24          2HG1      VAL  24  -0.767   2.654   1.330
  160   HG13  VAL  24          3HG1      VAL  24  -1.798   3.224   0.019
  161   HG21  VAL  24          3HG2      VAL  24  -3.463   0.817  -0.314
  162   HG22  VAL  24          1HG2      VAL  24  -4.263   2.370  -0.070
  163   HG23  VAL  24          2HG2      VAL  24  -4.664   0.996   0.963
  164    H    LYS  25           H        LYS  25  -1.983   2.745   3.844
  165    HA   LYS  25           HA       LYS  25   0.802   2.820   3.877
  166    HB2  LYS  25           2HB      LYS  25  -1.217   3.830   5.872
  167    HB3  LYS  25           1HB      LYS  25   0.507   4.123   6.037
  168    HG2  LYS  25           2HG      LYS  25  -0.353   6.054   5.045
  169    HG3  LYS  25           1HG      LYS  25   0.408   5.160   3.736
  170    HD2  LYS  25           2HD      LYS  25  -1.670   4.445   2.877
  171    HD3  LYS  25           1HD      LYS  25  -2.523   4.925   4.345
  172    HE2  LYS  25           2HE      LYS  25  -1.185   6.801   2.401
  173    HE3  LYS  25           1HE      LYS  25  -2.917   6.488   2.493
  174    HZ1  LYS  25           3HZ      LYS  25  -1.250   7.684   4.641
  175    HZ2  LYS  25           1HZ      LYS  25  -2.907   7.360   4.756
  176    HZ3  LYS  25           2HZ      LYS  25  -2.344   8.514   3.655
  177    H    ARG  26           H        ARG  26  -1.422   1.185   6.121
  178    HA   ARG  26           HA       ARG  26   0.567   0.343   7.927
  179    HE   ARG  26           HE       ARG  26  -2.378  -2.494   9.697
  180    HB2  ARG  26           2HB      ARG  26  -1.066  -0.931   8.967
  181    HB3  ARG  26           1HB      ARG  26  -2.019   0.318   8.181
  182    HG2  ARG  26           2HG      ARG  26  -2.427  -1.276   6.309
  183    HG3  ARG  26           1HG      ARG  26  -1.637  -2.524   7.278
  184    HD2  ARG  26           2HD      ARG  26  -4.078  -0.941   8.046
  185    HD3  ARG  26           1HD      ARG  26  -4.061  -2.623   7.519
  186   HH11  ARG  26          1HH1      ARG  26  -5.733  -1.827   9.043
  187   HH12  ARG  26          2HH1      ARG  26  -6.258  -2.209  10.648
  188   HH21  ARG  26          1HH2      ARG  26  -3.058  -2.999  11.818
  189   HH22  ARG  26          2HH2      ARG  26  -4.737  -2.878  12.225
  190    H    ALA  27           H        ALA  27  -0.689  -1.081   4.951
  191    HA   ALA  27           HA       ALA  27   0.673  -3.567   5.229
  192    HB1  ALA  27           3HB      ALA  27  -1.246  -3.311   3.736
  193    HB2  ALA  27           1HB      ALA  27   0.169  -3.889   2.856
  194    HB3  ALA  27           2HB      ALA  27  -0.320  -2.200   2.727
  195    H    LEU  28           H        LEU  28   1.507  -0.437   3.942
  196    HA   LEU  28           HA       LEU  28   3.884  -1.219   2.599
  197    HG   LEU  28           HG       LEU  28   1.671   0.664   1.623
  198    HB2  LEU  28           2HB      LEU  28   2.850   1.428   3.603
  199    HB3  LEU  28           1HB      LEU  28   4.392   1.274   2.779
  200   HD11  LEU  28          1HD1      LEU  28   2.535   2.513   0.028
  201   HD12  LEU  28          2HD1      LEU  28   3.619   2.913   1.364
  202   HD13  LEU  28          3HD1      LEU  28   1.872   2.965   1.598
  203   HD21  LEU  28          3HD2      LEU  28   3.317   0.627  -0.490
  204   HD22  LEU  28          1HD2      LEU  28   2.875  -0.825   0.413
  205   HD23  LEU  28          2HD2      LEU  28   4.405  -0.016   0.740
  206    H    GLU  29           H        GLU  29   3.122  -0.201   5.862
  207    HA   GLU  29           HA       GLU  29   5.856   0.164   6.646
  208    HB2  GLU  29           2HB      GLU  29   3.978   1.373   7.718
  209    HB3  GLU  29           1HB      GLU  29   3.394  -0.152   8.371
  210    HG2  GLU  29           2HG      GLU  29   5.463  -0.398   9.646
  211    HG3  GLU  29           1HG      GLU  29   6.046   1.132   8.991
  212    H    ILE  30           H        ILE  30   3.478  -2.425   6.894
  213    HA   ILE  30           HA       ILE  30   4.758  -4.099   8.706
  214    HB   ILE  30           HB       ILE  30   2.987  -4.742   6.356
  215   HG12  ILE  30          2HG1      ILE  30   2.482  -4.906   9.333
  216   HG13  ILE  30          1HG1      ILE  30   2.060  -3.514   8.344
  217   HG21  ILE  30          1HG2      ILE  30   2.869  -6.944   7.977
  218   HG22  ILE  30          2HG2      ILE  30   4.587  -6.543   8.006
  219   HG23  ILE  30          3HG2      ILE  30   3.774  -6.833   6.467
  220   HD11  ILE  30          3HD1      ILE  30   0.126  -4.910   8.719
  221   HD12  ILE  30          1HD1      ILE  30   0.973  -6.304   8.049
  222   HD13  ILE  30          2HD1      ILE  30   0.571  -4.936   7.012
  223    H    ALA  31           H        ALA  31   4.852  -4.471   5.153
  224    HA   ALA  31           HA       ALA  31   7.175  -6.162   5.336
  225    HB1  ALA  31           3HB      ALA  31   5.675  -5.082   2.955
  226    HB2  ALA  31           1HB      ALA  31   5.523  -6.687   3.670
  227    HB3  ALA  31           2HB      ALA  31   7.019  -6.218   2.861
  228    H    GLN  32           H        GLN  32   7.809  -3.742   6.443
  229    HA   GLN  32           HA       GLN  32   9.401  -2.157   6.479
  230    HB2  GLN  32           2HB      GLN  32  10.910  -3.881   5.717
  231    HB3  GLN  32           1HB      GLN  32  10.399  -3.651   4.052
  232    HG2  GLN  32           2HG      GLN  32  11.244  -1.317   4.224
  233    HG3  GLN  32           1HG      GLN  32  11.962  -1.757   5.769
  234   HE21  GLN  32          1HE2      GLN  32  14.056  -1.426   5.064
  235   HE22  GLN  32          2HE2      GLN  32  14.840  -2.481   3.943
  236    H    ASN  33           H        ASN  33   9.181  -2.480   2.933
  237    HA   ASN  33           HA       ASN  33   7.553  -0.135   2.670
  238    HB2  ASN  33           2HB      ASN  33   9.156   1.314   1.622
  239    HB3  ASN  33           1HB      ASN  33   9.824   0.814   3.173
  240   HD21  ASN  33          1HD2      ASN  33  10.056   0.530  -0.279
  241   HD22  ASN  33          2HD2      ASN  33  11.615  -0.213  -0.317
  242    H    ASN  34           H        ASN  34   8.140  -3.040   1.748
  243    HA   ASN  34           HA       ASN  34   8.409  -2.815  -1.100
  244    HB2  ASN  34           2HB      ASN  34   7.597  -5.163   0.611
  245    HB3  ASN  34           1HB      ASN  34   7.974  -5.243  -1.105
  246   HD21  ASN  34          1HD2      ASN  34   9.243  -6.588   1.142
  247   HD22  ASN  34          2HD2      ASN  34  10.907  -6.126   1.103
  248    H    VAL  35           H        VAL  35   6.840  -2.022  -2.311
  249    HA   VAL  35           HA       VAL  35   4.116  -1.938  -1.503
  250    HB   VAL  35           HB       VAL  35   4.544  -0.172  -2.888
  251   HG11  VAL  35          1HG1      VAL  35   6.351  -2.045  -4.342
  252   HG12  VAL  35          2HG1      VAL  35   6.694  -0.472  -3.616
  253   HG13  VAL  35          3HG1      VAL  35   5.797  -0.568  -5.133
  254   HG21  VAL  35          3HG2      VAL  35   3.668  -2.172  -4.967
  255   HG22  VAL  35          1HG2      VAL  35   3.389  -0.431  -4.971
  256   HG23  VAL  35          2HG2      VAL  35   2.592  -1.449  -3.772
  257    H    GLU  36           H        GLU  36   5.988  -4.079  -3.557
  258    HA   GLU  36           HA       GLU  36   3.953  -5.377  -4.927
  259    HB2  GLU  36           2HB      GLU  36   6.518  -6.555  -3.869
  260    HB3  GLU  36           1HB      GLU  36   5.505  -7.282  -5.106
  261    HG2  GLU  36           2HG      GLU  36   5.918  -5.379  -6.571
  262    HG3  GLU  36           1HG      GLU  36   6.924  -4.636  -5.328
  263    H    VAL  37           H        VAL  37   5.511  -6.532  -1.925
  264    HA   VAL  37           HA       VAL  37   3.715  -8.611  -1.426
  265    HB   VAL  37           HB       VAL  37   5.232  -6.984   0.621
  266   HG11  VAL  37          1HG1      VAL  37   3.444  -8.346   1.591
  267   HG12  VAL  37          2HG1      VAL  37   5.039  -8.943   2.044
  268   HG13  VAL  37          3HG1      VAL  37   4.107  -9.775   0.800
  269   HG21  VAL  37          3HG2      VAL  37   6.685  -7.918  -1.129
  270   HG22  VAL  37          1HG2      VAL  37   6.036  -9.524  -0.794
  271   HG23  VAL  37          2HG2      VAL  37   6.966  -8.674   0.440
  272    H    ALA  38           H        ALA  38   3.718  -5.261  -0.252
  273    HA   ALA  38           HA       ALA  38   1.462  -5.382   1.370
  274    HB1  ALA  38           3HB      ALA  38   2.703  -3.439   1.591
  275    HB2  ALA  38           1HB      ALA  38   1.284  -2.879   0.704
  276    HB3  ALA  38           2HB      ALA  38   2.800  -3.183  -0.151
  277    H    ARG  39           H        ARG  39   1.789  -5.159  -2.095
  278    HA   ARG  39           HA       ARG  39  -0.935  -4.462  -2.613
  279    HE   ARG  39           HE       ARG  39  -0.415  -4.447  -6.743
  280    HB2  ARG  39           2HB      ARG  39   1.385  -5.348  -4.291
  281    HB3  ARG  39           1HB      ARG  39  -0.236  -5.389  -4.973
  282    HG2  ARG  39           2HG      ARG  39  -0.493  -3.006  -4.521
  283    HG3  ARG  39           1HG      ARG  39   1.126  -2.966  -3.821
  284    HD2  ARG  39           2HD      ARG  39   1.218  -2.160  -6.085
  285    HD3  ARG  39           1HD      ARG  39   2.045  -3.713  -5.972
  286   HH11  ARG  39          1HH1      ARG  39   1.754  -1.994  -7.938
  287   HH12  ARG  39          2HH1      ARG  39   1.182  -2.102  -9.570
  288   HH21  ARG  39          1HH2      ARG  39  -1.173  -4.594  -8.890
  289   HH22  ARG  39          2HH2      ARG  39  -0.480  -3.579 -10.110
  290    H    SER  40           H        SER  40   0.891  -7.448  -2.347
  291    HA   SER  40           HA       SER  40  -0.991  -9.215  -3.430
  292    HG   SER  40           HG       SER  40   1.364 -10.527  -3.826
  293    HB2  SER  40           2HB      SER  40   0.981  -9.707  -1.180
  294    HB3  SER  40           1HB      SER  40   0.149 -10.959  -2.103
  295    H    ILE  41           H        ILE  41  -0.542  -8.052  -0.110
  296    HA   ILE  41           HA       ILE  41  -2.837  -9.476   0.880
  297    HB   ILE  41           HB       ILE  41  -1.102  -7.330   2.106
  298   HG12  ILE  41          2HG1      ILE  41  -0.592  -9.320   3.666
  299   HG13  ILE  41          1HG1      ILE  41  -1.336 -10.316   2.419
  300   HG21  ILE  41          1HG2      ILE  41  -3.423  -8.797   3.351
  301   HG22  ILE  41          2HG2      ILE  41  -3.313  -7.065   3.034
  302   HG23  ILE  41          3HG2      ILE  41  -2.260  -7.810   4.235
  303   HD11  ILE  41          3HD1      ILE  41   1.016  -8.494   1.980
  304   HD12  ILE  41          1HD1      ILE  41   0.322  -9.626   0.820
  305   HD13  ILE  41          2HD1      ILE  41   1.118 -10.230   2.272
  306    H    LEU  42           H        LEU  42  -2.171  -6.315  -0.416
  307    HA   LEU  42           HA       LEU  42  -4.357  -4.860   0.484
  308    HG   LEU  42           HG       LEU  42  -3.261  -2.165  -1.775
  309    HB2  LEU  42           2HB      LEU  42  -2.314  -4.148  -0.928
  310    HB3  LEU  42           1HB      LEU  42  -3.272  -4.624  -2.312
  311   HD11  LEU  42          1HD1      LEU  42  -5.590  -1.849  -2.283
  312   HD12  LEU  42          2HD1      LEU  42  -5.974  -3.475  -1.719
  313   HD13  LEU  42          3HD1      LEU  42  -4.989  -3.255  -3.165
  314   HD21  LEU  42          3HD2      LEU  42  -5.008  -3.023   0.530
  315   HD22  LEU  42          1HD2      LEU  42  -4.668  -1.366   0.031
  316   HD23  LEU  42          2HD2      LEU  42  -3.373  -2.377   0.670
  317    H    ARG  43           H        ARG  43  -4.087  -7.112  -2.225
  318    HA   ARG  43           HA       ARG  43  -6.682  -6.628  -3.277
  319    HE   ARG  43           HE       ARG  43  -8.628  -7.632  -4.000
  320    HB2  ARG  43           2HB      ARG  43  -4.867  -7.643  -4.596
  321    HB3  ARG  43           1HB      ARG  43  -4.907  -9.061  -3.558
  322    HG2  ARG  43           2HG      ARG  43  -6.055  -9.535  -5.608
  323    HG3  ARG  43           1HG      ARG  43  -7.227  -9.489  -4.290
  324    HD2  ARG  43           2HD      ARG  43  -6.657  -7.137  -6.054
  325    HD3  ARG  43           1HD      ARG  43  -7.869  -8.335  -6.458
  326   HH11  ARG  43          1HH1      ARG  43  -7.692  -5.693  -6.741
  327   HH12  ARG  43          2HH1      ARG  43  -8.720  -4.367  -6.315
  328   HH21  ARG  43          1HH2      ARG  43  -9.984  -5.892  -3.436
  329   HH22  ARG  43          2HH2      ARG  43 -10.023  -4.480  -4.438
  330    H    GLU  44           H        GLU  44  -5.491  -9.607  -1.722
  331    HA   GLU  44           HA       GLU  44  -8.099  -9.847  -0.376
  332    HB2  GLU  44           2HB      GLU  44  -7.937 -11.429  -2.262
  333    HB3  GLU  44           1HB      GLU  44  -6.466 -12.096  -1.566
  334    HG2  GLU  44           2HG      GLU  44  -7.709 -12.857   0.378
  335    HG3  GLU  44           1HG      GLU  44  -9.187 -12.154  -0.279
  336    H    PHE  45           H        PHE  45  -5.224 -11.900  -0.244
  337    HA   PHE  45           HA       PHE  45  -4.159 -10.871   2.149
  338    HD1  PHE  45           2HD      PHE  45  -4.669 -10.751   4.836
  339    HD2  PHE  45           1HD      PHE  45  -4.511 -14.839   3.664
  340    HE1  PHE  45           2HE      PHE  45  -3.415 -11.285   6.884
  341    HE2  PHE  45           1HE      PHE  45  -3.256 -15.380   5.711
  342    HZ   PHE  45           HZ       PHE  45  -2.707 -13.602   7.324
  343    HB2  PHE  45           2HB      PHE  45  -6.238 -11.753   3.130
  344    HB3  PHE  45           1HB      PHE  45  -5.868 -13.348   2.484
  345    H    ALA  46           H        ALA  46  -4.729 -14.263   1.251
  346    HA   ALA  46           HA       ALA  46  -3.306 -15.963   0.751
  347    HB1  ALA  46           3HB      ALA  46  -1.581 -15.495  -0.919
  348    HB2  ALA  46           1HB      ALA  46  -1.791 -13.765  -0.652
  349    HB3  ALA  46           2HB      ALA  46  -3.109 -14.717  -1.335
  Start of MODEL    7
    1    HA   ALA   3           HA       ALA   3  10.827  13.786  -4.142
    2    HB1  ALA   3           3HB      ALA   3  12.004  14.670  -6.083
    3    HB2  ALA   3           1HB      ALA   3  11.749  12.932  -6.237
    4    HB3  ALA   3           2HB      ALA   3  13.339  13.554  -5.793
    5    H    LEU   4           H        LEU   4  14.027  12.294  -4.521
    6    HA   LEU   4           HA       LEU   4  14.826  10.247  -3.934
    7    HG   LEU   4           HG       LEU   4  16.098  11.036  -1.998
    8    HB2  LEU   4           2HB      LEU   4  13.125  10.867  -1.523
    9    HB3  LEU   4           1HB      LEU   4  14.153   9.451  -1.621
   10   HD11  LEU   4          1HD1      LEU   4  15.773  13.335  -1.161
   11   HD12  LEU   4          2HD1      LEU   4  14.034  13.043  -1.109
   12   HD13  LEU   4          3HD1      LEU   4  14.888  13.013  -2.652
   13   HD21  LEU   4          3HD2      LEU   4  14.610  11.199   0.620
   14   HD22  LEU   4          1HD2      LEU   4  16.326  11.530   0.382
   15   HD23  LEU   4          2HD2      LEU   4  15.699   9.903   0.125
   16    H    GLU   5           H        GLU   5  13.565   8.150  -2.458
   17    HA   GLU   5           HA       GLU   5  12.281   6.742  -4.467
   18    HB2  GLU   5           2HB      GLU   5  11.556   5.183  -2.703
   19    HB3  GLU   5           1HB      GLU   5  13.244   5.644  -2.522
   20    HG2  GLU   5           2HG      GLU   5  12.661   7.199  -0.760
   21    HG3  GLU   5           1HG      GLU   5  10.951   6.825  -0.971
   22    H    ASN   6           H        ASN   6  10.981   9.044  -2.211
   23    HA   ASN   6           HA       ASN   6   8.914   9.950  -1.929
   24    HB2  ASN   6           2HB      ASN   6   9.227  10.395  -4.367
   25    HB3  ASN   6           1HB      ASN   6   8.382   8.889  -4.711
   26   HD21  ASN   6          1HD2      ASN   6   7.540  11.039  -2.088
   27   HD22  ASN   6          2HD2      ASN   6   6.026  11.554  -2.740
   28    H    VAL   7           H        VAL   7   8.185   8.628  -0.283
   29    HA   VAL   7           HA       VAL   7   7.168   6.040  -0.558
   30    HB   VAL   7           HB       VAL   7   7.766   6.968   1.612
   31   HG11  VAL   7          1HG1      VAL   7   6.295   8.567   2.751
   32   HG12  VAL   7          2HG1      VAL   7   5.330   8.716   1.283
   33   HG13  VAL   7          3HG1      VAL   7   7.009   9.256   1.294
   34   HG21  VAL   7          3HG2      VAL   7   4.855   6.199   1.462
   35   HG22  VAL   7          1HG2      VAL   7   5.870   6.131   2.902
   36   HG23  VAL   7          2HG2      VAL   7   6.224   5.088   1.525
   37    H    ASP   8           H        ASP   8   5.618   9.173  -0.942
   38    HA   ASP   8           HA       ASP   8   2.940   8.390  -0.923
   39    HB2  ASP   8           2HB      ASP   8   3.733  10.747  -0.958
   40    HB3  ASP   8           1HB      ASP   8   4.195  10.539  -2.645
   41    H    ALA   9           H        ALA   9   5.250   8.503  -3.624
   42    HA   ALA   9           HA       ALA   9   3.537   7.774  -5.686
   43    HB1  ALA   9           3HB      ALA   9   5.849   8.511  -6.036
   44    HB2  ALA   9           1HB      ALA   9   5.522   6.988  -6.865
   45    HB3  ALA   9           2HB      ALA   9   6.430   6.993  -5.354
   46    H    LYS  10           H        LYS  10   5.136   5.816  -3.255
   47    HA   LYS  10           HA       LYS  10   4.454   3.291  -4.386
   48    HB2  LYS  10           2HB      LYS  10   5.043   3.905  -1.485
   49    HB3  LYS  10           1HB      LYS  10   5.198   2.353  -2.296
   50    HG2  LYS  10           2HG      LYS  10   6.782   4.575  -3.416
   51    HG3  LYS  10           1HG      LYS  10   7.261   3.990  -1.823
   52    HD2  LYS  10           2HD      LYS  10   8.494   2.804  -3.532
   53    HD3  LYS  10           1HD      LYS  10   7.376   1.698  -2.734
   54    HE2  LYS  10           2HE      LYS  10   5.849   1.825  -4.569
   55    HE3  LYS  10           1HE      LYS  10   6.806   3.087  -5.343
   56    HZ1  LYS  10           3HZ      LYS  10   8.596   1.516  -5.655
   57    HZ2  LYS  10           1HZ      LYS  10   7.176   0.899  -6.336
   58    HZ3  LYS  10           2HZ      LYS  10   7.729   0.307  -4.852
   59    H    ILE  11           H        ILE  11   3.019   5.411  -1.957
   60    HA   ILE  11           HA       ILE  11   0.946   3.710  -1.132
   61    HB   ILE  11           HB       ILE  11   0.942   6.731  -1.243
   62   HG12  ILE  11          2HG1      ILE  11   1.661   4.837   1.012
   63   HG13  ILE  11          1HG1      ILE  11   2.810   5.781   0.072
   64   HG21  ILE  11          1HG2      ILE  11  -0.624   5.577   0.867
   65   HG22  ILE  11          2HG2      ILE  11  -1.134   4.912  -0.687
   66   HG23  ILE  11          3HG2      ILE  11  -1.129   6.662  -0.429
   67   HD11  ILE  11          3HD1      ILE  11   2.428   6.839   2.192
   68   HD12  ILE  11          1HD1      ILE  11   0.687   6.852   1.913
   69   HD13  ILE  11          2HD1      ILE  11   1.748   7.841   0.910
   70    H    ALA  12           H        ALA  12   0.823   6.436  -3.436
   71    HA   ALA  12           HA       ALA  12  -1.742   6.053  -4.390
   72    HB1  ALA  12           3HB      ALA  12  -0.367   7.998  -4.973
   73    HB2  ALA  12           1HB      ALA  12  -1.026   7.226  -6.415
   74    HB3  ALA  12           2HB      ALA  12   0.663   6.973  -5.973
   75    H    LYS  13           H        LYS  13   1.277   4.499  -5.324
   76    HA   LYS  13           HA       LYS  13   0.440   3.036  -7.524
   77    HB2  LYS  13           2HB      LYS  13   2.783   3.179  -6.661
   78    HB3  LYS  13           1HB      LYS  13   2.331   2.080  -5.367
   79    HG2  LYS  13           2HG      LYS  13   3.471   0.884  -7.132
   80    HG3  LYS  13           1HG      LYS  13   1.791   0.357  -7.015
   81    HD2  LYS  13           2HD      LYS  13   1.184   1.475  -8.977
   82    HD3  LYS  13           1HD      LYS  13   2.618   2.504  -8.937
   83    HE2  LYS  13           2HE      LYS  13   4.022   0.592  -9.416
   84    HE3  LYS  13           1HE      LYS  13   2.613  -0.466  -9.429
   85    HZ1  LYS  13           3HZ      LYS  13   3.270   0.128 -11.668
   86    HZ2  LYS  13           1HZ      LYS  13   3.123   1.776 -11.310
   87    HZ3  LYS  13           2HZ      LYS  13   1.751   0.786 -11.317
   88    H    LEU  14           H        LEU  14   0.085   2.429  -4.082
   89    HA   LEU  14           HA       LEU  14  -1.196  -0.118  -4.424
   90    HG   LEU  14           HG       LEU  14  -0.912  -1.390  -2.778
   91    HB2  LEU  14           2HB      LEU  14  -0.044   1.340  -2.303
   92    HB3  LEU  14           1HB      LEU  14  -1.726   1.100  -1.872
   93   HD11  LEU  14          1HD1      LEU  14   1.253  -0.202  -1.058
   94   HD12  LEU  14          2HD1      LEU  14   1.412  -0.650  -2.756
   95   HD13  LEU  14          3HD1      LEU  14   1.118  -1.893  -1.541
   96   HD21  LEU  14          3HD2      LEU  14  -0.994  -0.389   0.063
   97   HD22  LEU  14          1HD2      LEU  14  -1.148  -2.064  -0.465
   98   HD23  LEU  14          2HD2      LEU  14  -2.396  -0.889  -0.882
   99    H    MET  15           H        MET  15  -2.167   3.208  -4.218
  100    HA   MET  15           HA       MET  15  -4.898   2.775  -3.553
  101    HB2  MET  15           2HB      MET  15  -3.529   5.107  -4.906
  102    HB3  MET  15           1HB      MET  15  -5.207   5.113  -4.382
  103    HG2  MET  15           2HG      MET  15  -2.785   4.821  -2.621
  104    HG3  MET  15           1HG      MET  15  -3.810   6.246  -2.772
  105    HE1  MET  15           3HE      MET  15  -7.189   4.952  -1.244
  106    HE2  MET  15           1HE      MET  15  -6.706   4.923  -2.940
  107    HE3  MET  15           2HE      MET  15  -6.349   6.336  -1.946
  108    H    GLY  16           H        GLY  16  -3.075   2.403  -6.420
  109    HA2  GLY  16           2HA      GLY  16  -4.754   2.925  -8.503
  110    HA3  GLY  16           1HA      GLY  16  -3.707   1.513  -8.451
  111    H    GLU  17           H        GLU  17  -4.705  -0.181  -6.771
  112    HA   GLU  17           HA       GLU  17  -6.951  -1.271  -8.027
  113    HB2  GLU  17           2HB      GLU  17  -5.666  -1.820  -5.360
  114    HB3  GLU  17           1HB      GLU  17  -7.061  -2.732  -5.931
  115    HG2  GLU  17           2HG      GLU  17  -5.876  -3.681  -7.694
  116    HG3  GLU  17           1HG      GLU  17  -4.592  -2.465  -7.600
  117    H    GLY  18           H        GLY  18  -6.645   0.769  -5.178
  118    HA2  GLY  18           2HA      GLY  18  -8.278   2.252  -4.392
  119    HA3  GLY  18           1HA      GLY  18  -9.482   1.407  -5.353
  120    H    TYR  19           H        TYR  19  -7.976   1.706  -2.288
  121    HA   TYR  19           HA       TYR  19 -10.007   0.047  -1.079
  122    HD1  TYR  19           1HD      TYR  19  -9.119  -1.694   1.612
  123    HD2  TYR  19           2HD      TYR  19  -8.947  -2.912  -2.460
  124    HE1  TYR  19           1HE      TYR  19 -10.440  -3.692   2.161
  125    HE2  TYR  19           2HE      TYR  19 -10.269  -4.915  -1.923
  126    HH   TYR  19           HH       TYR  19 -11.914  -5.297   1.016
  127    HB2  TYR  19           2HB      TYR  19  -7.557  -1.145  -1.692
  128    HB3  TYR  19           1HB      TYR  19  -7.439  -0.754   0.020
  129    H    ALA  20           H        ALA  20  -9.345  -0.088   1.452
  130    HA   ALA  20           HA       ALA  20  -9.586   2.490   2.462
  131    HB1  ALA  20           3HB      ALA  20 -10.043   0.222   3.601
  132    HB2  ALA  20           1HB      ALA  20  -9.455   1.557   4.594
  133    HB3  ALA  20           2HB      ALA  20  -8.344   0.288   4.075
  134    H    PHE  21           H        PHE  21  -8.157   3.924   3.445
  135    HA   PHE  21           HA       PHE  21  -5.499   3.912   2.364
  136    HD1  PHE  21           2HD      PHE  21  -8.909   5.905   3.488
  137    HD2  PHE  21           1HD      PHE  21  -5.473   6.182   5.982
  138    HE1  PHE  21           2HE      PHE  21 -10.341   6.546   5.382
  139    HE2  PHE  21           1HE      PHE  21  -6.900   6.826   7.881
  140    HZ   PHE  21           HZ       PHE  21  -9.337   7.008   7.582
  141    HB2  PHE  21           2HB      PHE  21  -5.249   6.057   3.605
  142    HB3  PHE  21           1HB      PHE  21  -6.656   6.028   2.550
  143    H    GLU  22           H        GLU  22  -7.014   3.053   5.353
  144    HA   GLU  22           HA       GLU  22  -4.710   3.115   7.005
  145    HB2  GLU  22           2HB      GLU  22  -7.215   1.441   7.277
  146    HB3  GLU  22           1HB      GLU  22  -6.021   1.707   8.539
  147    HG2  GLU  22           2HG      GLU  22  -6.537   4.098   8.517
  148    HG3  GLU  22           1HG      GLU  22  -7.747   3.818   7.265
  149    H    GLU  23           H        GLU  23  -6.260   0.558   5.102
  150    HA   GLU  23           HA       GLU  23  -4.501  -1.506   5.906
  151    HB2  GLU  23           2HB      GLU  23  -6.311  -1.211   3.518
  152    HB3  GLU  23           1HB      GLU  23  -5.375  -2.666   3.837
  153    HG2  GLU  23           2HG      GLU  23  -6.492  -2.739   6.092
  154    HG3  GLU  23           1HG      GLU  23  -7.576  -1.484   5.497
  155    H    VAL  24           H        VAL  24  -4.292   0.973   3.475
  156    HA   VAL  24           HA       VAL  24  -2.243  -0.258   1.916
  157    HB   VAL  24           HB       VAL  24  -3.123   2.622   2.103
  158   HG11  VAL  24          1HG1      VAL  24  -1.339   1.384   0.015
  159   HG12  VAL  24          2HG1      VAL  24  -0.763   2.383   1.343
  160   HG13  VAL  24          3HG1      VAL  24  -1.837   3.071   0.126
  161   HG21  VAL  24          3HG2      VAL  24  -3.571   0.748  -0.192
  162   HG22  VAL  24          1HG2      VAL  24  -4.433   2.231   0.213
  163   HG23  VAL  24          2HG2      VAL  24  -4.672   0.777   1.184
  164    H    LYS  25           H        LYS  25  -2.053   2.675   3.961
  165    HA   LYS  25           HA       LYS  25   0.725   2.810   4.007
  166    HB2  LYS  25           2HB      LYS  25  -1.354   3.836   5.919
  167    HB3  LYS  25           1HB      LYS  25   0.362   4.110   6.187
  168    HG2  LYS  25           2HG      LYS  25  -0.409   6.041   5.123
  169    HG3  LYS  25           1HG      LYS  25   0.419   5.120   3.875
  170    HD2  LYS  25           2HD      LYS  25  -1.649   4.368   2.948
  171    HD3  LYS  25           1HD      LYS  25  -2.555   5.017   4.316
  172    HE2  LYS  25           2HE      LYS  25  -1.931   7.282   3.669
  173    HE3  LYS  25           1HE      LYS  25  -0.990   6.647   2.322
  174    HZ1  LYS  25           3HZ      LYS  25  -3.148   7.418   1.587
  175    HZ2  LYS  25           1HZ      LYS  25  -3.926   6.372   2.666
  176    HZ3  LYS  25           2HZ      LYS  25  -3.028   5.744   1.378
  177    H    ARG  26           H        ARG  26  -1.460   0.981   6.101
  178    HA   ARG  26           HA       ARG  26   0.564   0.257   7.968
  179    HE   ARG  26           HE       ARG  26  -3.954  -3.409   6.601
  180    HB2  ARG  26           2HB      ARG  26  -1.022  -1.096   9.002
  181    HB3  ARG  26           1HB      ARG  26  -2.006   0.160   8.268
  182    HG2  ARG  26           2HG      ARG  26  -2.485  -1.356   6.388
  183    HG3  ARG  26           1HG      ARG  26  -1.575  -2.624   7.214
  184    HD2  ARG  26           2HD      ARG  26  -3.105  -2.449   9.126
  185    HD3  ARG  26           1HD      ARG  26  -4.013  -1.208   8.265
  186   HH11  ARG  26          1HH1      ARG  26  -5.134  -2.664   9.796
  187   HH12  ARG  26          2HH1      ARG  26  -6.431  -3.810   9.723
  188   HH21  ARG  26          1HH2      ARG  26  -5.661  -4.917   6.498
  189   HH22  ARG  26          2HH2      ARG  26  -6.732  -5.089   7.848
  190    H    ALA  27           H        ALA  27  -0.718  -1.221   5.026
  191    HA   ALA  27           HA       ALA  27   0.770  -3.641   5.285
  192    HB1  ALA  27           3HB      ALA  27  -1.241  -3.528   3.913
  193    HB2  ALA  27           1HB      ALA  27   0.147  -4.046   2.955
  194    HB3  ALA  27           2HB      ALA  27  -0.445  -2.390   2.824
  195    H    LEU  28           H        LEU  28   1.572  -0.469   4.341
  196    HA   LEU  28           HA       LEU  28   3.854  -1.227   2.729
  197    HG   LEU  28           HG       LEU  28   1.736   0.243   1.620
  198    HB2  LEU  28           2HB      LEU  28   2.738   1.409   3.647
  199    HB3  LEU  28           1HB      LEU  28   4.287   1.289   2.828
  200   HD11  LEU  28          1HD1      LEU  28   2.994   2.870   0.922
  201   HD12  LEU  28          2HD1      LEU  28   1.786   2.744   2.198
  202   HD13  LEU  28          3HD1      LEU  28   1.375   2.276   0.548
  203   HD21  LEU  28          3HD2      LEU  28   4.217   1.153   0.207
  204   HD22  LEU  28          1HD2      LEU  28   2.946   0.071  -0.362
  205   HD23  LEU  28          2HD2      LEU  28   4.091  -0.479   0.862
  206    H    GLU  29           H        GLU  29   3.398   0.619   5.742
  207    HA   GLU  29           HA       GLU  29   6.076   0.808   6.458
  208    HB2  GLU  29           2HB      GLU  29   3.641   0.681   8.242
  209    HB3  GLU  29           1HB      GLU  29   5.238   1.204   8.759
  210    HG2  GLU  29           2HG      GLU  29   5.153   3.079   7.232
  211    HG3  GLU  29           1HG      GLU  29   3.593   2.532   6.616
  212    H    ILE  30           H        ILE  30   3.694  -1.686   7.289
  213    HA   ILE  30           HA       ILE  30   5.372  -3.172   9.010
  214    HB   ILE  30           HB       ILE  30   2.943  -3.996   7.426
  215   HG12  ILE  30          2HG1      ILE  30   3.308  -3.436  10.378
  216   HG13  ILE  30          1HG1      ILE  30   2.642  -2.290   9.220
  217   HG21  ILE  30          1HG2      ILE  30   3.377  -5.712   9.640
  218   HG22  ILE  30          2HG2      ILE  30   4.868  -5.654   8.700
  219   HG23  ILE  30          3HG2      ILE  30   3.354  -6.119   7.925
  220   HD11  ILE  30          3HD1      ILE  30   0.899  -3.400  10.507
  221   HD12  ILE  30          1HD1      ILE  30   1.454  -4.965   9.915
  222   HD13  ILE  30          2HD1      ILE  30   0.779  -3.787   8.790
  223    H    ALA  31           H        ALA  31   4.680  -3.463   5.541
  224    HA   ALA  31           HA       ALA  31   6.330  -5.786   5.238
  225    HB1  ALA  31           3HB      ALA  31   5.873  -5.589   2.872
  226    HB2  ALA  31           1HB      ALA  31   5.227  -3.965   3.106
  227    HB3  ALA  31           2HB      ALA  31   4.387  -5.355   3.793
  228    H    GLN  32           H        GLN  32   7.584  -3.327   6.353
  229    HA   GLN  32           HA       GLN  32   9.514  -2.134   6.204
  230    HB2  GLN  32           2HB      GLN  32  10.293  -4.497   4.489
  231    HB3  GLN  32           1HB      GLN  32  11.421  -3.315   5.137
  232    HG2  GLN  32           2HG      GLN  32  10.828  -3.962   7.402
  233    HG3  GLN  32           1HG      GLN  32   9.654  -5.118   6.775
  234   HE21  GLN  32          1HE2      GLN  32  10.377  -7.008   5.799
  235   HE22  GLN  32          2HE2      GLN  32  11.996  -7.581   5.991
  236    H    ASN  33           H        ASN  33   7.650  -1.080   4.571
  237    HA   ASN  33           HA       ASN  33   7.344   0.324   2.815
  238    HB2  ASN  33           2HB      ASN  33  10.367   0.260   2.697
  239    HB3  ASN  33           1HB      ASN  33   9.339   1.439   1.886
  240   HD21  ASN  33          1HD2      ASN  33  10.599   0.339   4.929
  241   HD22  ASN  33          2HD2      ASN  33  10.162   1.738   5.846
  242    H    ASN  34           H        ASN  34   6.603  -1.952   1.984
  243    HA   ASN  34           HA       ASN  34   7.846  -2.299  -0.655
  244    HB2  ASN  34           2HB      ASN  34   7.013  -4.460   1.265
  245    HB3  ASN  34           1HB      ASN  34   7.242  -4.762  -0.453
  246   HD21  ASN  34          1HD2      ASN  34   8.681  -5.935   1.718
  247   HD22  ASN  34          2HD2      ASN  34  10.341  -5.495   1.527
  248    H    VAL  35           H        VAL  35   6.461  -2.100  -2.277
  249    HA   VAL  35           HA       VAL  35   3.619  -1.917  -1.681
  250    HB   VAL  35           HB       VAL  35   4.161  -0.123  -3.018
  251   HG11  VAL  35          1HG1      VAL  35   6.030  -1.978  -4.454
  252   HG12  VAL  35          2HG1      VAL  35   6.403  -0.526  -3.526
  253   HG13  VAL  35          3HG1      VAL  35   5.606  -0.389  -5.092
  254   HG21  VAL  35          3HG2      VAL  35   3.467  -2.168  -5.122
  255   HG22  VAL  35          1HG2      VAL  35   3.168  -0.431  -5.180
  256   HG23  VAL  35          2HG2      VAL  35   2.299  -1.438  -4.022
  257    H    GLU  36           H        GLU  36   5.840  -3.886  -3.585
  258    HA   GLU  36           HA       GLU  36   3.986  -5.345  -5.067
  259    HB2  GLU  36           2HB      GLU  36   6.614  -6.300  -3.939
  260    HB3  GLU  36           1HB      GLU  36   5.723  -7.073  -5.240
  261    HG2  GLU  36           2HG      GLU  36   5.992  -5.032  -6.594
  262    HG3  GLU  36           1HG      GLU  36   6.959  -4.329  -5.299
  263    H    VAL  37           H        VAL  37   5.518  -6.307  -1.988
  264    HA   VAL  37           HA       VAL  37   3.924  -8.583  -1.578
  265    HB   VAL  37           HB       VAL  37   5.220  -6.857   0.539
  266   HG11  VAL  37          1HG1      VAL  37   4.328  -9.737   0.582
  267   HG12  VAL  37          2HG1      VAL  37   3.620  -8.399   1.486
  268   HG13  VAL  37          3HG1      VAL  37   5.256  -8.942   1.855
  269   HG21  VAL  37          3HG2      VAL  37   6.327  -9.200  -1.005
  270   HG22  VAL  37          1HG2      VAL  37   7.111  -8.423   0.370
  271   HG23  VAL  37          2HG2      VAL  37   6.854  -7.521  -1.122
  272    H    ALA  38           H        ALA  38   3.576  -5.240  -0.458
  273    HA   ALA  38           HA       ALA  38   1.300  -5.601   1.134
  274    HB1  ALA  38           3HB      ALA  38   2.377  -3.574   1.449
  275    HB2  ALA  38           1HB      ALA  38   0.941  -3.104   0.540
  276    HB3  ALA  38           2HB      ALA  38   2.495  -3.254  -0.281
  277    H    ARG  39           H        ARG  39   1.707  -5.281  -2.312
  278    HA   ARG  39           HA       ARG  39  -1.000  -4.682  -2.940
  279    HE   ARG  39           HE       ARG  39  -0.502  -4.507  -7.149
  280    HB2  ARG  39           2HB      ARG  39   1.407  -5.540  -4.484
  281    HB3  ARG  39           1HB      ARG  39  -0.173  -5.727  -5.236
  282    HG2  ARG  39           2HG      ARG  39  -0.607  -3.358  -4.972
  283    HG3  ARG  39           1HG      ARG  39   0.933  -3.153  -4.136
  284    HD2  ARG  39           2HD      ARG  39   1.145  -2.466  -6.445
  285    HD3  ARG  39           1HD      ARG  39   2.111  -3.909  -6.142
  286   HH11  ARG  39          1HH1      ARG  39   2.740  -3.590  -8.044
  287   HH12  ARG  39          2HH1      ARG  39   2.627  -4.259  -9.637
  288   HH21  ARG  39          1HH2      ARG  39  -0.659  -5.391  -9.243
  289   HH22  ARG  39          2HH2      ARG  39   0.693  -5.283 -10.319
  290    H    SER  40           H        SER  40   0.891  -7.698  -3.046
  291    HA   SER  40           HA       SER  40  -1.157  -9.384  -3.906
  292    HG   SER  40           HG       SER  40   1.865 -10.829  -1.613
  293    HB2  SER  40           2HB      SER  40   0.171 -11.221  -2.951
  294    HB3  SER  40           1HB      SER  40   1.205 -10.080  -3.811
  295    H    ILE  41           H        ILE  41  -0.394  -8.119  -0.738
  296    HA   ILE  41           HA       ILE  41  -2.372  -9.778   0.586
  297    HB   ILE  41           HB       ILE  41  -0.809  -7.450   1.712
  298   HG12  ILE  41          2HG1      ILE  41  -0.175 -10.403   1.898
  299   HG13  ILE  41          1HG1      ILE  41   0.626  -9.289   0.795
  300   HG21  ILE  41          1HG2      ILE  41  -2.768  -8.014   3.026
  301   HG22  ILE  41          2HG2      ILE  41  -1.304  -8.501   3.880
  302   HG23  ILE  41          3HG2      ILE  41  -2.286  -9.711   3.054
  303   HD11  ILE  41          3HD1      ILE  41   1.985  -9.678   2.752
  304   HD12  ILE  41          1HD1      ILE  41   0.667  -9.156   3.801
  305   HD13  ILE  41          2HD1      ILE  41   1.440  -8.001   2.716
  306    H    LEU  42           H        LEU  42  -2.163  -6.653  -0.868
  307    HA   LEU  42           HA       LEU  42  -4.258  -5.342   0.486
  308    HG   LEU  42           HG       LEU  42  -3.581  -2.444  -1.674
  309    HB2  LEU  42           2HB      LEU  42  -2.445  -4.459  -1.179
  310    HB3  LEU  42           1HB      LEU  42  -3.630  -4.848  -2.405
  311   HD11  LEU  42          1HD1      LEU  42  -5.968  -2.183  -1.702
  312   HD12  LEU  42          2HD1      LEU  42  -6.201  -3.854  -1.193
  313   HD13  LEU  42          3HD1      LEU  42  -5.527  -3.503  -2.784
  314   HD21  LEU  42          3HD2      LEU  42  -4.803  -3.558   0.850
  315   HD22  LEU  42          1HD2      LEU  42  -4.644  -1.853   0.432
  316   HD23  LEU  42          2HD2      LEU  42  -3.203  -2.829   0.713
  317    H    ARG  43           H        ARG  43  -4.196  -7.409  -2.377
  318    HA   ARG  43           HA       ARG  43  -7.078  -7.159  -2.716
  319    HE   ARG  43           HE       ARG  43  -9.141  -8.907  -6.624
  320    HB2  ARG  43           2HB      ARG  43  -5.599  -7.163  -4.692
  321    HB3  ARG  43           1HB      ARG  43  -5.071  -8.792  -4.287
  322    HG2  ARG  43           2HG      ARG  43  -6.668  -9.317  -5.802
  323    HG3  ARG  43           1HG      ARG  43  -7.705  -9.203  -4.377
  324    HD2  ARG  43           2HD      ARG  43  -8.020  -6.787  -4.956
  325    HD3  ARG  43           1HD      ARG  43  -7.253  -7.128  -6.493
  326   HH11  ARG  43          1HH1      ARG  43  -9.389  -5.701  -5.283
  327   HH12  ARG  43          2HH1      ARG  43 -11.071  -5.535  -5.658
  328   HH21  ARG  43          1HH2      ARG  43 -11.357  -8.696  -7.124
  329   HH22  ARG  43          2HH2      ARG  43 -12.190  -7.236  -6.703
  330    H    GLU  44           H        GLU  44  -4.764  -9.292  -1.306
  331    HA   GLU  44           HA       GLU  44  -6.122 -11.727  -1.378
  332    HB2  GLU  44           2HB      GLU  44  -3.788 -11.471  -0.629
  333    HB3  GLU  44           1HB      GLU  44  -4.348 -10.653   0.823
  334    HG2  GLU  44           2HG      GLU  44  -5.512 -12.676   1.524
  335    HG3  GLU  44           1HG      GLU  44  -4.970 -13.498   0.062
  336    H    PHE  45           H        PHE  45  -6.474  -8.972   0.792
  337    HA   PHE  45           HA       PHE  45  -8.263 -10.317   2.579
  338    HD1  PHE  45           2HD      PHE  45  -7.355  -9.335   5.257
  339    HD2  PHE  45           1HD      PHE  45 -10.173  -6.921   3.174
  340    HE1  PHE  45           2HE      PHE  45  -8.725  -9.182   7.295
  341    HE2  PHE  45           1HE      PHE  45 -11.547  -6.762   5.209
  342    HZ   PHE  45           HZ       PHE  45 -10.824  -7.895   7.272
  343    HB2  PHE  45           2HB      PHE  45  -6.799  -8.306   3.137
  344    HB3  PHE  45           1HB      PHE  45  -7.975  -7.330   2.264
  345    H    ALA  46           H        ALA  46  -9.768 -11.178   1.023
  346    HA   ALA  46           HA       ALA  46 -11.660  -9.174  -0.017
  347    HB1  ALA  46           3HB      ALA  46 -12.315 -10.802  -1.693
  348    HB2  ALA  46           1HB      ALA  46 -11.215 -11.993  -0.997
  349    HB3  ALA  46           2HB      ALA  46 -10.574 -10.534  -1.752
  Start of MODEL    8
    1    HA   ALA   3           HA       ALA   3  12.507   3.601  -4.847
    2    HB1  ALA   3           3HB      ALA   3  10.366   3.410  -6.023
    3    HB2  ALA   3           1HB      ALA   3  10.476   4.913  -5.107
    4    HB3  ALA   3           2HB      ALA   3   9.512   3.572  -4.489
    5    H    LEU   4           H        LEU   4  13.634   4.320  -3.140
    6    HA   LEU   4           HA       LEU   4  12.657   4.282  -0.465
    7    HG   LEU   4           HG       LEU   4  14.800   3.191   0.013
    8    HB2  LEU   4           2HB      LEU   4  15.033   5.633  -1.740
    9    HB3  LEU   4           1HB      LEU   4  14.690   5.730  -0.024
   10   HD11  LEU   4          1HD1      LEU   4  14.534   2.767  -2.355
   11   HD12  LEU   4          2HD1      LEU   4  16.089   2.147  -1.803
   12   HD13  LEU   4          3HD1      LEU   4  16.014   3.660  -2.706
   13   HD21  LEU   4          3HD2      LEU   4  17.243   3.174   0.093
   14   HD22  LEU   4          1HD2      LEU   4  16.582   4.606   0.883
   15   HD23  LEU   4          2HD2      LEU   4  17.283   4.733  -0.731
   16    H    GLU   5           H        GLU   5  13.530   7.040  -2.556
   17    HA   GLU   5           HA       GLU   5  12.213   8.940  -0.908
   18    HB2  GLU   5           2HB      GLU   5  12.594  10.500  -2.803
   19    HB3  GLU   5           1HB      GLU   5  14.047   9.636  -2.316
   20    HG2  GLU   5           2HG      GLU   5  13.819   8.128  -4.191
   21    HG3  GLU   5           1HG      GLU   5  12.305   8.898  -4.656
   22    H    ASN   6           H        ASN   6  10.432  10.338  -1.634
   23    HA   ASN   6           HA       ASN   6   8.250  10.629  -2.181
   24    HB2  ASN   6           2HB      ASN   6   9.098   8.957  -4.554
   25    HB3  ASN   6           1HB      ASN   6   7.556   9.798  -4.438
   26   HD21  ASN   6          1HD2      ASN   6  10.995  10.145  -4.791
   27   HD22  ASN   6          2HD2      ASN   6  10.980  11.799  -5.292
   28    H    VAL   7           H        VAL   7   7.996   9.167  -0.213
   29    HA   VAL   7           HA       VAL   7   7.273   6.462  -0.492
   30    HB   VAL   7           HB       VAL   7   6.162   6.716   1.715
   31   HG11  VAL   7          1HG1      VAL   7   8.903   7.949   1.481
   32   HG12  VAL   7          2HG1      VAL   7   8.529   6.231   1.613
   33   HG13  VAL   7          3HG1      VAL   7   8.195   7.311   2.966
   34   HG21  VAL   7          3HG2      VAL   7   6.332   8.879   2.882
   35   HG22  VAL   7          1HG2      VAL   7   5.278   8.960   1.470
   36   HG23  VAL   7          2HG2      VAL   7   6.911   9.620   1.390
   37    H    ASP   8           H        ASP   8   5.502   9.434  -0.900
   38    HA   ASP   8           HA       ASP   8   2.874   8.463  -0.791
   39    HB2  ASP   8           2HB      ASP   8   3.966  10.692  -2.519
   40    HB3  ASP   8           1HB      ASP   8   2.275  10.455  -2.085
   41    H    ALA   9           H        ALA   9   5.266   8.477  -3.363
   42    HA   ALA   9           HA       ALA   9   3.660   7.811  -5.536
   43    HB1  ALA   9           3HB      ALA   9   5.938   8.417  -5.898
   44    HB2  ALA   9           1HB      ALA   9   5.743   6.756  -6.461
   45    HB3  ALA   9           2HB      ALA   9   6.510   7.077  -4.905
   46    H    LYS  10           H        LYS  10   5.120   5.767  -3.054
   47    HA   LYS  10           HA       LYS  10   4.322   3.289  -4.188
   48    HB2  LYS  10           2HB      LYS  10   4.801   3.822  -1.256
   49    HB3  LYS  10           1HB      LYS  10   4.992   2.303  -2.121
   50    HG2  LYS  10           2HG      LYS  10   6.648   4.572  -3.039
   51    HG3  LYS  10           1HG      LYS  10   7.041   3.876  -1.468
   52    HD2  LYS  10           2HD      LYS  10   8.340   2.804  -3.215
   53    HD3  LYS  10           1HD      LYS  10   7.204   1.655  -2.511
   54    HE2  LYS  10           2HE      LYS  10   5.744   1.843  -4.380
   55    HE3  LYS  10           1HE      LYS  10   6.665   3.193  -5.042
   56    HZ1  LYS  10           3HZ      LYS  10   7.146   1.110  -6.188
   57    HZ2  LYS  10           1HZ      LYS  10   7.676   0.416  -4.739
   58    HZ3  LYS  10           2HZ      LYS  10   8.524   1.712  -5.416
   59    H    ILE  11           H        ILE  11   2.962   5.383  -1.672
   60    HA   ILE  11           HA       ILE  11   0.777   3.816  -0.958
   61    HB   ILE  11           HB       ILE  11   0.881   6.835  -1.084
   62   HG12  ILE  11          2HG1      ILE  11   1.550   4.922   1.172
   63   HG13  ILE  11          1HG1      ILE  11   2.711   5.871   0.252
   64   HG21  ILE  11          1HG2      ILE  11  -0.768   5.383   0.902
   65   HG22  ILE  11          2HG2      ILE  11  -1.332   5.366  -0.770
   66   HG23  ILE  11          3HG2      ILE  11  -1.079   6.904   0.062
   67   HD11  ILE  11          3HD1      ILE  11   2.311   6.898   2.390
   68   HD12  ILE  11          1HD1      ILE  11   0.576   6.945   2.079
   69   HD13  ILE  11          2HD1      ILE  11   1.672   7.927   1.110
   70    H    ALA  12           H        ALA  12   0.818   6.544  -3.257
   71    HA   ALA  12           HA       ALA  12  -1.741   6.218  -4.280
   72    HB1  ALA  12           3HB      ALA  12   0.710   7.192  -5.753
   73    HB2  ALA  12           1HB      ALA  12  -0.344   8.181  -4.743
   74    HB3  ALA  12           2HB      ALA  12  -0.965   7.468  -6.232
   75    H    LYS  13           H        LYS  13   1.286   4.636  -5.104
   76    HA   LYS  13           HA       LYS  13   0.556   3.309  -7.424
   77    HB2  LYS  13           2HB      LYS  13   2.848   3.320  -6.459
   78    HB3  LYS  13           1HB      LYS  13   2.298   2.221  -5.202
   79    HG2  LYS  13           2HG      LYS  13   3.422   0.922  -6.843
   80    HG3  LYS  13           1HG      LYS  13   1.696   0.591  -6.991
   81    HD2  LYS  13           2HD      LYS  13   1.570   1.512  -9.041
   82    HD3  LYS  13           1HD      LYS  13   2.728   2.792  -8.661
   83    HE2  LYS  13           2HE      LYS  13   4.560   1.312  -8.979
   84    HE3  LYS  13           1HE      LYS  13   3.480  -0.078  -9.053
   85    HZ1  LYS  13           3HZ      LYS  13   4.258   0.584 -11.251
   86    HZ2  LYS  13           1HZ      LYS  13   3.581   2.121 -11.046
   87    HZ3  LYS  13           2HZ      LYS  13   2.581   0.759 -11.124
   88    H    LEU  14           H        LEU  14  -0.178   2.630  -4.060
   89    HA   LEU  14           HA       LEU  14  -1.505   0.130  -4.697
   90    HG   LEU  14           HG       LEU  14  -0.546  -1.165  -3.089
   91    HB2  LEU  14           2HB      LEU  14  -0.954   1.671  -2.209
   92    HB3  LEU  14           1HB      LEU  14  -2.292   0.538  -2.196
   93   HD11  LEU  14          1HD1      LEU  14   1.209   0.500  -3.512
   94   HD12  LEU  14          2HD1      LEU  14   1.727  -0.749  -2.381
   95   HD13  LEU  14          3HD1      LEU  14   1.275   0.850  -1.785
   96   HD21  LEU  14          3HD2      LEU  14  -0.439  -0.171  -0.245
   97   HD22  LEU  14          1HD2      LEU  14   0.057  -1.766  -0.808
   98   HD23  LEU  14          2HD2      LEU  14  -1.638  -1.284  -0.904
   99    H    MET  15           H        MET  15  -2.332   3.480  -4.205
  100    HA   MET  15           HA       MET  15  -5.087   3.242  -3.737
  101    HB2  MET  15           2HB      MET  15  -3.474   5.413  -5.080
  102    HB3  MET  15           1HB      MET  15  -5.197   5.558  -4.771
  103    HG2  MET  15           2HG      MET  15  -4.767   5.278  -2.365
  104    HG3  MET  15           1HG      MET  15  -3.038   5.204  -2.704
  105    HE1  MET  15           3HE      MET  15  -3.635   8.738  -0.997
  106    HE2  MET  15           1HE      MET  15  -2.795   7.194  -0.858
  107    HE3  MET  15           2HE      MET  15  -4.545   7.262  -0.673
  108    H    GLY  16           H        GLY  16  -3.190   2.854  -6.604
  109    HA2  GLY  16           2HA      GLY  16  -4.889   3.312  -8.687
  110    HA3  GLY  16           1HA      GLY  16  -3.783   1.946  -8.640
  111    H    GLU  17           H        GLU  17  -4.703   0.200  -6.971
  112    HA   GLU  17           HA       GLU  17  -6.874  -1.014  -8.215
  113    HB2  GLU  17           2HB      GLU  17  -5.582  -1.408  -5.532
  114    HB3  GLU  17           1HB      GLU  17  -6.992  -2.354  -6.003
  115    HG2  GLU  17           2HG      GLU  17  -5.853  -3.364  -7.792
  116    HG3  GLU  17           1HG      GLU  17  -4.526  -2.193  -7.703
  117    H    GLY  18           H        GLY  18  -6.741   1.071  -5.374
  118    HA2  GLY  18           2HA      GLY  18  -8.444   2.507  -4.656
  119    HA3  GLY  18           1HA      GLY  18  -9.585   1.632  -5.669
  120    H    TYR  19           H        TYR  19  -7.823   1.574  -2.627
  121    HA   TYR  19           HA       TYR  19  -9.991   0.002  -1.454
  122    HD1  TYR  19           2HD      TYR  19  -7.762  -1.696  -3.790
  123    HD2  TYR  19           1HD      TYR  19  -9.671  -2.956  -0.203
  124    HE1  TYR  19           2HE      TYR  19  -8.647  -3.667  -4.962
  125    HE2  TYR  19           1HE      TYR  19 -10.563  -4.932  -1.366
  126    HH   TYR  19           HH       TYR  19 -11.081  -5.642  -3.658
  127    HB2  TYR  19           2HB      TYR  19  -7.112  -0.789  -1.575
  128    HB3  TYR  19           1HB      TYR  19  -8.045  -1.208  -0.143
  129    H    ALA  20           H        ALA  20  -9.394  -0.227   1.062
  130    HA   ALA  20           HA       ALA  20  -9.658   2.283   2.199
  131    HB1  ALA  20           3HB      ALA  20 -10.065  -0.061   3.209
  132    HB2  ALA  20           1HB      ALA  20  -9.539   1.244   4.274
  133    HB3  ALA  20           2HB      ALA  20  -8.376   0.040   3.717
  134    H    PHE  21           H        PHE  21  -8.245   3.614   3.397
  135    HA   PHE  21           HA       PHE  21  -5.595   3.779   2.287
  136    HD1  PHE  21           2HD      PHE  21  -5.359   6.435   1.266
  137    HD2  PHE  21           1HD      PHE  21  -8.990   5.941   3.429
  138    HE1  PHE  21           2HE      PHE  21  -6.566   7.677  -0.482
  139    HE2  PHE  21           1HE      PHE  21 -10.204   7.181   1.685
  140    HZ   PHE  21           HZ       PHE  21  -8.991   8.051  -0.274
  141    HB2  PHE  21           2HB      PHE  21  -6.918   5.434   4.450
  142    HB3  PHE  21           1HB      PHE  21  -5.389   5.814   3.664
  143    H    GLU  22           H        GLU  22  -7.070   2.733   5.269
  144    HA   GLU  22           HA       GLU  22  -4.741   2.658   6.866
  145    HB2  GLU  22           2HB      GLU  22  -7.256   0.989   7.054
  146    HB3  GLU  22           1HB      GLU  22  -6.026   1.106   8.304
  147    HG2  GLU  22           2HG      GLU  22  -6.487   3.499   8.524
  148    HG3  GLU  22           1HG      GLU  22  -7.736   3.365   7.288
  149    H    GLU  23           H        GLU  23  -6.308   0.224   4.814
  150    HA   GLU  23           HA       GLU  23  -4.555  -1.892   5.446
  151    HB2  GLU  23           2HB      GLU  23  -6.307  -1.383   3.049
  152    HB3  GLU  23           1HB      GLU  23  -5.387  -2.868   3.270
  153    HG2  GLU  23           2HG      GLU  23  -6.560  -3.150   5.464
  154    HG3  GLU  23           1HG      GLU  23  -7.603  -1.807   4.997
  155    H    VAL  24           H        VAL  24  -4.331   0.753   3.182
  156    HA   VAL  24           HA       VAL  24  -2.239  -0.334   1.590
  157    HB   VAL  24           HB       VAL  24  -3.134   2.521   1.977
  158   HG11  VAL  24          1HG1      VAL  24  -1.319   1.412  -0.161
  159   HG12  VAL  24          2HG1      VAL  24  -0.780   2.371   1.216
  160   HG13  VAL  24          3HG1      VAL  24  -1.851   3.084   0.009
  161   HG21  VAL  24          3HG2      VAL  24  -3.602   0.686  -0.362
  162   HG22  VAL  24          1HG2      VAL  24  -4.340   2.256  -0.056
  163   HG23  VAL  24          2HG2      VAL  24  -4.747   0.875   0.964
  164    H    LYS  25           H        LYS  25  -2.078   2.475   3.800
  165    HA   LYS  25           HA       LYS  25   0.694   2.598   3.909
  166    HB2  LYS  25           2HB      LYS  25  -1.404   3.504   5.863
  167    HB3  LYS  25           1HB      LYS  25   0.308   3.783   6.139
  168    HG2  LYS  25           2HG      LYS  25  -0.459   5.761   5.182
  169    HG3  LYS  25           1HG      LYS  25   0.330   4.904   3.866
  170    HD2  LYS  25           2HD      LYS  25  -1.757   4.228   2.943
  171    HD3  LYS  25           1HD      LYS  25  -2.632   4.773   4.376
  172    HE2  LYS  25           2HE      LYS  25  -2.031   7.082   3.877
  173    HE3  LYS  25           1HE      LYS  25  -1.119   6.550   2.465
  174    HZ1  LYS  25           3HZ      LYS  25  -4.047   6.246   2.860
  175    HZ2  LYS  25           1HZ      LYS  25  -3.180   5.700   1.513
  176    HZ3  LYS  25           2HZ      LYS  25  -3.293   7.357   1.832
  177    H    ARG  26           H        ARG  26  -1.513   0.604   5.805
  178    HA   ARG  26           HA       ARG  26   0.462  -0.203   7.698
  179    HE   ARG  26           HE       ARG  26  -3.934  -3.844   5.934
  180    HB2  ARG  26           2HB      ARG  26  -1.136  -1.611   8.608
  181    HB3  ARG  26           1HB      ARG  26  -2.133  -0.364   7.876
  182    HG2  ARG  26           2HG      ARG  26  -2.472  -1.827   5.924
  183    HG3  ARG  26           1HG      ARG  26  -1.551  -3.091   6.742
  184    HD2  ARG  26           2HD      ARG  26  -3.170  -3.077   8.572
  185    HD3  ARG  26           1HD      ARG  26  -4.077  -1.807   7.752
  186   HH11  ARG  26          1HH1      ARG  26  -5.092  -3.524   9.204
  187   HH12  ARG  26          2HH1      ARG  26  -6.317  -4.735   9.026
  188   HH21  ARG  26          1HH2      ARG  26  -5.545  -5.438   5.688
  189   HH22  ARG  26          2HH2      ARG  26  -6.576  -5.825   7.026
  190    H    ALA  27           H        ALA  27  -0.693  -1.494   4.623
  191    HA   ALA  27           HA       ALA  27   0.796  -3.919   4.774
  192    HB1  ALA  27           3HB      ALA  27  -1.173  -3.638   3.316
  193    HB2  ALA  27           1HB      ALA  27   0.245  -4.202   2.433
  194    HB3  ALA  27           2HB      ALA  27  -0.251  -2.514   2.319
  195    H    LEU  28           H        LEU  28   1.552  -0.672   3.930
  196    HA   LEU  28           HA       LEU  28   3.972  -1.337   2.484
  197    HG   LEU  28           HG       LEU  28   1.862   0.116   1.244
  198    HB2  LEU  28           2HB      LEU  28   2.696   1.248   3.350
  199    HB3  LEU  28           1HB      LEU  28   4.302   1.196   2.645
  200   HD11  LEU  28          1HD1      LEU  28   2.148   2.272  -0.108
  201   HD12  LEU  28          2HD1      LEU  28   3.062   2.862   1.283
  202   HD13  LEU  28          3HD1      LEU  28   1.374   2.390   1.472
  203   HD21  LEU  28          3HD2      LEU  28   4.399   1.063  -0.028
  204   HD22  LEU  28          1HD2      LEU  28   3.201  -0.080  -0.636
  205   HD23  LEU  28          2HD2      LEU  28   4.304  -0.559   0.656
  206    H    GLU  29           H        GLU  29   3.036  -0.168   5.665
  207    HA   GLU  29           HA       GLU  29   5.665   0.421   6.559
  208    HB2  GLU  29           2HB      GLU  29   3.634   1.391   7.578
  209    HB3  GLU  29           1HB      GLU  29   3.192  -0.198   8.184
  210    HG2  GLU  29           2HG      GLU  29   4.190   1.138   9.934
  211    HG3  GLU  29           1HG      GLU  29   5.215  -0.244   9.550
  212    H    ILE  30           H        ILE  30   3.479  -2.320   7.198
  213    HA   ILE  30           HA       ILE  30   5.174  -3.827   8.805
  214    HB   ILE  30           HB       ILE  30   3.124  -4.847   6.837
  215   HG12  ILE  30          2HG1      ILE  30   2.889  -4.277   9.799
  216   HG13  ILE  30          1HG1      ILE  30   2.278  -3.223   8.530
  217   HG21  ILE  30          1HG2      ILE  30   3.651  -6.391   9.262
  218   HG22  ILE  30          2HG2      ILE  30   5.023  -6.309   8.159
  219   HG23  ILE  30          3HG2      ILE  30   3.472  -6.931   7.591
  220   HD11  ILE  30          3HD1      ILE  30   0.543  -4.638   9.567
  221   HD12  ILE  30          1HD1      ILE  30   1.384  -6.063   8.960
  222   HD13  ILE  30          2HD1      ILE  30   0.703  -4.893   7.829
  223    H    ALA  31           H        ALA  31   4.824  -3.857   5.272
  224    HA   ALA  31           HA       ALA  31   6.928  -5.807   4.971
  225    HB1  ALA  31           3HB      ALA  31   4.934  -5.706   3.474
  226    HB2  ALA  31           1HB      ALA  31   6.481  -5.702   2.626
  227    HB3  ALA  31           2HB      ALA  31   5.576  -4.201   2.815
  228    H    GLN  32           H        GLN  32   7.590  -3.259   6.250
  229    HA   GLN  32           HA       GLN  32   9.319  -1.791   6.322
  230    HB2  GLN  32           2HB      GLN  32  10.411  -3.232   3.902
  231    HB3  GLN  32           1HB      GLN  32  11.309  -2.236   5.039
  232    HG2  GLN  32           2HG      GLN  32  10.848  -3.864   6.812
  233    HG3  GLN  32           1HG      GLN  32   9.984  -4.868   5.650
  234   HE21  GLN  32          1HE2      GLN  32  11.839  -4.290   3.488
  235   HE22  GLN  32          2HE2      GLN  32  13.275  -5.189   3.828
  236    H    ASN  33           H        ASN  33   9.427  -2.236   2.812
  237    HA   ASN  33           HA       ASN  33   7.970   0.208   2.325
  238    HB2  ASN  33           2HB      ASN  33   9.954   1.132   0.971
  239    HB3  ASN  33           1HB      ASN  33  10.011   1.297   2.722
  240   HD21  ASN  33          1HD2      ASN  33  10.575  -1.719   1.038
  241   HD22  ASN  33          2HD2      ASN  33  12.258  -1.831   1.411
  242    H    ASN  34           H        ASN  34   7.921  -2.681   1.626
  243    HA   ASN  34           HA       ASN  34   8.344  -2.619  -1.263
  244    HB2  ASN  34           2HB      ASN  34   7.554  -4.902   0.544
  245    HB3  ASN  34           1HB      ASN  34   7.902  -5.037  -1.174
  246   HD21  ASN  34          1HD2      ASN  34   9.187  -6.317   1.110
  247   HD22  ASN  34          2HD2      ASN  34  10.857  -5.885   1.022
  248    H    VAL  35           H        VAL  35   6.744  -2.296  -2.653
  249    HA   VAL  35           HA       VAL  35   4.038  -1.994  -1.674
  250    HB   VAL  35           HB       VAL  35   4.319  -0.322  -3.181
  251   HG11  VAL  35          1HG1      VAL  35   6.212  -2.147  -4.624
  252   HG12  VAL  35          2HG1      VAL  35   6.551  -0.630  -3.790
  253   HG13  VAL  35          3HG1      VAL  35   5.670  -0.619  -5.317
  254   HG21  VAL  35          3HG2      VAL  35   3.663  -2.430  -5.225
  255   HG22  VAL  35          1HG2      VAL  35   3.177  -0.735  -5.212
  256   HG23  VAL  35          2HG2      VAL  35   2.503  -1.856  -4.030
  257    H    GLU  36           H        GLU  36   5.887  -4.321  -3.489
  258    HA   GLU  36           HA       GLU  36   3.782  -5.716  -4.713
  259    HB2  GLU  36           2HB      GLU  36   6.516  -6.581  -3.812
  260    HB3  GLU  36           1HB      GLU  36   5.412  -7.676  -4.631
  261    HG2  GLU  36           2HG      GLU  36   6.920  -6.785  -6.244
  262    HG3  GLU  36           1HG      GLU  36   5.328  -6.083  -6.527
  263    H    VAL  37           H        VAL  37   5.542  -6.565  -1.721
  264    HA   VAL  37           HA       VAL  37   3.831  -8.614  -0.905
  265    HB   VAL  37           HB       VAL  37   5.378  -6.729   0.887
  266   HG11  VAL  37          1HG1      VAL  37   3.675  -8.075   2.049
  267   HG12  VAL  37          2HG1      VAL  37   5.316  -8.514   2.520
  268   HG13  VAL  37          3HG1      VAL  37   4.415  -9.540   1.403
  269   HG21  VAL  37          3HG2      VAL  37   6.216  -9.333  -0.385
  270   HG22  VAL  37          1HG2      VAL  37   7.143  -8.441   0.821
  271   HG23  VAL  37          2HG2      VAL  37   6.844  -7.729  -0.764
  272    H    ALA  38           H        ALA  38   3.695  -5.137  -0.432
  273    HA   ALA  38           HA       ALA  38   1.566  -5.050   1.401
  274    HB1  ALA  38           3HB      ALA  38   2.802  -3.079   1.176
  275    HB2  ALA  38           1HB      ALA  38   1.264  -2.704   0.397
  276    HB3  ALA  38           2HB      ALA  38   2.679  -3.096  -0.582
  277    H    ARG  39           H        ARG  39   1.715  -5.233  -2.100
  278    HA   ARG  39           HA       ARG  39  -1.038  -4.769  -2.598
  279    HE   ARG  39           HE       ARG  39  -0.245  -5.441  -6.776
  280    HB2  ARG  39           2HB      ARG  39   1.215  -5.967  -4.186
  281    HB3  ARG  39           1HB      ARG  39  -0.435  -6.038  -4.793
  282    HG2  ARG  39           2HG      ARG  39  -0.591  -3.671  -4.887
  283    HG3  ARG  39           1HG      ARG  39   0.917  -3.476  -3.994
  284    HD2  ARG  39           2HD      ARG  39   1.253  -3.064  -6.366
  285    HD3  ARG  39           1HD      ARG  39   2.152  -4.483  -5.833
  286   HH11  ARG  39          1HH1      ARG  39   2.398  -3.573  -8.069
  287   HH12  ARG  39          2HH1      ARG  39   2.194  -4.163  -9.684
  288   HH21  ARG  39          1HH2      ARG  39  -0.519  -6.225  -8.901
  289   HH22  ARG  39          2HH2      ARG  39   0.536  -5.670 -10.157
  290    H    SER  40           H        SER  40   0.863  -7.599  -1.827
  291    HA   SER  40           HA       SER  40  -1.042  -9.568  -2.492
  292    HG   SER  40           HG       SER  40  -0.074 -11.368   0.033
  293    HB2  SER  40           2HB      SER  40   1.304 -10.135  -2.083
  294    HB3  SER  40           1HB      SER  40   1.152  -9.628  -0.400
  295    H    ILE  41           H        ILE  41  -0.348  -7.853   0.534
  296    HA   ILE  41           HA       ILE  41  -2.488  -9.136   1.962
  297    HB   ILE  41           HB       ILE  41  -1.001  -6.622   2.729
  298   HG12  ILE  41          2HG1      ILE  41  -0.358  -9.482   3.482
  299   HG13  ILE  41          1HG1      ILE  41   0.512  -8.558   2.261
  300   HG21  ILE  41          1HG2      ILE  41  -3.046  -6.990   3.990
  301   HG22  ILE  41          2HG2      ILE  41  -1.635  -7.252   5.014
  302   HG23  ILE  41          3HG2      ILE  41  -2.532  -8.631   4.377
  303   HD11  ILE  41          3HD1      ILE  41   0.322  -7.872   5.185
  304   HD12  ILE  41          1HD1      ILE  41   1.203  -6.957   3.963
  305   HD13  ILE  41          2HD1      ILE  41   1.710  -8.595   4.373
  306    H    LEU  42           H        LEU  42  -2.098  -6.280   0.037
  307    HA   LEU  42           HA       LEU  42  -4.307  -4.791   0.945
  308    HG   LEU  42           HG       LEU  42  -3.392  -2.280  -1.593
  309    HB2  LEU  42           2HB      LEU  42  -2.332  -4.107  -0.554
  310    HB3  LEU  42           1HB      LEU  42  -3.260  -4.779  -1.875
  311   HD11  LEU  42          1HD1      LEU  42  -5.032  -3.581  -2.881
  312   HD12  LEU  42          2HD1      LEU  42  -5.748  -2.166  -2.110
  313   HD13  LEU  42          3HD1      LEU  42  -6.007  -3.768  -1.422
  314   HD21  LEU  42          3HD2      LEU  42  -5.096  -3.006   0.788
  315   HD22  LEU  42          1HD2      LEU  42  -4.870  -1.391   0.116
  316   HD23  LEU  42          2HD2      LEU  42  -3.511  -2.236   0.856
  317    H    ARG  43           H        ARG  43  -3.961  -7.203  -1.627
  318    HA   ARG  43           HA       ARG  43  -6.523  -6.974  -2.729
  319    HE   ARG  43           HE       ARG  43  -8.084  -9.908  -5.820
  320    HB2  ARG  43           2HB      ARG  43  -4.628  -8.202  -3.761
  321    HB3  ARG  43           1HB      ARG  43  -4.827  -9.471  -2.558
  322    HG2  ARG  43           2HG      ARG  43  -6.095 -10.426  -4.143
  323    HG3  ARG  43           1HG      ARG  43  -7.333  -9.308  -3.567
  324    HD2  ARG  43           2HD      ARG  43  -6.493  -7.665  -5.240
  325    HD3  ARG  43           1HD      ARG  43  -5.482  -8.935  -5.902
  326   HH11  ARG  43          1HH1      ARG  43  -6.296  -7.386  -7.431
  327   HH12  ARG  43          2HH1      ARG  43  -7.304  -7.395  -8.839
  328   HH21  ARG  43          1HH2      ARG  43  -9.414  -9.926  -7.670
  329   HH22  ARG  43          2HH2      ARG  43  -9.077  -8.837  -8.975
  330    H    GLU  44           H        GLU  44  -5.411  -9.634  -0.618
  331    HA   GLU  44           HA       GLU  44  -8.103  -9.664   0.570
  332    HB2  GLU  44           2HB      GLU  44  -7.572 -12.212   0.860
  333    HB3  GLU  44           1HB      GLU  44  -8.202 -11.605  -0.665
  334    HG2  GLU  44           2HG      GLU  44  -5.902 -11.529  -1.550
  335    HG3  GLU  44           1HG      GLU  44  -5.324 -12.229  -0.039
  336    H    PHE  45           H        PHE  45  -5.217 -11.588   1.325
  337    HA   PHE  45           HA       PHE  45  -4.443 -10.087   3.590
  338    HD1  PHE  45           1HD      PHE  45  -5.588  -9.508   6.143
  339    HD2  PHE  45           2HD      PHE  45  -4.483 -13.600   5.767
  340    HE1  PHE  45           1HE      PHE  45  -4.594  -9.442   8.391
  341    HE2  PHE  45           2HE      PHE  45  -3.487 -13.542   8.016
  342    HZ   PHE  45           HZ       PHE  45  -3.542 -11.461   9.331
  343    HB2  PHE  45           2HB      PHE  45  -6.604 -10.988   4.444
  344    HB3  PHE  45           1HB      PHE  45  -5.981 -12.618   4.211
  345    H    ALA  46           H        ALA  46  -2.508 -10.793   4.424
  346    HA   ALA  46           HA       ALA  46  -1.523 -13.448   3.902
  347    HB1  ALA  46           3HB      ALA  46   0.331 -12.852   2.505
  348    HB2  ALA  46           1HB      ALA  46  -0.091 -11.142   2.592
  349    HB3  ALA  46           2HB      ALA  46  -1.148 -12.269   1.743
  Start of MODEL    9
    1    HA   ALA   3           HA       ALA   3   7.872  16.005  -2.361
    2    HB1  ALA   3           3HB      ALA   3   9.687  17.952  -3.780
    3    HB2  ALA   3           1HB      ALA   3   8.405  18.380  -2.648
    4    HB3  ALA   3           2HB      ALA   3   8.005  17.611  -4.183
    5    H    LEU   4           H        LEU   4  10.503  14.402  -2.391
    6    HA   LEU   4           HA       LEU   4  10.730  13.704  -5.202
    7    HG   LEU   4           HG       LEU   4  12.808  14.909  -3.233
    8    HB2  LEU   4           2HB      LEU   4  12.117  12.572  -2.769
    9    HB3  LEU   4           1HB      LEU   4  12.490  12.155  -4.432
   10   HD11  LEU   4          1HD1      LEU   4  14.875  12.815  -3.894
   11   HD12  LEU   4          2HD1      LEU   4  14.393  13.327  -2.276
   12   HD13  LEU   4          3HD1      LEU   4  15.207  14.461  -3.354
   13   HD21  LEU   4          3HD2      LEU   4  13.630  13.794  -5.912
   14   HD22  LEU   4          1HD2      LEU   4  14.034  15.398  -5.298
   15   HD23  LEU   4          2HD2      LEU   4  12.352  14.974  -5.622
   16    H    GLU   5           H        GLU   5  11.175  11.035  -5.204
   17    HA   GLU   5           HA       GLU   5   8.494   9.998  -4.867
   18    HB2  GLU   5           2HB      GLU   5   9.556   7.919  -5.918
   19    HB3  GLU   5           1HB      GLU   5   9.464   9.367  -6.909
   20    HG2  GLU   5           2HG      GLU   5  11.775   9.827  -6.591
   21    HG3  GLU   5           1HG      GLU   5  11.916   8.568  -5.366
   22    H    ASN   6           H        ASN   6   8.242   9.848  -2.643
   23    HA   ASN   6           HA       ASN   6   9.968   7.899  -1.271
   24    HB2  ASN   6           2HB      ASN   6   8.199  10.070  -0.125
   25    HB3  ASN   6           1HB      ASN   6   9.124   8.919   0.832
   26   HD21  ASN   6          1HD2      ASN   6   9.293  11.816   0.765
   27   HD22  ASN   6          2HD2      ASN   6  10.921  12.198   0.332
   28    H    VAL   7           H        VAL   7   8.038   7.612   0.907
   29    HA   VAL   7           HA       VAL   7   6.731   5.306   0.157
   30    HB   VAL   7           HB       VAL   7   5.286   5.626   2.150
   31   HG11  VAL   7          1HG1      VAL   7   8.218   6.213   2.531
   32   HG12  VAL   7          2HG1      VAL   7   7.469   4.623   2.402
   33   HG13  VAL   7          3HG1      VAL   7   7.122   5.649   3.793
   34   HG21  VAL   7          3HG2      VAL   7   4.979   8.041   1.999
   35   HG22  VAL   7          1HG2      VAL   7   6.691   8.291   2.343
   36   HG23  VAL   7          2HG2      VAL   7   5.637   7.592   3.572
   37    H    ASP   8           H        ASP   8   5.679   8.622  -0.212
   38    HA   ASP   8           HA       ASP   8   2.951   8.295  -0.585
   39    HB2  ASP   8           2HB      ASP   8   4.814  10.201  -2.018
   40    HB3  ASP   8           1HB      ASP   8   3.060  10.350  -1.959
   41    H    ALA   9           H        ALA   9   5.504   8.174  -3.086
   42    HA   ALA   9           HA       ALA   9   3.881   7.622  -5.270
   43    HB1  ALA   9           3HB      ALA   9   6.304   8.142  -5.391
   44    HB2  ALA   9           1HB      ALA   9   5.845   6.742  -6.359
   45    HB3  ALA   9           2HB      ALA   9   6.648   6.514  -4.807
   46    H    LYS  10           H        LYS  10   5.070   5.522  -2.743
   47    HA   LYS  10           HA       LYS  10   4.271   3.072  -3.960
   48    HB2  LYS  10           2HB      LYS  10   4.641   3.631  -1.011
   49    HB3  LYS  10           1HB      LYS  10   4.720   2.069  -1.812
   50    HG2  LYS  10           2HG      LYS  10   6.608   4.123  -2.770
   51    HG3  LYS  10           1HG      LYS  10   6.879   3.500  -1.142
   52    HD2  LYS  10           2HD      LYS  10   8.144   2.198  -2.739
   53    HD3  LYS  10           1HD      LYS  10   6.861   1.207  -2.047
   54    HE2  LYS  10           2HE      LYS  10   7.116   0.903  -4.482
   55    HE3  LYS  10           1HE      LYS  10   5.519   1.482  -4.016
   56    HZ1  LYS  10           3HZ      LYS  10   7.722   3.162  -5.086
   57    HZ2  LYS  10           1HZ      LYS  10   6.186   3.718  -4.642
   58    HZ3  LYS  10           2HZ      LYS  10   6.359   2.659  -5.950
   59    H    ILE  11           H        ILE  11   2.829   5.306  -1.643
   60    HA   ILE  11           HA       ILE  11   0.548   3.821  -1.004
   61    HB   ILE  11           HB       ILE  11   0.860   6.827  -1.144
   62   HG12  ILE  11          2HG1      ILE  11   1.118   4.884   1.168
   63   HG13  ILE  11          1HG1      ILE  11   2.445   5.725   0.381
   64   HG21  ILE  11          1HG2      ILE  11  -1.071   5.798   0.756
   65   HG22  ILE  11          2HG2      ILE  11  -1.471   5.330  -0.898
   66   HG23  ILE  11          3HG2      ILE  11  -1.263   7.036  -0.486
   67   HD11  ILE  11          3HD1      ILE  11   1.783   6.723   2.534
   68   HD12  ILE  11          1HD1      ILE  11   0.201   7.086   1.848
   69   HD13  ILE  11          2HD1      ILE  11   1.645   7.842   1.178
   70    H    ALA  12           H        ALA  12   0.839   6.519  -3.325
   71    HA   ALA  12           HA       ALA  12  -1.655   6.313  -4.495
   72    HB1  ALA  12           3HB      ALA  12  -0.684   7.423  -6.450
   73    HB2  ALA  12           1HB      ALA  12   0.936   7.065  -5.853
   74    HB3  ALA  12           2HB      ALA  12  -0.114   8.158  -4.951
   75    H    LYS  13           H        LYS  13   1.305   4.518  -5.156
   76    HA   LYS  13           HA       LYS  13   0.566   3.135  -7.439
   77    HB2  LYS  13           2HB      LYS  13   2.816   3.039  -6.392
   78    HB3  LYS  13           1HB      LYS  13   2.153   2.034  -5.113
   79    HG2  LYS  13           2HG      LYS  13   3.323   0.689  -6.765
   80    HG3  LYS  13           1HG      LYS  13   1.602   0.302  -6.734
   81    HD2  LYS  13           2HD      LYS  13   1.204   1.419  -8.761
   82    HD3  LYS  13           1HD      LYS  13   2.742   2.282  -8.680
   83    HE2  LYS  13           2HE      LYS  13   2.822   0.495 -10.336
   84    HE3  LYS  13           1HE      LYS  13   3.942   0.205  -9.006
   85    HZ1  LYS  13           3HZ      LYS  13   2.320  -1.316  -8.036
   86    HZ2  LYS  13           1HZ      LYS  13   2.772  -1.811  -9.589
   87    HZ3  LYS  13           2HZ      LYS  13   1.277  -1.060  -9.343
   88    H    LEU  14           H        LEU  14  -0.214   2.510  -4.050
   89    HA   LEU  14           HA       LEU  14  -1.704   0.114  -4.707
   90    HG   LEU  14           HG       LEU  14  -0.770  -1.274  -3.096
   91    HB2  LEU  14           2HB      LEU  14  -1.045   1.581  -2.193
   92    HB3  LEU  14           1HB      LEU  14  -2.405   0.474  -2.191
   93   HD11  LEU  14          1HD1      LEU  14   1.003   0.293  -3.728
   94   HD12  LEU  14          2HD1      LEU  14   1.572  -0.926  -2.587
   95   HD13  LEU  14          3HD1      LEU  14   1.226   0.711  -2.029
   96   HD21  LEU  14          3HD2      LEU  14  -0.367  -0.210  -0.307
   97   HD22  LEU  14          1HD2      LEU  14  -0.009  -1.844  -0.865
   98   HD23  LEU  14          2HD2      LEU  14  -1.677  -1.273  -0.823
   99    H    MET  15           H        MET  15  -2.316   3.493  -4.257
  100    HA   MET  15           HA       MET  15  -5.077   3.380  -3.682
  101    HB2  MET  15           2HB      MET  15  -3.430   5.522  -5.039
  102    HB3  MET  15           1HB      MET  15  -5.108   5.729  -4.557
  103    HG2  MET  15           2HG      MET  15  -2.816   5.124  -2.704
  104    HG3  MET  15           1HG      MET  15  -3.556   6.704  -2.945
  105    HE1  MET  15           3HE      MET  15  -5.966   7.370  -2.099
  106    HE2  MET  15           1HE      MET  15  -7.127   6.203  -1.468
  107    HE3  MET  15           2HE      MET  15  -6.608   6.109  -3.151
  108    H    GLY  16           H        GLY  16  -3.252   2.956  -6.586
  109    HA2  GLY  16           2HA      GLY  16  -5.025   3.561  -8.600
  110    HA3  GLY  16           1HA      GLY  16  -3.914   2.197  -8.655
  111    H    GLU  17           H        GLU  17  -4.763   0.394  -7.006
  112    HA   GLU  17           HA       GLU  17  -6.960  -0.804  -8.212
  113    HB2  GLU  17           2HB      GLU  17  -5.614  -1.256  -5.560
  114    HB3  GLU  17           1HB      GLU  17  -7.006  -2.216  -6.056
  115    HG2  GLU  17           2HG      GLU  17  -5.859  -3.154  -7.868
  116    HG3  GLU  17           1HG      GLU  17  -4.568  -1.944  -7.779
  117    H    GLY  18           H        GLY  18  -6.761   1.333  -5.442
  118    HA2  GLY  18           2HA      GLY  18  -8.430   2.672  -4.552
  119    HA3  GLY  18           1HA      GLY  18  -9.589   1.896  -5.623
  120    H    TYR  19           H        TYR  19  -7.883   1.642  -2.569
  121    HA   TYR  19           HA       TYR  19 -10.082   0.040  -1.516
  122    HD1  TYR  19           1HD      TYR  19  -8.431  -1.909  -3.886
  123    HD2  TYR  19           2HD      TYR  19  -9.663  -2.838   0.079
  124    HE1  TYR  19           1HE      TYR  19  -9.620  -3.891  -4.726
  125    HE2  TYR  19           2HE      TYR  19 -10.853  -4.823  -0.750
  126    HH   TYR  19           HH       TYR  19 -10.402  -6.075  -3.852
  127    HB2  TYR  19           2HB      TYR  19  -7.322  -0.909  -1.902
  128    HB3  TYR  19           1HB      TYR  19  -7.975  -1.194  -0.293
  129    H    ALA  20           H        ALA  20  -9.403  -0.410   0.984
  130    HA   ALA  20           HA       ALA  20  -9.658   1.993   2.323
  131    HB1  ALA  20           3HB      ALA  20  -9.010  -0.773   3.071
  132    HB2  ALA  20           1HB      ALA  20 -10.174   0.350   3.773
  133    HB3  ALA  20           2HB      ALA  20  -8.467   0.454   4.217
  134    H    PHE  21           H        PHE  21  -8.272   3.419   3.312
  135    HA   PHE  21           HA       PHE  21  -5.620   3.581   2.229
  136    HD1  PHE  21           1HD      PHE  21  -5.714   5.447   6.041
  137    HD2  PHE  21           2HD      PHE  21  -9.087   5.469   3.445
  138    HE1  PHE  21           1HE      PHE  21  -7.186   5.871   7.965
  139    HE2  PHE  21           2HE      PHE  21 -10.566   5.894   5.366
  140    HZ   PHE  21           HZ       PHE  21  -9.616   6.095   7.629
  141    HB2  PHE  21           2HB      PHE  21  -5.448   5.632   3.644
  142    HB3  PHE  21           1HB      PHE  21  -6.842   5.636   2.572
  143    H    GLU  22           H        GLU  22  -7.097   2.584   5.218
  144    HA   GLU  22           HA       GLU  22  -4.824   2.563   6.865
  145    HB2  GLU  22           2HB      GLU  22  -7.130   2.331   7.708
  146    HB3  GLU  22           1HB      GLU  22  -7.242   0.746   6.955
  147    HG2  GLU  22           2HG      GLU  22  -5.416  -0.046   8.394
  148    HG3  GLU  22           1HG      GLU  22  -5.366   1.536   9.169
  149    H    GLU  23           H        GLU  23  -6.240   0.058   4.792
  150    HA   GLU  23           HA       GLU  23  -4.425  -1.990   5.423
  151    HB2  GLU  23           2HB      GLU  23  -6.113  -1.489   2.979
  152    HB3  GLU  23           1HB      GLU  23  -5.150  -2.946   3.198
  153    HG2  GLU  23           2HG      GLU  23  -6.379  -3.335   5.333
  154    HG3  GLU  23           1HG      GLU  23  -7.438  -1.994   4.896
  155    H    VAL  24           H        VAL  24  -4.318   0.569   3.007
  156    HA   VAL  24           HA       VAL  24  -2.098  -0.384   1.553
  157    HB   VAL  24           HB       VAL  24  -3.120   2.436   1.889
  158   HG11  VAL  24          1HG1      VAL  24  -1.244   1.351  -0.206
  159   HG12  VAL  24          2HG1      VAL  24  -0.767   2.369   1.145
  160   HG13  VAL  24          3HG1      VAL  24  -1.850   3.001  -0.092
  161   HG21  VAL  24          3HG2      VAL  24  -3.528   0.491  -0.380
  162   HG22  VAL  24          1HG2      VAL  24  -4.260   2.085  -0.197
  163   HG23  VAL  24          2HG2      VAL  24  -4.699   0.780   0.906
  164    H    LYS  25           H        LYS  25  -2.107   2.492   3.668
  165    HA   LYS  25           HA       LYS  25   0.627   2.785   3.864
  166    HB2  LYS  25           2HB      LYS  25  -1.576   3.534   5.765
  167    HB3  LYS  25           1HB      LYS  25   0.105   3.917   6.106
  168    HG2  LYS  25           2HG      LYS  25  -0.781   5.849   5.143
  169    HG3  LYS  25           1HG      LYS  25   0.149   5.079   3.866
  170    HD2  LYS  25           2HD      LYS  25  -1.811   4.277   2.798
  171    HD3  LYS  25           1HD      LYS  25  -2.814   4.683   4.192
  172    HE2  LYS  25           2HE      LYS  25  -2.441   7.047   3.805
  173    HE3  LYS  25           1HE      LYS  25  -1.356   6.679   2.466
  174    HZ1  LYS  25           3HZ      LYS  25  -4.254   6.045   2.575
  175    HZ2  LYS  25           1HZ      LYS  25  -3.216   5.668   1.292
  176    HZ3  LYS  25           2HZ      LYS  25  -3.545   7.284   1.669
  177    H    ARG  26           H        ARG  26  -1.482   0.848   5.980
  178    HA   ARG  26           HA       ARG  26   0.531   0.134   7.815
  179    HE   ARG  26           HE       ARG  26  -2.239  -2.874   9.407
  180    HB2  ARG  26           2HB      ARG  26  -0.986  -1.372   8.737
  181    HB3  ARG  26           1HB      ARG  26  -2.030  -0.160   8.010
  182    HG2  ARG  26           2HG      ARG  26  -2.236  -1.661   6.020
  183    HG3  ARG  26           1HG      ARG  26  -1.389  -2.898   6.951
  184    HD2  ARG  26           2HD      ARG  26  -3.972  -1.551   7.707
  185    HD3  ARG  26           1HD      ARG  26  -3.809  -3.188   7.076
  186   HH11  ARG  26          1HH1      ARG  26  -5.547  -3.196   8.360
  187   HH12  ARG  26          2HH1      ARG  26  -6.084  -3.904   9.847
  188   HH21  ARG  26          1HH2      ARG  26  -2.938  -3.810  11.367
  189   HH22  ARG  26          2HH2      ARG  26  -4.601  -4.254  11.555
  190    H    ALA  27           H        ALA  27  -0.464  -1.268   4.747
  191    HA   ALA  27           HA       ALA  27   1.151  -3.618   5.019
  192    HB1  ALA  27           3HB      ALA  27  -0.856  -3.554   3.600
  193    HB2  ALA  27           1HB      ALA  27   0.578  -4.053   2.703
  194    HB3  ALA  27           2HB      ALA  27  -0.046  -2.413   2.527
  195    H    LEU  28           H        LEU  28   1.723  -0.375   4.045
  196    HA   LEU  28           HA       LEU  28   4.112  -0.984   2.527
  197    HG   LEU  28           HG       LEU  28   1.933   0.303   1.283
  198    HB2  LEU  28           2HB      LEU  28   2.739   1.568   3.332
  199    HB3  LEU  28           1HB      LEU  28   4.332   1.569   2.593
  200   HD11  LEU  28          1HD1      LEU  28   1.976   2.399  -0.125
  201   HD12  LEU  28          2HD1      LEU  28   2.996   3.110   1.129
  202   HD13  LEU  28          3HD1      LEU  28   1.358   2.586   1.516
  203   HD21  LEU  28          3HD2      LEU  28   4.415   1.355  -0.027
  204   HD22  LEU  28          1HD2      LEU  28   3.250   0.179  -0.636
  205   HD23  LEU  28          2HD2      LEU  28   4.369  -0.269   0.654
  206    H    GLU  29           H        GLU  29   3.299   0.478   5.655
  207    HA   GLU  29           HA       GLU  29   5.976   1.072   6.371
  208    HB2  GLU  29           2HB      GLU  29   5.069   1.401   8.652
  209    HB3  GLU  29           1HB      GLU  29   4.156   2.263   7.420
  210    HG2  GLU  29           2HG      GLU  29   2.474   0.463   7.451
  211    HG3  GLU  29           1HG      GLU  29   3.373  -0.323   8.747
  212    H    ILE  30           H        ILE  30   3.805  -1.620   7.200
  213    HA   ILE  30           HA       ILE  30   5.537  -2.958   8.951
  214    HB   ILE  30           HB       ILE  30   3.358  -4.040   7.167
  215   HG12  ILE  30          2HG1      ILE  30   3.426  -3.527  10.150
  216   HG13  ILE  30          1HG1      ILE  30   2.705  -2.441   8.967
  217   HG21  ILE  30          1HG2      ILE  30   3.849  -5.751   9.374
  218   HG22  ILE  30          2HG2      ILE  30   5.385  -5.473   8.552
  219   HG23  ILE  30          3HG2      ILE  30   4.006  -6.106   7.654
  220   HD11  ILE  30          3HD1      ILE  30   1.019  -3.790  10.075
  221   HD12  ILE  30          1HD1      ILE  30   1.826  -5.263   9.535
  222   HD13  ILE  30          2HD1      ILE  30   1.100  -4.173   8.355
  223    H    ALA  31           H        ALA  31   5.077  -3.314   5.449
  224    HA   ALA  31           HA       ALA  31   7.204  -5.257   5.268
  225    HB1  ALA  31           3HB      ALA  31   5.579  -3.912   3.113
  226    HB2  ALA  31           1HB      ALA  31   5.266  -5.495   3.825
  227    HB3  ALA  31           2HB      ALA  31   6.719  -5.234   2.859
  228    H    GLN  32           H        GLN  32   7.800  -2.534   6.236
  229    HA   GLN  32           HA       GLN  32   9.434  -0.998   6.105
  230    HB2  GLN  32           2HB      GLN  32  10.971  -2.801   5.790
  231    HB3  GLN  32           1HB      GLN  32  10.526  -2.967   4.097
  232    HG2  GLN  32           2HG      GLN  32  11.402  -0.669   3.740
  233    HG3  GLN  32           1HG      GLN  32  12.033  -0.713   5.382
  234   HE21  GLN  32          1HE2      GLN  32  11.920  -3.500   3.281
  235   HE22  GLN  32          2HE2      GLN  32  13.626  -3.651   3.063
  236    H    ASN  33           H        ASN  33   9.470  -1.943   2.674
  237    HA   ASN  33           HA       ASN  33   7.959   0.384   1.896
  238    HB2  ASN  33           2HB      ASN  33  10.300   1.236   2.314
  239    HB3  ASN  33           1HB      ASN  33  10.840   0.202   0.996
  240   HD21  ASN  33          1HD2      ASN  33   8.886   2.969   1.847
  241   HD22  ASN  33          2HD2      ASN  33   8.813   3.650   0.261
  242    H    ASN  34           H        ASN  34   7.902  -2.543   1.600
  243    HA   ASN  34           HA       ASN  34   8.314  -2.896  -1.272
  244    HB2  ASN  34           2HB      ASN  34   7.573  -4.899   0.861
  245    HB3  ASN  34           1HB      ASN  34   7.867  -5.282  -0.831
  246   HD21  ASN  34          1HD2      ASN  34   9.968  -5.160  -1.642
  247   HD22  ASN  34          2HD2      ASN  34  11.348  -5.156  -0.601
  248    H    VAL  35           H        VAL  35   6.697  -2.557  -2.619
  249    HA   VAL  35           HA       VAL  35   3.985  -2.326  -1.632
  250    HB   VAL  35           HB       VAL  35   4.262  -0.655  -3.160
  251   HG11  VAL  35          1HG1      VAL  35   6.102  -2.519  -4.611
  252   HG12  VAL  35          2HG1      VAL  35   6.457  -0.970  -3.845
  253   HG13  VAL  35          3HG1      VAL  35   5.531  -1.019  -5.345
  254   HG21  VAL  35          3HG2      VAL  35   3.469  -2.864  -5.053
  255   HG22  VAL  35          1HG2      VAL  35   3.121  -1.143  -5.222
  256   HG23  VAL  35          2HG2      VAL  35   2.377  -2.071  -3.921
  257    H    GLU  36           H        GLU  36   5.926  -4.614  -3.381
  258    HA   GLU  36           HA       GLU  36   3.956  -6.103  -4.670
  259    HB2  GLU  36           2HB      GLU  36   6.482  -7.141  -3.396
  260    HB3  GLU  36           1HB      GLU  36   5.550  -7.950  -4.646
  261    HG2  GLU  36           2HG      GLU  36   6.067  -6.196  -6.219
  262    HG3  GLU  36           1HG      GLU  36   6.913  -5.286  -4.967
  263    H    VAL  37           H        VAL  37   5.374  -6.642  -1.444
  264    HA   VAL  37           HA       VAL  37   3.632  -8.735  -0.715
  265    HB   VAL  37           HB       VAL  37   5.002  -6.783   1.145
  266   HG11  VAL  37          1HG1      VAL  37   3.244  -8.210   2.156
  267   HG12  VAL  37          2HG1      VAL  37   4.855  -8.525   2.799
  268   HG13  VAL  37          3HG1      VAL  37   4.143  -9.633   1.627
  269   HG21  VAL  37          3HG2      VAL  37   6.592  -7.781  -0.430
  270   HG22  VAL  37          1HG2      VAL  37   6.037  -9.389   0.031
  271   HG23  VAL  37          2HG2      VAL  37   6.851  -8.364   1.212
  272    H    ALA  38           H        ALA  38   3.490  -5.239  -0.321
  273    HA   ALA  38           HA       ALA  38   1.189  -5.121   1.296
  274    HB1  ALA  38           3HB      ALA  38   2.463  -3.169   1.222
  275    HB2  ALA  38           1HB      ALA  38   1.037  -2.765   0.268
  276    HB3  ALA  38           2HB      ALA  38   2.550  -3.182  -0.539
  277    H    ARG  39           H        ARG  39   1.682  -5.584  -2.104
  278    HA   ARG  39           HA       ARG  39  -0.973  -4.920  -2.929
  279    HE   ARG  39           HE       ARG  39  -0.169  -5.491  -7.063
  280    HB2  ARG  39           2HB      ARG  39   1.382  -6.245  -4.228
  281    HB3  ARG  39           1HB      ARG  39  -0.196  -6.325  -4.999
  282    HG2  ARG  39           2HG      ARG  39  -0.306  -3.928  -5.138
  283    HG3  ARG  39           1HG      ARG  39   1.189  -3.772  -4.215
  284    HD2  ARG  39           2HD      ARG  39   1.625  -3.470  -6.576
  285    HD3  ARG  39           1HD      ARG  39   2.401  -4.938  -5.985
  286   HH11  ARG  39          1HH1      ARG  39   3.123  -4.787  -7.963
  287   HH12  ARG  39          2HH1      ARG  39   3.022  -5.616  -9.481
  288   HH21  ARG  39          1HH2      ARG  39  -0.314  -6.580  -9.061
  289   HH22  ARG  39          2HH2      ARG  39   1.067  -6.636 -10.105
  290    H    SER  40           H        SER  40   0.744  -7.923  -2.176
  291    HA   SER  40           HA       SER  40  -1.278  -9.716  -2.908
  292    HG   SER  40           HG       SER  40   1.694 -10.493  -0.240
  293    HB2  SER  40           2HB      SER  40  -0.135 -11.347  -1.516
  294    HB3  SER  40           1HB      SER  40   1.066 -10.368  -2.359
  295    H    ILE  41           H        ILE  41  -0.633  -8.071   0.167
  296    HA   ILE  41           HA       ILE  41  -2.856  -9.278   1.516
  297    HB   ILE  41           HB       ILE  41  -0.933  -8.493   2.786
  298   HG12  ILE  41          2HG1      ILE  41  -2.136  -7.129   4.505
  299   HG13  ILE  41          1HG1      ILE  41  -3.479  -6.969   3.377
  300   HG21  ILE  41          1HG2      ILE  41  -1.729  -5.737   1.865
  301   HG22  ILE  41          2HG2      ILE  41  -0.271  -6.618   1.407
  302   HG23  ILE  41          3HG2      ILE  41  -0.498  -6.094   3.076
  303   HD11  ILE  41          3HD1      ILE  41  -3.906  -8.701   5.019
  304   HD12  ILE  41          1HD1      ILE  41  -2.436  -9.545   4.531
  305   HD13  ILE  41          2HD1      ILE  41  -3.781  -9.390   3.400
  306    H    LEU  42           H        LEU  42  -2.393  -6.466  -0.462
  307    HA   LEU  42           HA       LEU  42  -4.674  -4.996   0.353
  308    HG   LEU  42           HG       LEU  42  -3.586  -2.390  -1.991
  309    HB2  LEU  42           2HB      LEU  42  -2.580  -4.357  -1.125
  310    HB3  LEU  42           1HB      LEU  42  -3.619  -4.853  -2.441
  311   HD11  LEU  42          1HD1      LEU  42  -6.300  -3.629  -1.598
  312   HD12  LEU  42          2HD1      LEU  42  -5.454  -3.584  -3.143
  313   HD13  LEU  42          3HD1      LEU  42  -5.919  -2.080  -2.349
  314   HD21  LEU  42          3HD2      LEU  42  -5.106  -3.155   0.498
  315   HD22  LEU  42          1HD2      LEU  42  -4.819  -1.520  -0.094
  316   HD23  LEU  42          2HD2      LEU  42  -3.466  -2.508   0.457
  317    H    ARG  43           H        ARG  43  -4.183  -7.625  -1.901
  318    HA   ARG  43           HA       ARG  43  -6.503  -7.394  -3.440
  319    HE   ARG  43           HE       ARG  43  -2.913  -8.266  -6.314
  320    HB2  ARG  43           2HB      ARG  43  -5.067  -9.914  -2.589
  321    HB3  ARG  43           1HB      ARG  43  -6.221  -9.789  -3.910
  322    HG2  ARG  43           2HG      ARG  43  -4.034  -7.883  -4.118
  323    HG3  ARG  43           1HG      ARG  43  -3.507  -9.568  -4.140
  324    HD2  ARG  43           2HD      ARG  43  -5.003 -10.048  -5.960
  325    HD3  ARG  43           1HD      ARG  43  -5.690  -8.439  -5.865
  326   HH11  ARG  43          1HH1      ARG  43  -5.879  -9.116  -7.930
  327   HH12  ARG  43          2HH1      ARG  43  -5.289  -8.708  -9.507
  328   HH21  ARG  43          1HH2      ARG  43  -2.125  -7.728  -8.383
  329   HH22  ARG  43          2HH2      ARG  43  -3.153  -7.919  -9.764
  330    H    GLU  44           H        GLU  44  -6.059  -9.799  -0.838
  331    HA   GLU  44           HA       GLU  44  -8.879  -9.373  -0.099
  332    HB2  GLU  44           2HB      GLU  44  -7.418 -12.019  -0.196
  333    HB3  GLU  44           1HB      GLU  44  -9.063 -11.784   0.375
  334    HG2  GLU  44           2HG      GLU  44  -8.067 -11.320  -2.427
  335    HG3  GLU  44           1HG      GLU  44  -9.046 -12.678  -1.872
  336    H    PHE  45           H        PHE  45  -6.342 -11.457   1.233
  337    HA   PHE  45           HA       PHE  45  -5.853  -9.786   3.499
  338    HD1  PHE  45           2HD      PHE  45  -7.172  -8.902   5.420
  339    HD2  PHE  45           1HD      PHE  45  -6.520 -13.037   6.187
  340    HE1  PHE  45           2HE      PHE  45  -6.683  -8.384   7.776
  341    HE2  PHE  45           1HE      PHE  45  -6.030 -12.527   8.544
  342    HZ   PHE  45           HZ       PHE  45  -6.110 -10.198   9.341
  343    HB2  PHE  45           2HB      PHE  45  -8.130 -10.872   3.959
  344    HB3  PHE  45           1HB      PHE  45  -7.252 -12.391   4.106
  345    H    ALA  46           H        ALA  46  -4.770 -11.731   1.305
  346    HA   ALA  46           HA       ALA  46  -2.701 -12.905   3.034
  347    HB1  ALA  46           3HB      ALA  46  -4.218 -14.688   2.347
  348    HB2  ALA  46           1HB      ALA  46  -2.629 -14.889   1.611
  349    HB3  ALA  46           2HB      ALA  46  -3.968 -14.257   0.656
  Start of MODEL   10
    1    HA   ALA   3           HA       ALA   3  14.123  13.393  -3.706
    2    HB1  ALA   3           3HB      ALA   3  15.635  14.575  -5.208
    3    HB2  ALA   3           1HB      ALA   3  16.481  13.068  -5.558
    4    HB3  ALA   3           2HB      ALA   3  16.531  13.750  -3.933
    5    H    LEU   4           H        LEU   4  14.211  10.678  -5.710
    6    HA   LEU   4           HA       LEU   4  12.797  11.982  -7.908
    7    HG   LEU   4           HG       LEU   4  15.197   9.655  -9.556
    8    HB2  LEU   4           2HB      LEU   4  13.837   9.174  -7.544
    9    HB3  LEU   4           1HB      LEU   4  12.884   9.671  -8.928
   10   HD11  LEU   4          1HD1      LEU   4  15.507  11.944 -10.301
   11   HD12  LEU   4          2HD1      LEU   4  14.296  12.501  -9.148
   12   HD13  LEU   4          3HD1      LEU   4  13.824  11.452 -10.484
   13   HD21  LEU   4          3HD2      LEU   4  16.177   9.847  -7.325
   14   HD22  LEU   4          1HD2      LEU   4  15.687  11.541  -7.253
   15   HD23  LEU   4          2HD2      LEU   4  16.880  11.017  -8.441
   16    H    GLU   5           H        GLU   5  12.313   9.063  -5.912
   17    HA   GLU   5           HA       GLU   5   9.410   9.541  -6.102
   18    HB2  GLU   5           2HB      GLU   5   9.113   7.108  -5.844
   19    HB3  GLU   5           1HB      GLU   5  10.038   7.513  -7.283
   20    HG2  GLU   5           2HG      GLU   5  12.108   6.954  -6.110
   21    HG3  GLU   5           1HG      GLU   5  11.176   6.543  -4.670
   22    H    ASN   6           H        ASN   6   8.223   9.583  -4.265
   23    HA   ASN   6           HA       ASN   6   9.695   9.269  -1.736
   24    HB2  ASN   6           2HB      ASN   6   7.277  10.970  -2.378
   25    HB3  ASN   6           1HB      ASN   6   7.979  10.798  -0.772
   26   HD21  ASN   6          1HD2      ASN   6  10.708  10.724  -1.744
   27   HD22  ASN   6          2HD2      ASN   6  11.104  12.340  -2.209
   28    H    VAL   7           H        VAL   7   7.826   9.014   0.116
   29    HA   VAL   7           HA       VAL   7   6.965   6.349  -0.116
   30    HB   VAL   7           HB       VAL   7   5.649   6.797   1.957
   31   HG11  VAL   7          1HG1      VAL   7   8.509   7.748   1.917
   32   HG12  VAL   7          2HG1      VAL   7   7.947   6.090   2.128
   33   HG13  VAL   7          3HG1      VAL   7   7.616   7.298   3.368
   34   HG21  VAL   7          3HG2      VAL   7   5.012   9.100   1.526
   35   HG22  VAL   7          1HG2      VAL   7   6.701   9.602   1.594
   36   HG23  VAL   7          2HG2      VAL   7   5.904   8.991   3.043
   37    H    ASP   8           H        ASP   8   5.319   9.405  -0.667
   38    HA   ASP   8           HA       ASP   8   2.676   8.545  -0.781
   39    HB2  ASP   8           2HB      ASP   8   4.022  10.680  -2.452
   40    HB3  ASP   8           1HB      ASP   8   2.283  10.508  -2.224
   41    H    ALA   9           H        ALA   9   5.173   8.509  -3.288
   42    HA   ALA   9           HA       ALA   9   3.615   7.761  -5.465
   43    HB1  ALA   9           3HB      ALA   9   5.927   8.418  -5.721
   44    HB2  ALA   9           1HB      ALA   9   5.696   6.806  -6.399
   45    HB3  ALA   9           2HB      ALA   9   6.460   6.999  -4.822
   46    H    LYS  10           H        LYS  10   5.045   5.793  -2.909
   47    HA   LYS  10           HA       LYS  10   4.303   3.287  -4.038
   48    HB2  LYS  10           2HB      LYS  10   4.759   3.843  -1.109
   49    HB3  LYS  10           1HB      LYS  10   4.988   2.327  -1.965
   50    HG2  LYS  10           2HG      LYS  10   6.673   4.802  -2.137
   51    HG3  LYS  10           1HG      LYS  10   7.138   3.227  -1.520
   52    HD2  LYS  10           2HD      LYS  10   6.368   3.793  -4.374
   53    HD3  LYS  10           1HD      LYS  10   8.028   3.774  -3.776
   54    HE2  LYS  10           2HE      LYS  10   6.075   1.502  -3.926
   55    HE3  LYS  10           1HE      LYS  10   7.640   1.669  -4.709
   56    HZ1  LYS  10           3HZ      LYS  10   7.207   1.383  -1.792
   57    HZ2  LYS  10           1HZ      LYS  10   8.711   1.544  -2.551
   58    HZ3  LYS  10           2HZ      LYS  10   7.766   0.168  -2.828
   59    H    ILE  11           H        ILE  11   2.837   5.486  -1.699
   60    HA   ILE  11           HA       ILE  11   0.700   3.855  -0.913
   61    HB   ILE  11           HB       ILE  11   0.723   6.869  -1.139
   62   HG12  ILE  11          2HG1      ILE  11   1.435   5.043   1.173
   63   HG13  ILE  11          1HG1      ILE  11   2.567   6.011   0.239
   64   HG21  ILE  11          1HG2      ILE  11  -0.885   5.624   0.954
   65   HG22  ILE  11          2HG2      ILE  11  -1.404   5.186  -0.676
   66   HG23  ILE  11          3HG2      ILE  11  -1.313   6.886  -0.204
   67   HD11  ILE  11          3HD1      ILE  11   2.090   7.050   2.372
   68   HD12  ILE  11          1HD1      ILE  11   0.368   7.073   1.994
   69   HD13  ILE  11          2HD1      ILE  11   1.491   8.048   1.049
   70    H    ALA  12           H        ALA  12   0.698   6.505  -3.305
   71    HA   ALA  12           HA       ALA  12  -1.834   6.059  -4.352
   72    HB1  ALA  12           3HB      ALA  12  -0.521   8.049  -4.880
   73    HB2  ALA  12           1HB      ALA  12  -1.044   7.239  -6.357
   74    HB3  ALA  12           2HB      ALA  12   0.620   7.067  -5.798
   75    H    LYS  13           H        LYS  13   1.257   4.551  -5.060
   76    HA   LYS  13           HA       LYS  13   0.606   3.088  -7.328
   77    HB2  LYS  13           2HB      LYS  13   2.883   3.246  -6.400
   78    HB3  LYS  13           1HB      LYS  13   2.394   2.256  -5.034
   79    HG2  LYS  13           2HG      LYS  13   3.641   0.966  -6.680
   80    HG3  LYS  13           1HG      LYS  13   1.987   0.374  -6.510
   81    HD2  LYS  13           2HD      LYS  13   1.333   1.311  -8.567
   82    HD3  LYS  13           1HD      LYS  13   2.771   2.332  -8.645
   83    HE2  LYS  13           2HE      LYS  13   4.167   0.372  -8.913
   84    HE3  LYS  13           1HE      LYS  13   2.753  -0.674  -8.811
   85    HZ1  LYS  13           3HZ      LYS  13   3.423  -0.322 -11.103
   86    HZ2  LYS  13           1HZ      LYS  13   3.263   1.353 -10.923
   87    HZ3  LYS  13           2HZ      LYS  13   1.899   0.358 -10.828
   88    H    LEU  14           H        LEU  14  -0.089   2.495  -3.926
   89    HA   LEU  14           HA       LEU  14  -1.285  -0.088  -4.460
   90    HG   LEU  14           HG       LEU  14  -0.649  -1.390  -2.764
   91    HB2  LEU  14           2HB      LEU  14  -0.651   1.520  -2.082
   92    HB3  LEU  14           1HB      LEU  14  -2.139   0.603  -1.956
   93   HD11  LEU  14          1HD1      LEU  14   1.339   0.657  -1.895
   94   HD12  LEU  14          2HD1      LEU  14   1.400  -0.463  -3.255
   95   HD13  LEU  14          3HD1      LEU  14   1.650  -1.056  -1.614
   96   HD21  LEU  14          3HD2      LEU  14  -0.448  -0.283   0.029
   97   HD22  LEU  14          1HD2      LEU  14  -0.184  -1.960  -0.451
   98   HD23  LEU  14          2HD2      LEU  14  -1.787  -1.240  -0.607
   99    H    MET  15           H        MET  15  -2.293   3.228  -4.090
  100    HA   MET  15           HA       MET  15  -5.052   2.792  -3.686
  101    HB2  MET  15           2HB      MET  15  -3.534   5.123  -4.857
  102    HB3  MET  15           1HB      MET  15  -5.273   5.145  -4.597
  103    HG2  MET  15           2HG      MET  15  -4.891   4.750  -2.198
  104    HG3  MET  15           1HG      MET  15  -3.154   4.813  -2.486
  105    HE1  MET  15           3HE      MET  15  -6.528   6.810  -2.616
  106    HE2  MET  15           1HE      MET  15  -5.898   7.027  -4.249
  107    HE3  MET  15           2HE      MET  15  -5.983   8.401  -3.148
  108    H    GLY  16           H        GLY  16  -3.037   2.485  -6.442
  109    HA2  GLY  16           2HA      GLY  16  -4.627   3.010  -8.608
  110    HA3  GLY  16           1HA      GLY  16  -3.518   1.646  -8.533
  111    H    GLU  17           H        GLU  17  -4.532  -0.077  -6.865
  112    HA   GLU  17           HA       GLU  17  -6.643  -1.287  -8.251
  113    HB2  GLU  17           2HB      GLU  17  -5.458  -1.767  -5.524
  114    HB3  GLU  17           1HB      GLU  17  -6.789  -2.741  -6.146
  115    HG2  GLU  17           2HG      GLU  17  -5.496  -3.644  -7.857
  116    HG3  GLU  17           1HG      GLU  17  -4.267  -2.377  -7.716
  117    H    GLY  18           H        GLY  18  -6.593   0.715  -5.347
  118    HA2  GLY  18           2HA      GLY  18  -8.355   2.151  -4.717
  119    HA3  GLY  18           1HA      GLY  18  -9.461   1.184  -5.680
  120    H    TYR  19           H        TYR  19  -7.967   1.619  -2.596
  121    HA   TYR  19           HA       TYR  19  -9.980  -0.033  -1.350
  122    HD1  TYR  19           2HD      TYR  19  -9.680  -2.264   0.743
  123    HD2  TYR  19           1HD      TYR  19  -8.196  -2.615  -3.228
  124    HE1  TYR  19           2HE      TYR  19 -10.919  -4.371   0.474
  125    HE2  TYR  19           1HE      TYR  19  -9.432  -4.722  -3.510
  126    HH   TYR  19           HH       TYR  19 -10.374  -6.508  -2.099
  127    HB2  TYR  19           2HB      TYR  19  -7.263  -1.004  -1.743
  128    HB3  TYR  19           1HB      TYR  19  -7.710  -0.963  -0.041
  129    H    ALA  20           H        ALA  20  -9.249  -0.149   1.180
  130    HA   ALA  20           HA       ALA  20  -9.554   2.436   2.167
  131    HB1  ALA  20           3HB      ALA  20  -9.878   0.096   3.298
  132    HB2  ALA  20           1HB      ALA  20  -9.485   1.513   4.274
  133    HB3  ALA  20           2HB      ALA  20  -8.220   0.361   3.846
  134    H    PHE  21           H        PHE  21  -8.118   3.780   3.380
  135    HA   PHE  21           HA       PHE  21  -5.473   3.911   2.217
  136    HD1  PHE  21           1HD      PHE  21  -8.864   5.818   2.801
  137    HD2  PHE  21           2HD      PHE  21  -4.998   6.885   1.379
  138    HE1  PHE  21           1HE      PHE  21  -9.892   7.009   0.909
  139    HE2  PHE  21           2HE      PHE  21  -6.019   8.077  -0.515
  140    HZ   PHE  21           HZ       PHE  21  -8.470   8.141  -0.751
  141    HB2  PHE  21           2HB      PHE  21  -6.878   5.679   4.234
  142    HB3  PHE  21           1HB      PHE  21  -5.278   6.003   3.576
  143    H    GLU  22           H        GLU  22  -6.934   3.288   5.362
  144    HA   GLU  22           HA       GLU  22  -4.601   3.200   6.903
  145    HB2  GLU  22           2HB      GLU  22  -7.190   1.672   7.235
  146    HB3  GLU  22           1HB      GLU  22  -5.934   1.788   8.462
  147    HG2  GLU  22           2HG      GLU  22  -7.462   4.115   7.316
  148    HG3  GLU  22           1HG      GLU  22  -7.795   3.333   8.861
  149    H    GLU  23           H        GLU  23  -6.180   0.729   4.938
  150    HA   GLU  23           HA       GLU  23  -4.543  -1.428   5.780
  151    HB2  GLU  23           2HB      GLU  23  -6.237  -1.011   3.325
  152    HB3  GLU  23           1HB      GLU  23  -5.387  -2.514   3.663
  153    HG2  GLU  23           2HG      GLU  23  -6.605  -2.598   5.846
  154    HG3  GLU  23           1HG      GLU  23  -7.577  -1.242   5.275
  155    H    VAL  24           H        VAL  24  -4.236   1.007   3.285
  156    HA   VAL  24           HA       VAL  24  -2.141  -0.237   1.829
  157    HB   VAL  24           HB       VAL  24  -2.988   2.655   2.000
  158   HG11  VAL  24          1HG1      VAL  24  -1.120   1.399  -0.007
  159   HG12  VAL  24          2HG1      VAL  24  -0.608   2.422   1.331
  160   HG13  VAL  24          3HG1      VAL  24  -1.629   3.085   0.056
  161   HG21  VAL  24          3HG2      VAL  24  -3.390   0.704  -0.256
  162   HG22  VAL  24          1HG2      VAL  24  -4.154   2.276  -0.024
  163   HG23  VAL  24          2HG2      VAL  24  -4.568   0.929   1.037
  164    H    LYS  25           H        LYS  25  -1.958   2.687   3.877
  165    HA   LYS  25           HA       LYS  25   0.805   2.815   4.036
  166    HB2  LYS  25           2HB      LYS  25  -1.309   3.730   5.978
  167    HB3  LYS  25           1HB      LYS  25   0.401   4.062   6.212
  168    HG2  LYS  25           2HG      LYS  25  -0.474   5.991   5.228
  169    HG3  LYS  25           1HG      LYS  25   0.362   5.145   3.933
  170    HD2  LYS  25           2HD      LYS  25  -1.667   4.381   2.987
  171    HD3  LYS  25           1HD      LYS  25  -2.587   4.837   4.422
  172    HE2  LYS  25           2HE      LYS  25  -1.212   6.743   2.534
  173    HE3  LYS  25           1HE      LYS  25  -2.941   6.406   2.573
  174    HZ1  LYS  25           3HZ      LYS  25  -2.399   8.442   3.757
  175    HZ2  LYS  25           1HZ      LYS  25  -1.369   7.591   4.796
  176    HZ3  LYS  25           2HZ      LYS  25  -3.032   7.286   4.816
  177    H    ARG  26           H        ARG  26  -1.445   1.067   6.170
  178    HA   ARG  26           HA       ARG  26   0.513   0.243   8.020
  179    HE   ARG  26           HE       ARG  26  -4.018  -3.367   6.363
  180    HB2  ARG  26           2HB      ARG  26  -1.102  -1.131   8.964
  181    HB3  ARG  26           1HB      ARG  26  -2.079   0.108   8.192
  182    HG2  ARG  26           2HG      ARG  26  -2.439  -1.398   6.284
  183    HG3  ARG  26           1HG      ARG  26  -1.526  -2.652   7.131
  184    HD2  ARG  26           2HD      ARG  26  -3.137  -2.511   8.993
  185    HD3  ARG  26           1HD      ARG  26  -4.062  -1.330   8.065
  186   HH11  ARG  26          1HH1      ARG  26  -4.617  -3.321   9.795
  187   HH12  ARG  26          2HH1      ARG  26  -5.656  -4.707   9.764
  188   HH21  ARG  26          1HH2      ARG  26  -5.383  -5.197   6.313
  189   HH22  ARG  26          2HH2      ARG  26  -6.090  -5.773   7.785
  190    H    ALA  27           H        ALA  27  -0.637  -1.162   4.993
  191    HA   ALA  27           HA       ALA  27   0.831  -3.588   5.226
  192    HB1  ALA  27           3HB      ALA  27  -1.098  -3.371   3.735
  193    HB2  ALA  27           1HB      ALA  27   0.338  -3.892   2.854
  194    HB3  ALA  27           2HB      ALA  27  -0.205  -2.217   2.744
  195    H    LEU  28           H        LEU  28   1.567  -0.390   4.043
  196    HA   LEU  28           HA       LEU  28   3.950  -1.060   2.654
  197    HG   LEU  28           HG       LEU  28   1.586   0.896   1.919
  198    HB2  LEU  28           2HB      LEU  28   2.937   1.541   3.801
  199    HB3  LEU  28           1HB      LEU  28   4.408   1.409   2.852
  200   HD11  LEU  28          1HD1      LEU  28   2.250   2.714   0.295
  201   HD12  LEU  28          2HD1      LEU  28   3.653   2.993   1.330
  202   HD13  LEU  28          3HD1      LEU  28   2.025   3.210   1.972
  203   HD21  LEU  28          3HD2      LEU  28   2.836   0.667  -0.341
  204   HD22  LEU  28          1HD2      LEU  28   2.750  -0.723   0.740
  205   HD23  LEU  28          2HD2      LEU  28   4.220   0.242   0.664
  206    H    GLU  29           H        GLU  29   3.322   0.249   5.898
  207    HA   GLU  29           HA       GLU  29   6.023   0.472   6.660
  208    HB2  GLU  29           2HB      GLU  29   3.502   0.201   8.297
  209    HB3  GLU  29           1HB      GLU  29   5.086   0.491   9.005
  210    HG2  GLU  29           2HG      GLU  29   3.702   2.289   7.027
  211    HG3  GLU  29           1HG      GLU  29   3.780   2.545   8.769
  212    H    ILE  30           H        ILE  30   3.643  -2.115   7.155
  213    HA   ILE  30           HA       ILE  30   5.106  -3.806   8.780
  214    HB   ILE  30           HB       ILE  30   3.108  -4.433   6.616
  215   HG12  ILE  30          2HG1      ILE  30   2.912  -4.602   9.630
  216   HG13  ILE  30          1HG1      ILE  30   2.371  -3.224   8.680
  217   HG21  ILE  30          1HG2      ILE  30   3.154  -6.655   8.213
  218   HG22  ILE  30          2HG2      ILE  30   4.867  -6.248   8.080
  219   HG23  ILE  30          3HG2      ILE  30   3.909  -6.521   6.624
  220   HD11  ILE  30          3HD1      ILE  30   0.505  -4.640   9.266
  221   HD12  ILE  30          1HD1      ILE  30   1.294  -6.029   8.517
  222   HD13  ILE  30          2HD1      ILE  30   0.768  -4.670   7.523
  223    H    ALA  31           H        ALA  31   4.888  -4.061   5.223
  224    HA   ALA  31           HA       ALA  31   7.177  -5.809   5.152
  225    HB1  ALA  31           3HB      ALA  31   5.620  -4.584   2.879
  226    HB2  ALA  31           1HB      ALA  31   5.284  -6.143   3.629
  227    HB3  ALA  31           2HB      ALA  31   6.794  -5.894   2.751
  228    H    GLN  32           H        GLN  32   7.814  -3.315   6.267
  229    HA   GLN  32           HA       GLN  32   9.413  -1.709   6.204
  230    HB2  GLN  32           2HB      GLN  32  10.384  -3.273   3.812
  231    HB3  GLN  32           1HB      GLN  32  11.286  -1.990   4.604
  232    HG2  GLN  32           2HG      GLN  32  10.371  -4.485   6.004
  233    HG3  GLN  32           1HG      GLN  32  11.942  -4.308   5.231
  234   HE21  GLN  32          1HE2      GLN  32  13.028  -4.605   7.172
  235   HE22  GLN  32          2HE2      GLN  32  13.075  -3.386   8.396
  236    H    ASN  33           H        ASN  33   9.426  -2.120   2.702
  237    HA   ASN  33           HA       ASN  33   7.717   0.186   2.296
  238    HB2  ASN  33           2HB      ASN  33  10.631   0.214   1.482
  239    HB3  ASN  33           1HB      ASN  33   9.431   1.380   0.934
  240   HD21  ASN  33          1HD2      ASN  33   8.573   2.861   2.411
  241   HD22  ASN  33          2HD2      ASN  33   9.371   3.218   3.901
  242    H    ASN  34           H        ASN  34   7.789  -2.684   1.626
  243    HA   ASN  34           HA       ASN  34   8.160  -2.713  -1.257
  244    HB2  ASN  34           2HB      ASN  34   7.346  -4.893   0.661
  245    HB3  ASN  34           1HB      ASN  34   7.610  -5.123  -1.062
  246   HD21  ASN  34          1HD2      ASN  34   9.845  -3.248  -1.130
  247   HD22  ASN  34          2HD2      ASN  34  11.178  -4.070  -0.402
  248    H    VAL  35           H        VAL  35   6.591  -2.364  -2.656
  249    HA   VAL  35           HA       VAL  35   3.862  -2.061  -1.719
  250    HB   VAL  35           HB       VAL  35   4.184  -0.336  -3.159
  251   HG11  VAL  35          1HG1      VAL  35   6.152  -2.116  -4.540
  252   HG12  VAL  35          2HG1      VAL  35   6.411  -0.565  -3.736
  253   HG13  VAL  35          3HG1      VAL  35   5.589  -0.625  -5.295
  254   HG21  VAL  35          3HG2      VAL  35   3.559  -2.424  -5.239
  255   HG22  VAL  35          1HG2      VAL  35   3.155  -0.709  -5.283
  256   HG23  VAL  35          2HG2      VAL  35   2.376  -1.768  -4.107
  257    H    GLU  36           H        GLU  36   5.770  -4.300  -3.585
  258    HA   GLU  36           HA       GLU  36   3.708  -5.652  -4.921
  259    HB2  GLU  36           2HB      GLU  36   6.308  -6.788  -3.905
  260    HB3  GLU  36           1HB      GLU  36   5.289  -7.500  -5.145
  261    HG2  GLU  36           2HG      GLU  36   6.727  -4.863  -5.334
  262    HG3  GLU  36           1HG      GLU  36   7.207  -6.368  -6.115
  263    H    VAL  37           H        VAL  37   5.347  -6.531  -1.872
  264    HA   VAL  37           HA       VAL  37   3.665  -8.679  -1.230
  265    HB   VAL  37           HB       VAL  37   5.103  -6.870   0.721
  266   HG11  VAL  37          1HG1      VAL  37   3.438  -8.345   1.752
  267   HG12  VAL  37          2HG1      VAL  37   5.082  -8.793   2.204
  268   HG13  VAL  37          3HG1      VAL  37   4.212  -9.738   0.996
  269   HG21  VAL  37          3HG2      VAL  37   6.617  -7.725  -1.003
  270   HG22  VAL  37          1HG2      VAL  37   6.090  -9.370  -0.648
  271   HG23  VAL  37          2HG2      VAL  37   6.956  -8.438   0.574
  272    H    ALA  38           H        ALA  38   3.525  -5.260  -0.270
  273    HA   ALA  38           HA       ALA  38   1.298  -5.375   1.392
  274    HB1  ALA  38           3HB      ALA  38   2.476  -3.366   1.425
  275    HB2  ALA  38           1HB      ALA  38   0.986  -2.941   0.581
  276    HB3  ALA  38           2HB      ALA  38   2.471  -3.225  -0.332
  277    H    ARG  39           H        ARG  39   1.547  -5.052  -2.111
  278    HA   ARG  39           HA       ARG  39  -1.225  -4.707  -2.600
  279    HE   ARG  39           HE       ARG  39  -1.018  -3.854  -7.064
  280    HB2  ARG  39           2HB      ARG  39   1.157  -5.402  -4.281
  281    HB3  ARG  39           1HB      ARG  39  -0.457  -5.610  -4.951
  282    HG2  ARG  39           2HG      ARG  39  -0.939  -3.261  -4.571
  283    HG3  ARG  39           1HG      ARG  39   0.652  -3.043  -3.839
  284    HD2  ARG  39           2HD      ARG  39   0.677  -2.283  -6.137
  285    HD3  ARG  39           1HD      ARG  39   1.704  -3.702  -5.941
  286   HH11  ARG  39          1HH1      ARG  39   2.365  -4.688  -7.103
  287   HH12  ARG  39          2HH1      ARG  39   2.221  -5.746  -8.466
  288   HH21  ARG  39          1HH2      ARG  39  -1.216  -5.245  -8.862
  289   HH22  ARG  39          2HH2      ARG  39   0.186  -6.064  -9.465
  290    H    SER  40           H        SER  40   0.879  -7.491  -2.290
  291    HA   SER  40           HA       SER  40  -0.807  -9.457  -3.347
  292    HG   SER  40           HG       SER  40  -0.281 -11.566  -2.559
  293    HB2  SER  40           2HB      SER  40   1.551  -9.888  -2.814
  294    HB3  SER  40           1HB      SER  40   1.205  -9.704  -1.096
  295    H    ILE  41           H        ILE  41  -0.645  -7.983  -0.155
  296    HA   ILE  41           HA       ILE  41  -2.859  -9.662   0.770
  297    HB   ILE  41           HB       ILE  41  -2.479  -8.581   2.972
  298   HG12  ILE  41          2HG1      ILE  41  -0.072  -7.334   1.626
  299   HG13  ILE  41          1HG1      ILE  41  -1.534  -6.456   2.065
  300   HG21  ILE  41          1HG2      ILE  41  -1.410 -10.699   2.417
  301   HG22  ILE  41          2HG2      ILE  41  -0.367  -9.720   3.448
  302   HG23  ILE  41          3HG2      ILE  41  -0.040  -9.835   1.719
  303   HD11  ILE  41          3HD1      ILE  41   0.236  -6.114   3.692
  304   HD12  ILE  41          1HD1      ILE  41   0.324  -7.852   3.978
  305   HD13  ILE  41          2HD1      ILE  41  -1.133  -6.959   4.416
  306    H    LEU  42           H        LEU  42  -2.344  -6.645  -0.656
  307    HA   LEU  42           HA       LEU  42  -4.340  -5.088   0.587
  308    HG   LEU  42           HG       LEU  42  -3.385  -2.359  -1.672
  309    HB2  LEU  42           2HB      LEU  42  -2.421  -4.388  -0.978
  310    HB3  LEU  42           1HB      LEU  42  -3.499  -4.818  -2.285
  311   HD11  LEU  42          1HD1      LEU  42  -5.181  -3.358  -3.029
  312   HD12  LEU  42          2HD1      LEU  42  -5.742  -2.004  -2.048
  313   HD13  LEU  42          3HD1      LEU  42  -6.103  -3.659  -1.556
  314   HD21  LEU  42          3HD2      LEU  42  -5.063  -3.262   0.667
  315   HD22  LEU  42          1HD2      LEU  42  -4.684  -1.599   0.219
  316   HD23  LEU  42          2HD2      LEU  42  -3.403  -2.677   0.774
  317    H    ARG  43           H        ARG  43  -4.401  -6.950  -2.455
  318    HA   ARG  43           HA       ARG  43  -7.251  -6.537  -2.735
  319    HE   ARG  43           HE       ARG  43  -9.555  -8.222  -6.294
  320    HB2  ARG  43           2HB      ARG  43  -5.821  -6.546  -4.716
  321    HB3  ARG  43           1HB      ARG  43  -5.329  -8.202  -4.375
  322    HG2  ARG  43           2HG      ARG  43  -6.940  -8.610  -5.918
  323    HG3  ARG  43           1HG      ARG  43  -7.958  -8.571  -4.477
  324    HD2  ARG  43           2HD      ARG  43  -8.247  -6.116  -4.913
  325    HD3  ARG  43           1HD      ARG  43  -7.519  -6.388  -6.482
  326   HH11  ARG  43          1HH1      ARG  43  -9.280  -4.750  -6.160
  327   HH12  ARG  43          2HH1      ARG  43 -10.858  -4.471  -6.814
  328   HH21  ARG  43          1HH2      ARG  43 -11.637  -7.862  -7.153
  329   HH22  ARG  43          2HH2      ARG  43 -12.198  -6.238  -7.375
  330    H    GLU  44           H        GLU  44  -5.114  -9.001  -1.528
  331    HA   GLU  44           HA       GLU  44  -7.079 -11.097  -1.593
  332    HB2  GLU  44           2HB      GLU  44  -4.348 -10.845  -0.356
  333    HB3  GLU  44           1HB      GLU  44  -5.366 -12.250  -0.068
  334    HG2  GLU  44           2HG      GLU  44  -4.478 -11.290  -2.779
  335    HG3  GLU  44           1HG      GLU  44  -3.719 -12.593  -1.865
  336    H    PHE  45           H        PHE  45  -7.500  -8.476  -0.063
  337    HA   PHE  45           HA       PHE  45  -7.769  -9.373   2.674
  338    HD1  PHE  45           1HD      PHE  45  -7.365  -7.709   4.707
  339    HD2  PHE  45           2HD      PHE  45 -10.527  -6.027   2.409
  340    HE1  PHE  45           1HE      PHE  45  -8.501  -7.023   6.779
  341    HE2  PHE  45           2HE      PHE  45 -11.668  -5.337   4.476
  342    HZ   PHE  45           HZ       PHE  45 -10.656  -5.834   6.665
  343    HB2  PHE  45           2HB      PHE  45  -7.137  -7.052   2.238
  344    HB3  PHE  45           1HB      PHE  45  -8.625  -6.797   1.333
  345    H    ALA  46           H        ALA  46  -9.265 -11.017   2.692
  346    HA   ALA  46           HA       ALA  46 -11.968 -10.373   1.722
  347    HB1  ALA  46           3HB      ALA  46 -10.968 -12.372   0.724
  348    HB2  ALA  46           1HB      ALA  46 -12.387 -12.772   1.690
  349    HB3  ALA  46           2HB      ALA  46 -10.771 -13.073   2.329
  Start of MODEL   11
    1    HA   ALA   3           HA       ALA   3  12.554  14.146  -0.369
    2    HB1  ALA   3           3HB      ALA   3  14.392  15.489  -1.270
    3    HB2  ALA   3           1HB      ALA   3  13.036  16.498  -0.769
    4    HB3  ALA   3           2HB      ALA   3  13.302  16.165  -2.480
    5    H    LEU   4           H        LEU   4  10.797  15.570   0.183
    6    HA   LEU   4           HA       LEU   4   8.629  16.233   0.127
    7    HG   LEU   4           HG       LEU   4  10.657  17.887  -1.590
    8    HB2  LEU   4           2HB      LEU   4   9.077  16.445  -2.852
    9    HB3  LEU   4           1HB      LEU   4   7.749  17.161  -1.959
   10   HD11  LEU   4          1HD1      LEU   4   9.812  18.559  -3.785
   11   HD12  LEU   4          2HD1      LEU   4  10.102  19.954  -2.744
   12   HD13  LEU   4          3HD1      LEU   4   8.456  19.378  -3.009
   13   HD21  LEU   4          3HD2      LEU   4   9.324  18.217   0.425
   14   HD22  LEU   4          1HD2      LEU   4   8.139  19.140  -0.500
   15   HD23  LEU   4          2HD2      LEU   4   9.776  19.763  -0.292
   16    H    GLU   5           H        GLU   5   8.517  14.734  -3.079
   17    HA   GLU   5           HA       GLU   5   6.439  12.932  -2.091
   18    HB2  GLU   5           2HB      GLU   5   6.061  12.481  -4.537
   19    HB3  GLU   5           1HB      GLU   5   5.778  14.142  -4.034
   20    HG2  GLU   5           2HG      GLU   5   7.979  14.771  -4.905
   21    HG3  GLU   5           1HG      GLU   5   8.238  13.108  -5.429
   22    H    ASN   6           H        ASN   6   7.177  11.069  -1.305
   23    HA   ASN   6           HA       ASN   6   8.933   9.455  -2.986
   24    HB2  ASN   6           2HB      ASN   6  10.311   8.818  -0.989
   25    HB3  ASN   6           1HB      ASN   6  10.525  10.482  -1.517
   26   HD21  ASN   6          1HD2      ASN   6  11.003   9.220   1.083
   27   HD22  ASN   6          2HD2      ASN   6  10.068  10.122   2.222
   28    H    VAL   7           H        VAL   7   7.381   9.388   0.238
   29    HA   VAL   7           HA       VAL   7   6.810   6.599   0.052
   30    HB   VAL   7           HB       VAL   7   5.451   6.957   2.102
   31   HG11  VAL   7          1HG1      VAL   7   8.215   8.158   2.132
   32   HG12  VAL   7          2HG1      VAL   7   7.807   6.450   2.293
   33   HG13  VAL   7          3HG1      VAL   7   7.334   7.591   3.551
   34   HG21  VAL   7          3HG2      VAL   7   6.277   9.837   1.744
   35   HG22  VAL   7          1HG2      VAL   7   5.501   9.167   3.180
   36   HG23  VAL   7          2HG2      VAL   7   4.636   9.199   1.644
   37    H    ASP   8           H        ASP   8   5.132   9.525  -0.770
   38    HA   ASP   8           HA       ASP   8   2.491   8.585  -0.859
   39    HB2  ASP   8           2HB      ASP   8   3.075  10.968  -1.013
   40    HB3  ASP   8           1HB      ASP   8   3.822  10.683  -2.583
   41    H    ALA   9           H        ALA   9   5.093   8.475  -3.241
   42    HA   ALA   9           HA       ALA   9   3.676   7.626  -5.470
   43    HB1  ALA   9           3HB      ALA   9   5.987   8.251  -5.643
   44    HB2  ALA   9           1HB      ALA   9   5.816   6.585  -6.196
   45    HB3  ALA   9           2HB      ALA   9   6.468   6.919  -4.592
   46    H    LYS  10           H        LYS  10   4.958   5.755  -2.762
   47    HA   LYS  10           HA       LYS  10   4.264   3.208  -3.815
   48    HB2  LYS  10           2HB      LYS  10   4.574   3.904  -0.895
   49    HB3  LYS  10           1HB      LYS  10   4.823   2.342  -1.662
   50    HG2  LYS  10           2HG      LYS  10   6.504   4.584  -2.610
   51    HG3  LYS  10           1HG      LYS  10   6.824   3.964  -0.991
   52    HD2  LYS  10           2HD      LYS  10   8.222   2.832  -2.619
   53    HD3  LYS  10           1HD      LYS  10   7.064   1.700  -1.921
   54    HE2  LYS  10           2HE      LYS  10   5.701   1.780  -3.868
   55    HE3  LYS  10           1HE      LYS  10   6.636   3.116  -4.542
   56    HZ1  LYS  10           3HZ      LYS  10   7.172   0.942  -5.539
   57    HZ2  LYS  10           1HZ      LYS  10   7.723   0.400  -4.034
   58    HZ3  LYS  10           2HZ      LYS  10   8.513   1.675  -4.813
   59    H    ILE  11           H        ILE  11   2.721   5.411  -1.507
   60    HA   ILE  11           HA       ILE  11   0.527   3.836  -0.832
   61    HB   ILE  11           HB       ILE  11   0.584   6.845  -1.108
   62   HG12  ILE  11          2HG1      ILE  11   1.145   5.082   1.292
   63   HG13  ILE  11          1HG1      ILE  11   2.362   5.950   0.367
   64   HG21  ILE  11          1HG2      ILE  11  -1.125   5.592   0.917
   65   HG22  ILE  11          2HG2      ILE  11  -1.585   5.230  -0.750
   66   HG23  ILE  11          3HG2      ILE  11  -1.473   6.908  -0.207
   67   HD11  ILE  11          3HD1      ILE  11   1.808   7.092   2.445
   68   HD12  ILE  11          1HD1      ILE  11   0.129   7.220   1.928
   69   HD13  ILE  11          2HD1      ILE  11   1.391   8.069   1.039
   70    H    ALA  12           H        ALA  12   0.632   6.455  -3.256
   71    HA   ALA  12           HA       ALA  12  -1.858   6.029  -4.394
   72    HB1  ALA  12           3HB      ALA  12  -0.467   7.987  -4.886
   73    HB2  ALA  12           1HB      ALA  12  -0.999   7.190  -6.366
   74    HB3  ALA  12           2HB      ALA  12   0.653   6.966  -5.789
   75    H    LYS  13           H        LYS  13   1.241   4.490  -5.032
   76    HA   LYS  13           HA       LYS  13   0.636   3.018  -7.296
   77    HB2  LYS  13           2HB      LYS  13   2.878   3.162  -6.217
   78    HB3  LYS  13           1HB      LYS  13   2.307   2.080  -4.957
   79    HG2  LYS  13           2HG      LYS  13   3.531   0.746  -6.470
   80    HG3  LYS  13           1HG      LYS  13   1.828   0.402  -6.771
   81    HD2  LYS  13           2HD      LYS  13   1.888   1.294  -8.837
   82    HD3  LYS  13           1HD      LYS  13   2.996   2.589  -8.366
   83    HE2  LYS  13           2HE      LYS  13   4.860   1.110  -8.475
   84    HE3  LYS  13           1HE      LYS  13   3.796  -0.280  -8.665
   85    HZ1  LYS  13           3HZ      LYS  13   3.100   0.599 -10.814
   86    HZ2  LYS  13           1HZ      LYS  13   4.773   0.351 -10.774
   87    HZ3  LYS  13           2HZ      LYS  13   4.145   1.916 -10.632
   88    H    LEU  14           H        LEU  14  -0.192   2.462  -3.924
   89    HA   LEU  14           HA       LEU  14  -1.423  -0.100  -4.512
   90    HG   LEU  14           HG       LEU  14  -0.597  -1.387  -2.803
   91    HB2  LEU  14           2HB      LEU  14  -0.915   1.510  -2.066
   92    HB3  LEU  14           1HB      LEU  14  -2.271   0.398  -2.027
   93   HD11  LEU  14          1HD1      LEU  14   1.175   0.206  -3.431
   94   HD12  LEU  14          2HD1      LEU  14   1.716  -1.006  -2.270
   95   HD13  LEU  14          3HD1      LEU  14   1.357   0.634  -1.730
   96   HD21  LEU  14          3HD2      LEU  14  -0.347  -0.178  -0.054
   97   HD22  LEU  14          1HD2      LEU  14   0.116  -1.819  -0.508
   98   HD23  LEU  14          2HD2      LEU  14  -1.578  -1.329  -0.580
   99    H    MET  15           H        MET  15  -2.350   3.232  -4.162
  100    HA   MET  15           HA       MET  15  -5.107   2.898  -3.722
  101    HB2  MET  15           2HB      MET  15  -3.571   5.128  -5.062
  102    HB3  MET  15           1HB      MET  15  -5.290   5.210  -4.700
  103    HG2  MET  15           2HG      MET  15  -3.066   4.892  -2.698
  104    HG3  MET  15           1HG      MET  15  -3.988   6.362  -3.013
  105    HE1  MET  15           3HE      MET  15  -3.567   5.004  -0.126
  106    HE2  MET  15           1HE      MET  15  -5.182   5.178   0.560
  107    HE3  MET  15           2HE      MET  15  -4.466   6.503  -0.357
  108    H    GLY  16           H        GLY  16  -3.140   2.503  -6.529
  109    HA2  GLY  16           2HA      GLY  16  -4.831   2.916  -8.647
  110    HA3  GLY  16           1HA      GLY  16  -3.666   1.600  -8.581
  111    H    GLU  17           H        GLU  17  -4.531  -0.152  -6.881
  112    HA   GLU  17           HA       GLU  17  -6.648  -1.466  -8.139
  113    HB2  GLU  17           2HB      GLU  17  -5.265  -1.824  -5.503
  114    HB3  GLU  17           1HB      GLU  17  -6.685  -2.794  -5.893
  115    HG2  GLU  17           2HG      GLU  17  -5.616  -3.782  -7.753
  116    HG3  GLU  17           1HG      GLU  17  -4.282  -2.620  -7.686
  117    H    GLY  18           H        GLY  18  -6.577   0.688  -5.367
  118    HA2  GLY  18           2HA      GLY  18  -8.375   2.056  -4.704
  119    HA3  GLY  18           1HA      GLY  18  -9.476   0.993  -5.569
  120    H    TYR  19           H        TYR  19  -8.024   1.748  -2.565
  121    HA   TYR  19           HA       TYR  19  -9.801  -0.075  -1.204
  122    HD1  TYR  19           1HD      TYR  19  -9.101  -2.672  -2.263
  123    HD2  TYR  19           2HD      TYR  19  -7.916  -1.665   1.697
  124    HE1  TYR  19           1HE      TYR  19 -10.136  -4.743  -1.434
  125    HE2  TYR  19           2HE      TYR  19  -8.947  -3.734   2.538
  126    HH   TYR  19           HH       TYR  19 -10.686  -5.331   1.863
  127    HB2  TYR  19           2HB      TYR  19  -7.247  -0.995  -1.751
  128    HB3  TYR  19           1HB      TYR  19  -7.116  -0.390  -0.103
  129    H    ALA  20           H        ALA  20  -8.882   0.065   1.338
  130    HA   ALA  20           HA       ALA  20  -9.559   2.697   2.111
  131    HB1  ALA  20           3HB      ALA  20  -9.689   0.400   3.403
  132    HB2  ALA  20           1HB      ALA  20  -9.524   1.929   4.268
  133    HB3  ALA  20           2HB      ALA  20  -8.107   0.911   4.002
  134    H    PHE  21           H        PHE  21  -7.999   3.642   3.985
  135    HA   PHE  21           HA       PHE  21  -5.472   4.222   2.605
  136    HD1  PHE  21           2HD      PHE  21  -8.985   5.711   3.527
  137    HD2  PHE  21           1HD      PHE  21  -5.381   7.373   1.993
  138    HE1  PHE  21           2HE      PHE  21 -10.278   6.939   1.833
  139    HE2  PHE  21           1HE      PHE  21  -6.667   8.605   0.296
  140    HZ   PHE  21           HZ       PHE  21  -9.119   8.390   0.214
  141    HB2  PHE  21           2HB      PHE  21  -6.867   5.731   4.834
  142    HB3  PHE  21           1HB      PHE  21  -5.369   6.223   4.052
  143    H    GLU  22           H        GLU  22  -6.737   3.683   5.887
  144    HA   GLU  22           HA       GLU  22  -4.317   3.404   7.211
  145    HB2  GLU  22           2HB      GLU  22  -6.909   1.957   7.785
  146    HB3  GLU  22           1HB      GLU  22  -5.572   2.149   8.910
  147    HG2  GLU  22           2HG      GLU  22  -5.887   4.569   8.877
  148    HG3  GLU  22           1HG      GLU  22  -7.228   4.377   7.749
  149    H    GLU  23           H        GLU  23  -6.126   1.072   5.291
  150    HA   GLU  23           HA       GLU  23  -4.580  -1.192   6.054
  151    HB2  GLU  23           2HB      GLU  23  -6.400  -0.669   3.711
  152    HB3  GLU  23           1HB      GLU  23  -5.603  -2.215   3.980
  153    HG2  GLU  23           2HG      GLU  23  -6.678  -2.275   6.233
  154    HG3  GLU  23           1HG      GLU  23  -7.611  -0.857   5.754
  155    H    VAL  24           H        VAL  24  -4.357   1.156   3.436
  156    HA   VAL  24           HA       VAL  24  -2.333  -0.199   1.978
  157    HB   VAL  24           HB       VAL  24  -3.202   2.690   1.973
  158   HG11  VAL  24          1HG1      VAL  24  -1.357   1.345   0.002
  159   HG12  VAL  24          2HG1      VAL  24  -0.824   2.443   1.270
  160   HG13  VAL  24          3HG1      VAL  24  -1.883   3.027  -0.011
  161   HG21  VAL  24          3HG2      VAL  24  -3.597   0.592  -0.145
  162   HG22  VAL  24          1HG2      VAL  24  -4.396   2.156   0.002
  163   HG23  VAL  24          2HG2      VAL  24  -4.759   0.867   1.152
  164    H    LYS  25           H        LYS  25  -2.124   2.744   4.009
  165    HA   LYS  25           HA       LYS  25   0.647   2.965   3.988
  166    HB2  LYS  25           2HB      LYS  25  -1.397   3.830   6.024
  167    HB3  LYS  25           1HB      LYS  25   0.316   4.170   6.220
  168    HG2  LYS  25           2HG      LYS  25  -0.582   6.107   5.278
  169    HG3  LYS  25           1HG      LYS  25   0.207   5.272   3.947
  170    HD2  LYS  25           2HD      LYS  25  -1.889   4.459   3.124
  171    HD3  LYS  25           1HD      LYS  25  -2.734   5.047   4.556
  172    HE2  LYS  25           2HE      LYS  25  -1.403   6.715   2.427
  173    HE3  LYS  25           1HE      LYS  25  -3.134   6.545   2.707
  174    HZ1  LYS  25           3HZ      LYS  25  -2.291   8.605   3.636
  175    HZ2  LYS  25           1HZ      LYS  25  -1.190   7.754   4.598
  176    HZ3  LYS  25           2HZ      LYS  25  -2.851   7.590   4.868
  177    H    ARG  26           H        ARG  26  -1.422   1.226   6.323
  178    HA   ARG  26           HA       ARG  26   0.664   0.386   8.003
  179    HE   ARG  26           HE       ARG  26  -3.826  -3.289   6.569
  180    HB2  ARG  26           2HB      ARG  26  -0.871  -1.027   9.037
  181    HB3  ARG  26           1HB      ARG  26  -1.903   0.222   8.359
  182    HG2  ARG  26           2HG      ARG  26  -2.327  -1.276   6.421
  183    HG3  ARG  26           1HG      ARG  26  -1.436  -2.541   7.269
  184    HD2  ARG  26           2HD      ARG  26  -3.018  -2.367   9.139
  185    HD3  ARG  26           1HD      ARG  26  -3.906  -1.130   8.251
  186   HH11  ARG  26          1HH1      ARG  26  -4.964  -2.705   9.811
  187   HH12  ARG  26          2HH1      ARG  26  -6.219  -3.895   9.722
  188   HH21  ARG  26          1HH2      ARG  26  -5.475  -4.858   6.444
  189   HH22  ARG  26          2HH2      ARG  26  -6.509  -5.119   7.808
  190    H    ALA  27           H        ALA  27  -0.640  -0.953   5.020
  191    HA   ALA  27           HA       ALA  27   0.817  -3.395   5.119
  192    HB1  ALA  27           3HB      ALA  27  -1.177  -3.114   3.723
  193    HB2  ALA  27           1HB      ALA  27   0.212  -3.629   2.768
  194    HB3  ALA  27           2HB      ALA  27  -0.312  -1.945   2.726
  195    H    LEU  28           H        LEU  28   1.581  -0.161   4.214
  196    HA   LEU  28           HA       LEU  28   3.962  -0.862   2.735
  197    HG   LEU  28           HG       LEU  28   1.569   0.837   1.769
  198    HB2  LEU  28           2HB      LEU  28   2.806   1.774   3.647
  199    HB3  LEU  28           1HB      LEU  28   4.310   1.637   2.752
  200   HD11  LEU  28          1HD1      LEU  28   2.545   2.675   0.034
  201   HD12  LEU  28          2HD1      LEU  28   3.206   3.260   1.564
  202   HD13  LEU  28          3HD1      LEU  28   1.465   3.040   1.380
  203   HD21  LEU  28          3HD2      LEU  28   3.197   0.844  -0.407
  204   HD22  LEU  28          1HD2      LEU  28   2.729  -0.599   0.492
  205   HD23  LEU  28          2HD2      LEU  28   4.269   0.188   0.832
  206    H    GLU  29           H        GLU  29   3.086   0.104   5.968
  207    HA   GLU  29           HA       GLU  29   5.750   0.743   6.805
  208    HB2  GLU  29           2HB      GLU  29   3.219   0.202   8.366
  209    HB3  GLU  29           1HB      GLU  29   4.738   0.698   9.102
  210    HG2  GLU  29           2HG      GLU  29   3.197   2.286   7.062
  211    HG3  GLU  29           1HG      GLU  29   3.175   2.564   8.802
  212    H    ILE  30           H        ILE  30   3.549  -1.990   7.386
  213    HA   ILE  30           HA       ILE  30   5.330  -3.552   8.894
  214    HB   ILE  30           HB       ILE  30   3.077  -4.497   7.124
  215   HG12  ILE  30          2HG1      ILE  30   3.111  -3.870  10.084
  216   HG13  ILE  30          1HG1      ILE  30   2.432  -2.815   8.850
  217   HG21  ILE  30          1HG2      ILE  30   3.867  -5.983   9.547
  218   HG22  ILE  30          2HG2      ILE  30   5.000  -6.039   8.198
  219   HG23  ILE  30          3HG2      ILE  30   3.334  -6.578   7.973
  220   HD11  ILE  30          3HD1      ILE  30   0.736  -4.136  10.048
  221   HD12  ILE  30          1HD1      ILE  30   1.475  -5.609   9.423
  222   HD13  ILE  30          2HD1      ILE  30   0.750  -4.445   8.312
  223    H    ALA  31           H        ALA  31   4.704  -3.418   5.416
  224    HA   ALA  31           HA       ALA  31   6.511  -5.552   4.788
  225    HB1  ALA  31           3HB      ALA  31   6.129  -4.884   2.455
  226    HB2  ALA  31           1HB      ALA  31   5.250  -3.463   3.016
  227    HB3  ALA  31           2HB      ALA  31   4.619  -5.076   3.346
  228    H    GLN  32           H        GLN  32   7.227  -2.748   6.100
  229    HA   GLN  32           HA       GLN  32   9.112  -1.509   6.302
  230    HB2  GLN  32           2HB      GLN  32  10.266  -3.520   4.361
  231    HB3  GLN  32           1HB      GLN  32  11.200  -2.280   5.183
  232    HG2  GLN  32           2HG      GLN  32  10.625  -3.260   7.336
  233    HG3  GLN  32           1HG      GLN  32   9.662  -4.493   6.522
  234   HE21  GLN  32          1HE2      GLN  32  10.700  -6.121   5.369
  235   HE22  GLN  32          2HE2      GLN  32  12.379  -6.469   5.579
  236    H    ASN  33           H        ASN  33   9.370  -2.449   2.871
  237    HA   ASN  33           HA       ASN  33   8.448   0.132   1.989
  238    HB2  ASN  33           2HB      ASN  33  10.549   0.688   0.784
  239    HB3  ASN  33           1HB      ASN  33  10.740   0.710   2.535
  240   HD21  ASN  33          1HD2      ASN  33  11.958  -0.882   3.534
  241   HD22  ASN  33          2HD2      ASN  33  13.038  -1.904   2.656
  242    H    ASN  34           H        ASN  34   8.088  -2.877   1.670
  243    HA   ASN  34           HA       ASN  34   8.486  -3.130  -1.220
  244    HB2  ASN  34           2HB      ASN  34   7.729  -5.180   0.858
  245    HB3  ASN  34           1HB      ASN  34   7.893  -5.519  -0.859
  246   HD21  ASN  34          1HD2      ASN  34   9.530  -7.007  -0.493
  247   HD22  ASN  34          2HD2      ASN  34  11.130  -6.524  -0.052
  248    H    VAL  35           H        VAL  35   6.870  -2.693  -2.544
  249    HA   VAL  35           HA       VAL  35   4.161  -2.475  -1.498
  250    HB   VAL  35           HB       VAL  35   4.377  -0.650  -2.819
  251   HG11  VAL  35          1HG1      VAL  35   6.353  -2.239  -4.414
  252   HG12  VAL  35          2HG1      VAL  35   6.619  -0.798  -3.432
  253   HG13  VAL  35          3HG1      VAL  35   5.755  -0.674  -4.964
  254   HG21  VAL  35          3HG2      VAL  35   3.830  -2.523  -5.103
  255   HG22  VAL  35          1HG2      VAL  35   3.250  -0.872  -4.875
  256   HG23  VAL  35          2HG2      VAL  35   2.637  -2.173  -3.853
  257    H    GLU  36           H        GLU  36   6.063  -4.563  -3.530
  258    HA   GLU  36           HA       GLU  36   4.049  -5.850  -4.960
  259    HB2  GLU  36           2HB      GLU  36   6.700  -6.834  -3.945
  260    HB3  GLU  36           1HB      GLU  36   5.651  -7.828  -4.944
  261    HG2  GLU  36           2HG      GLU  36   7.254  -6.833  -6.374
  262    HG3  GLU  36           1HG      GLU  36   5.716  -6.020  -6.664
  263    H    VAL  37           H        VAL  37   5.482  -6.782  -1.829
  264    HA   VAL  37           HA       VAL  37   3.784  -8.968  -1.348
  265    HB   VAL  37           HB       VAL  37   5.825  -8.658  -0.054
  266   HG11  VAL  37          1HG1      VAL  37   4.457  -6.252   1.131
  267   HG12  VAL  37          2HG1      VAL  37   5.863  -6.241   0.068
  268   HG13  VAL  37          3HG1      VAL  37   5.985  -6.938   1.684
  269   HG21  VAL  37          3HG2      VAL  37   3.334  -8.560   1.643
  270   HG22  VAL  37          1HG2      VAL  37   4.927  -9.055   2.216
  271   HG23  VAL  37          2HG2      VAL  37   4.105  -9.998   0.974
  272    H    ALA  38           H        ALA  38   3.511  -5.543  -0.527
  273    HA   ALA  38           HA       ALA  38   1.168  -5.717   1.022
  274    HB1  ALA  38           3HB      ALA  38   2.379  -3.736   1.250
  275    HB2  ALA  38           1HB      ALA  38   0.957  -3.250   0.327
  276    HB3  ALA  38           2HB      ALA  38   2.498  -3.502  -0.493
  277    H    ARG  39           H        ARG  39   1.745  -5.548  -2.420
  278    HA   ARG  39           HA       ARG  39  -0.906  -4.901  -3.203
  279    HE   ARG  39           HE       ARG  39   0.070  -4.844  -7.384
  280    HB2  ARG  39           2HB      ARG  39   1.474  -6.068  -4.621
  281    HB3  ARG  39           1HB      ARG  39  -0.090  -5.984  -5.422
  282    HG2  ARG  39           2HG      ARG  39  -0.126  -3.599  -5.241
  283    HG3  ARG  39           1HG      ARG  39   1.327  -3.608  -4.241
  284    HD2  ARG  39           2HD      ARG  39   1.863  -2.987  -6.522
  285    HD3  ARG  39           1HD      ARG  39   2.606  -4.528  -6.099
  286   HH11  ARG  39          1HH1      ARG  39   3.468  -4.303  -7.931
  287   HH12  ARG  39          2HH1      ARG  39   3.450  -4.975  -9.527
  288   HH21  ARG  39          1HH2      ARG  39   0.037  -5.732  -9.484
  289   HH22  ARG  39          2HH2      ARG  39   1.501  -5.786 -10.410
  290    H    SER  40           H        SER  40   0.841  -7.920  -2.706
  291    HA   SER  40           HA       SER  40  -1.135  -9.661  -3.694
  292    HG   SER  40           HG       SER  40   2.113 -11.047  -3.287
  293    HB2  SER  40           2HB      SER  40   0.946 -10.145  -1.543
  294    HB3  SER  40           1HB      SER  40   0.023 -11.401  -2.368
  295    H    ILE  41           H        ILE  41  -0.586  -8.240  -0.510
  296    HA   ILE  41           HA       ILE  41  -2.780  -9.665   0.703
  297    HB   ILE  41           HB       ILE  41  -1.302  -7.258   1.773
  298   HG12  ILE  41          2HG1      ILE  41   0.278  -9.052   1.266
  299   HG13  ILE  41          1HG1      ILE  41   0.089  -8.877   3.007
  300   HG21  ILE  41          1HG2      ILE  41  -3.398  -7.679   2.911
  301   HG22  ILE  41          2HG2      ILE  41  -2.045  -8.099   3.962
  302   HG23  ILE  41          3HG2      ILE  41  -2.958  -9.369   3.147
  303   HD11  ILE  41          3HD1      ILE  41  -1.418 -10.809   3.023
  304   HD12  ILE  41          1HD1      ILE  41   0.176 -11.210   2.383
  305   HD13  ILE  41          2HD1      ILE  41  -1.186 -10.990   1.284
  306    H    LEU  42           H        LEU  42  -2.316  -6.629  -0.918
  307    HA   LEU  42           HA       LEU  42  -4.674  -5.344   0.052
  308    HG   LEU  42           HG       LEU  42  -3.495  -2.322  -1.670
  309    HB2  LEU  42           2HB      LEU  42  -2.500  -4.397  -1.101
  310    HB3  LEU  42           1HB      LEU  42  -3.412  -4.657  -2.572
  311   HD11  LEU  42          1HD1      LEU  42  -5.808  -1.992  -2.156
  312   HD12  LEU  42          2HD1      LEU  42  -6.188  -3.669  -1.766
  313   HD13  LEU  42          3HD1      LEU  42  -5.217  -3.293  -3.189
  314   HD21  LEU  42          3HD2      LEU  42  -5.180  -3.580   0.494
  315   HD22  LEU  42          1HD2      LEU  42  -4.927  -1.854   0.238
  316   HD23  LEU  42          2HD2      LEU  42  -3.575  -2.883   0.712
  317    H    ARG  43           H        ARG  43  -3.905  -7.424  -2.662
  318    HA   ARG  43           HA       ARG  43  -6.472  -7.025  -3.931
  319    HE   ARG  43           HE       ARG  43  -4.285  -7.542  -7.474
  320    HB2  ARG  43           2HB      ARG  43  -4.494  -7.421  -5.306
  321    HB3  ARG  43           1HB      ARG  43  -4.247  -8.984  -4.535
  322    HG2  ARG  43           2HG      ARG  43  -5.322  -9.712  -6.380
  323    HG3  ARG  43           1HG      ARG  43  -6.752  -9.307  -5.428
  324    HD2  ARG  43           2HD      ARG  43  -7.097  -8.317  -7.528
  325    HD3  ARG  43           1HD      ARG  43  -6.625  -7.021  -6.446
  326   HH11  ARG  43          1HH1      ARG  43  -7.364  -7.487  -9.103
  327   HH12  ARG  43          2HH1      ARG  43  -6.692  -7.023 -10.631
  328   HH21  ARG  43          1HH2      ARG  43  -3.392  -6.928  -9.484
  329   HH22  ARG  43          2HH2      ARG  43  -4.437  -6.705 -10.847
  330    H    GLU  44           H        GLU  44  -4.942  -9.385  -1.837
  331    HA   GLU  44           HA       GLU  44  -7.118 -11.275  -2.098
  332    HB2  GLU  44           2HB      GLU  44  -4.682 -11.233  -0.313
  333    HB3  GLU  44           1HB      GLU  44  -5.870 -12.529  -0.319
  334    HG2  GLU  44           2HG      GLU  44  -4.180 -11.684  -2.662
  335    HG3  GLU  44           1HG      GLU  44  -3.901 -13.091  -1.639
  336    H    PHE  45           H        PHE  45  -7.418  -8.468  -0.941
  337    HA   PHE  45           HA       PHE  45  -8.654  -7.434   0.660
  338    HD1  PHE  45           2HD      PHE  45  -9.742 -10.634  -1.334
  339    HD2  PHE  45           1HD      PHE  45 -11.810  -7.365   0.441
  340    HE1  PHE  45           2HE      PHE  45 -11.085 -10.377  -3.380
  341    HE2  PHE  45           1HE      PHE  45 -13.157  -7.104  -1.600
  342    HZ   PHE  45           HZ       PHE  45 -12.795  -8.610  -3.515
  343    HB2  PHE  45           2HB      PHE  45  -9.716 -10.231   1.108
  344    HB3  PHE  45           1HB      PHE  45 -10.432  -8.763   1.765
  345    H    ALA  46           H        ALA  46  -9.402  -7.897   3.172
  346    HA   ALA  46           HA       ALA  46  -6.854  -8.173   4.549
  347    HB1  ALA  46           3HB      ALA  46  -8.216  -6.221   5.045
  348    HB2  ALA  46           1HB      ALA  46  -8.027  -7.227   6.480
  349    HB3  ALA  46           2HB      ALA  46  -9.538  -7.261   5.573
  Start of MODEL   12
    1    HA   ALA   3           HA       ALA   3  10.462  10.997   4.689
    2    HB1  ALA   3           3HB      ALA   3  10.576   8.042   5.285
    3    HB2  ALA   3           1HB      ALA   3   9.851   9.281   6.312
    4    HB3  ALA   3           2HB      ALA   3  11.590   9.286   6.016
    5    H    LEU   4           H        LEU   4  12.170  11.598   3.559
    6    HA   LEU   4           HA       LEU   4  13.906  11.624   2.100
    7    HG   LEU   4           HG       LEU   4  15.359   9.351   0.646
    8    HB2  LEU   4           2HB      LEU   4  14.748   9.831   3.565
    9    HB3  LEU   4           1HB      LEU   4  13.930   8.641   2.570
   10   HD11  LEU   4          1HD1      LEU   4  15.910  11.596   1.421
   11   HD12  LEU   4          2HD1      LEU   4  17.369  10.654   1.111
   12   HD13  LEU   4          3HD1      LEU   4  16.823  10.915   2.767
   13   HD21  LEU   4          3HD2      LEU   4  16.775   8.356   3.116
   14   HD22  LEU   4          1HD2      LEU   4  17.393   8.234   1.468
   15   HD23  LEU   4          2HD2      LEU   4  15.921   7.376   1.923
   16    H    GLU   5           H        GLU   5  12.917   8.385   1.107
   17    HA   GLU   5           HA       GLU   5  12.803   9.132  -1.629
   18    HB2  GLU   5           2HB      GLU   5  12.048   6.853  -2.031
   19    HB3  GLU   5           1HB      GLU   5  13.387   6.856  -0.892
   20    HG2  GLU   5           2HG      GLU   5  11.818   6.581   0.958
   21    HG3  GLU   5           1HG      GLU   5  10.473   6.584  -0.183
   22    H    ASN   6           H        ASN   6  10.877   8.748  -3.017
   23    HA   ASN   6           HA       ASN   6   8.658  10.260  -2.005
   24    HB2  ASN   6           2HB      ASN   6   9.037   8.867  -4.666
   25    HB3  ASN   6           1HB      ASN   6   7.741   9.997  -4.285
   26   HD21  ASN   6          1HD2      ASN   6   8.202  12.184  -4.096
   27   HD22  ASN   6          2HD2      ASN   6   9.681  12.868  -4.671
   28    H    VAL   7           H        VAL   7   8.182   8.666  -0.277
   29    HA   VAL   7           HA       VAL   7   7.236   6.081  -0.767
   30    HB   VAL   7           HB       VAL   7   6.089   6.258   1.421
   31   HG11  VAL   7          1HG1      VAL   7   8.902   7.339   1.330
   32   HG12  VAL   7          2HG1      VAL   7   8.422   5.642   1.353
   33   HG13  VAL   7          3HG1      VAL   7   8.118   6.662   2.759
   34   HG21  VAL   7          3HG2      VAL   7   6.307   8.316   2.734
   35   HG22  VAL   7          1HG2      VAL   7   5.354   8.579   1.273
   36   HG23  VAL   7          2HG2      VAL   7   7.029   9.125   1.343
   37    H    ASP   8           H        ASP   8   5.638   9.195  -0.940
   38    HA   ASP   8           HA       ASP   8   2.969   8.432  -0.937
   39    HB2  ASP   8           2HB      ASP   8   3.733  10.778  -0.923
   40    HB3  ASP   8           1HB      ASP   8   4.261  10.608  -2.594
   41    H    ALA   9           H        ALA   9   5.284   8.477  -3.622
   42    HA   ALA   9           HA       ALA   9   3.524   7.827  -5.692
   43    HB1  ALA   9           3HB      ALA   9   5.808   8.548  -6.111
   44    HB2  ALA   9           1HB      ALA   9   5.510   6.987  -6.878
   45    HB3  ALA   9           2HB      ALA   9   6.426   7.071  -5.373
   46    H    LYS  10           H        LYS  10   5.162   5.813  -3.327
   47    HA   LYS  10           HA       LYS  10   4.406   3.323  -4.489
   48    HB2  LYS  10           2HB      LYS  10   5.065   3.800  -1.585
   49    HB3  LYS  10           1HB      LYS  10   5.266   2.317  -2.503
   50    HG2  LYS  10           2HG      LYS  10   6.882   4.844  -2.681
   51    HG3  LYS  10           1HG      LYS  10   7.423   3.234  -2.210
   52    HD2  LYS  10           2HD      LYS  10   6.447   4.005  -4.960
   53    HD3  LYS  10           1HD      LYS  10   8.142   3.860  -4.492
   54    HE2  LYS  10           2HE      LYS  10   7.735   1.488  -3.928
   55    HE3  LYS  10           1HE      LYS  10   6.076   1.669  -4.498
   56    HZ1  LYS  10           3HZ      LYS  10   7.489   0.696  -6.195
   57    HZ2  LYS  10           1HZ      LYS  10   8.518   2.038  -6.148
   58    HZ3  LYS  10           2HZ      LYS  10   6.926   2.211  -6.693
   59    H    ILE  11           H        ILE  11   3.073   5.432  -2.003
   60    HA   ILE  11           HA       ILE  11   1.015   3.754  -1.109
   61    HB   ILE  11           HB       ILE  11   0.991   6.772  -1.281
   62   HG12  ILE  11          2HG1      ILE  11   1.883   4.905   0.932
   63   HG13  ILE  11          1HG1      ILE  11   2.917   5.962  -0.020
   64   HG21  ILE  11          1HG2      ILE  11  -0.490   5.362   0.837
   65   HG22  ILE  11          2HG2      ILE  11  -1.123   5.154  -0.796
   66   HG23  ILE  11          3HG2      ILE  11  -0.944   6.776  -0.117
   67   HD11  ILE  11          3HD1      ILE  11   2.552   6.932   2.141
   68   HD12  ILE  11          1HD1      ILE  11   0.804   6.813   1.942
   69   HD13  ILE  11          2HD1      ILE  11   1.736   7.911   0.923
   70    H    ALA  12           H        ALA  12   0.862   6.441  -3.447
   71    HA   ALA  12           HA       ALA  12  -1.722   6.035  -4.358
   72    HB1  ALA  12           3HB      ALA  12  -1.023   7.221  -6.395
   73    HB2  ALA  12           1HB      ALA  12   0.665   7.019  -5.926
   74    HB3  ALA  12           2HB      ALA  12  -0.412   8.010  -4.942
   75    H    LYS  13           H        LYS  13   1.303   4.500  -5.267
   76    HA   LYS  13           HA       LYS  13   0.502   3.060  -7.497
   77    HB2  LYS  13           2HB      LYS  13   2.830   3.194  -6.609
   78    HB3  LYS  13           1HB      LYS  13   2.368   2.084  -5.327
   79    HG2  LYS  13           2HG      LYS  13   3.540   0.922  -7.104
   80    HG3  LYS  13           1HG      LYS  13   1.870   0.364  -6.985
   81    HD2  LYS  13           2HD      LYS  13   1.238   1.505  -8.933
   82    HD3  LYS  13           1HD      LYS  13   2.674   2.528  -8.899
   83    HE2  LYS  13           2HE      LYS  13   4.069   0.604  -9.389
   84    HE3  LYS  13           1HE      LYS  13   2.647  -0.438  -9.415
   85    HZ1  LYS  13           3HZ      LYS  13   1.798   0.868 -11.284
   86    HZ2  LYS  13           1HZ      LYS  13   3.295   0.167 -11.648
   87    HZ3  LYS  13           2HZ      LYS  13   3.202   1.814 -11.274
   88    H    LEU  14           H        LEU  14   0.032   2.426  -4.061
   89    HA   LEU  14           HA       LEU  14  -1.253  -0.122  -4.523
   90    HG   LEU  14           HG       LEU  14  -0.512  -1.402  -2.935
   91    HB2  LEU  14           2HB      LEU  14  -0.433   1.469  -2.203
   92    HB3  LEU  14           1HB      LEU  14  -1.961   0.643  -1.975
   93   HD11  LEU  14          1HD1      LEU  14   1.435   0.503  -1.691
   94   HD12  LEU  14          2HD1      LEU  14   1.573  -0.399  -3.200
   95   HD13  LEU  14          3HD1      LEU  14   1.698  -1.239  -1.657
   96   HD21  LEU  14          3HD2      LEU  14  -0.435  -0.529  -0.054
   97   HD22  LEU  14          1HD2      LEU  14  -0.313  -2.174  -0.676
   98   HD23  LEU  14          2HD2      LEU  14  -1.826  -1.283  -0.833
   99    H    MET  15           H        MET  15  -2.194   3.207  -4.058
  100    HA   MET  15           HA       MET  15  -4.938   2.799  -3.530
  101    HB2  MET  15           2HB      MET  15  -3.521   5.158  -4.782
  102    HB3  MET  15           1HB      MET  15  -5.190   5.171  -4.229
  103    HG2  MET  15           2HG      MET  15  -4.483   4.791  -1.956
  104    HG3  MET  15           1HG      MET  15  -2.805   4.638  -2.473
  105    HE1  MET  15           3HE      MET  15  -5.869   7.071  -2.090
  106    HE2  MET  15           1HE      MET  15  -5.482   7.194  -3.807
  107    HE3  MET  15           2HE      MET  15  -5.207   8.571  -2.740
  108    H    GLY  16           H        GLY  16  -3.078   2.480  -6.378
  109    HA2  GLY  16           2HA      GLY  16  -4.751   3.126  -8.452
  110    HA3  GLY  16           1HA      GLY  16  -3.688   1.724  -8.464
  111    H    GLU  17           H        GLU  17  -4.680   0.011  -6.768
  112    HA   GLU  17           HA       GLU  17  -6.882  -1.133  -8.058
  113    HB2  GLU  17           2HB      GLU  17  -5.696  -1.627  -5.329
  114    HB3  GLU  17           1HB      GLU  17  -6.985  -2.612  -6.013
  115    HG2  GLU  17           2HG      GLU  17  -5.625  -3.514  -7.636
  116    HG3  GLU  17           1HG      GLU  17  -4.465  -2.179  -7.545
  117    H    GLY  18           H        GLY  18  -6.687   0.474  -4.888
  118    HA2  GLY  18           2HA      GLY  18  -8.334   2.075  -4.192
  119    HA3  GLY  18           1HA      GLY  18  -9.519   1.226  -5.176
  120    H    TYR  19           H        TYR  19  -8.035   1.492  -2.103
  121    HA   TYR  19           HA       TYR  19 -10.008  -0.271  -0.948
  122    HD1  TYR  19           2HD      TYR  19 -10.270  -2.611  -1.463
  123    HD2  TYR  19           1HD      TYR  19  -7.450  -2.304   1.709
  124    HE1  TYR  19           2HE      TYR  19 -11.396  -4.456  -0.291
  125    HE2  TYR  19           1HE      TYR  19  -8.568  -4.150   2.889
  126    HH   TYR  19           HH       TYR  19 -10.797  -5.212   2.953
  127    HB2  TYR  19           2HB      TYR  19  -7.772  -1.556  -1.648
  128    HB3  TYR  19           1HB      TYR  19  -7.222  -0.909  -0.108
  129    H    ALA  20           H        ALA  20  -9.236  -0.474   1.593
  130    HA   ALA  20           HA       ALA  20  -9.652   2.040   2.693
  131    HB1  ALA  20           3HB      ALA  20  -9.831  -0.295   3.779
  132    HB2  ALA  20           1HB      ALA  20  -9.335   1.067   4.785
  133    HB3  ALA  20           2HB      ALA  20  -8.128  -0.069   4.182
  134    H    PHE  21           H        PHE  21  -8.341   3.657   3.451
  135    HA   PHE  21           HA       PHE  21  -5.724   3.837   2.304
  136    HD1  PHE  21           1HD      PHE  21  -5.902   6.328   0.882
  137    HD2  PHE  21           2HD      PHE  21  -9.243   5.865   3.476
  138    HE1  PHE  21           1HE      PHE  21  -7.381   7.217  -0.872
  139    HE2  PHE  21           2HE      PHE  21 -10.729   6.752   1.727
  140    HZ   PHE  21           HZ       PHE  21  -9.799   7.430  -0.451
  141    HB2  PHE  21           2HB      PHE  21  -7.039   5.671   4.323
  142    HB3  PHE  21           1HB      PHE  21  -5.637   6.047   3.327
  143    H    GLU  22           H        GLU  22  -7.076   3.282   5.485
  144    HA   GLU  22           HA       GLU  22  -4.683   3.461   6.964
  145    HB2  GLU  22           2HB      GLU  22  -7.120   3.382   7.800
  146    HB3  GLU  22           1HB      GLU  22  -6.968   1.636   7.681
  147    HG2  GLU  22           2HG      GLU  22  -5.143   3.379   9.316
  148    HG3  GLU  22           1HG      GLU  22  -6.568   2.560   9.952
  149    H    GLU  23           H        GLU  23  -6.293   0.736   5.369
  150    HA   GLU  23           HA       GLU  23  -4.499  -1.250   6.285
  151    HB2  GLU  23           2HB      GLU  23  -6.411  -1.160   3.962
  152    HB3  GLU  23           1HB      GLU  23  -5.451  -2.583   4.352
  153    HG2  GLU  23           2HG      GLU  23  -6.453  -2.532   6.634
  154    HG3  GLU  23           1HG      GLU  23  -7.533  -1.259   6.067
  155    H    VAL  24           H        VAL  24  -4.488   0.856   3.463
  156    HA   VAL  24           HA       VAL  24  -2.471  -0.475   2.013
  157    HB   VAL  24           HB       VAL  24  -3.374   2.400   1.980
  158   HG11  VAL  24          1HG1      VAL  24  -1.482   1.090   0.033
  159   HG12  VAL  24          2HG1      VAL  24  -0.995   2.229   1.283
  160   HG13  VAL  24          3HG1      VAL  24  -2.067   2.750  -0.014
  161   HG21  VAL  24          3HG2      VAL  24  -3.706   0.305  -0.147
  162   HG22  VAL  24          1HG2      VAL  24  -4.571   1.830   0.034
  163   HG23  VAL  24          2HG2      VAL  24  -4.868   0.507   1.162
  164    H    LYS  25           H        LYS  25  -2.189   2.533   3.936
  165    HA   LYS  25           HA       LYS  25   0.585   2.723   3.815
  166    HB2  LYS  25           2HB      LYS  25  -1.406   3.725   5.832
  167    HB3  LYS  25           1HB      LYS  25   0.316   4.020   6.021
  168    HG2  LYS  25           2HG      LYS  25  -0.531   5.938   4.990
  169    HG3  LYS  25           1HG      LYS  25   0.259   5.029   3.708
  170    HD2  LYS  25           2HD      LYS  25  -1.855   4.216   2.900
  171    HD3  LYS  25           1HD      LYS  25  -2.695   4.922   4.282
  172    HE2  LYS  25           2HE      LYS  25  -2.155   7.149   3.534
  173    HE3  LYS  25           1HE      LYS  25  -1.178   6.504   2.215
  174    HZ1  LYS  25           3HZ      LYS  25  -4.108   6.127   2.530
  175    HZ2  LYS  25           1HZ      LYS  25  -3.167   5.537   1.253
  176    HZ3  LYS  25           2HZ      LYS  25  -3.368   7.205   1.457
  177    H    ARG  26           H        ARG  26  -1.409   1.144   6.330
  178    HA   ARG  26           HA       ARG  26   0.748   0.387   7.962
  179    HE   ARG  26           HE       ARG  26  -3.400  -0.756   9.627
  180    HB2  ARG  26           2HB      ARG  26  -0.742  -1.120   9.058
  181    HB3  ARG  26           1HB      ARG  26  -1.678   0.299   8.614
  182    HG2  ARG  26           2HG      ARG  26  -2.919  -0.835   7.071
  183    HG3  ARG  26           1HG      ARG  26  -1.650  -2.016   6.752
  184    HD2  ARG  26           2HD      ARG  26  -3.572  -2.981   7.960
  185    HD3  ARG  26           1HD      ARG  26  -2.059  -3.100   8.855
  186   HH11  ARG  26          1HH1      ARG  26  -3.679  -4.218   9.896
  187   HH12  ARG  26          2HH1      ARG  26  -4.520  -4.162  11.408
  188   HH21  ARG  26          1HH2      ARG  26  -4.506  -0.673  11.621
  189   HH22  ARG  26          2HH2      ARG  26  -4.990  -2.147  12.389
  190    H    ALA  27           H        ALA  27  -0.602  -1.036   5.069
  191    HA   ALA  27           HA       ALA  27   0.779  -3.528   5.298
  192    HB1  ALA  27           3HB      ALA  27  -1.235  -3.367   3.960
  193    HB2  ALA  27           1HB      ALA  27   0.122  -3.849   2.941
  194    HB3  ALA  27           2HB      ALA  27  -0.467  -2.187   2.898
  195    H    LEU  28           H        LEU  28   1.560  -0.373   4.139
  196    HA   LEU  28           HA       LEU  28   3.839  -1.193   2.584
  197    HG   LEU  28           HG       LEU  28   1.810   0.235   1.370
  198    HB2  LEU  28           2HB      LEU  28   2.690   1.449   3.424
  199    HB3  LEU  28           1HB      LEU  28   4.280   1.351   2.682
  200   HD11  LEU  28          1HD1      LEU  28   3.037   2.838   0.591
  201   HD12  LEU  28          2HD1      LEU  28   1.889   2.785   1.927
  202   HD13  LEU  28          3HD1      LEU  28   1.399   2.239   0.321
  203   HD21  LEU  28          3HD2      LEU  28   4.351   1.160   0.076
  204   HD22  LEU  28          1HD2      LEU  28   3.125   0.060  -0.550
  205   HD23  LEU  28          2HD2      LEU  28   4.205  -0.464   0.742
  206    H    GLU  29           H        GLU  29   3.313   0.405   5.707
  207    HA   GLU  29           HA       GLU  29   6.027   0.770   6.340
  208    HB2  GLU  29           2HB      GLU  29   4.198   1.976   7.458
  209    HB3  GLU  29           1HB      GLU  29   3.667   0.475   8.204
  210    HG2  GLU  29           2HG      GLU  29   4.901   1.753   9.805
  211    HG3  GLU  29           1HG      GLU  29   5.840   0.327   9.366
  212    H    ILE  30           H        ILE  30   3.732  -1.690   7.526
  213    HA   ILE  30           HA       ILE  30   5.525  -3.191   9.034
  214    HB   ILE  30           HB       ILE  30   3.106  -4.197   7.536
  215   HG12  ILE  30          2HG1      ILE  30   3.400  -3.204  10.381
  216   HG13  ILE  30          1HG1      ILE  30   2.644  -2.306   9.071
  217   HG21  ILE  30          1HG2      ILE  30   3.924  -5.459  10.061
  218   HG22  ILE  30          2HG2      ILE  30   5.025  -5.711   8.708
  219   HG23  ILE  30          3HG2      ILE  30   3.332  -6.187   8.566
  220   HD11  ILE  30          3HD1      ILE  30   0.987  -3.337  10.521
  221   HD12  ILE  30          1HD1      ILE  30   1.675  -4.927  10.191
  222   HD13  ILE  30          2HD1      ILE  30   0.912  -4.010   8.892
  223    H    ALA  31           H        ALA  31   4.711  -3.466   5.594
  224    HA   ALA  31           HA       ALA  31   6.303  -5.800   5.182
  225    HB1  ALA  31           3HB      ALA  31   4.363  -5.192   3.767
  226    HB2  ALA  31           1HB      ALA  31   5.831  -5.516   2.843
  227    HB3  ALA  31           2HB      ALA  31   5.307  -3.854   3.112
  228    H    GLN  32           H        GLN  32   7.483  -3.113   6.223
  229    HA   GLN  32           HA       GLN  32   9.467  -2.009   6.110
  230    HB2  GLN  32           2HB      GLN  32  10.402  -4.355   4.451
  231    HB3  GLN  32           1HB      GLN  32  11.401  -3.249   5.383
  232    HG2  GLN  32           2HG      GLN  32  10.300  -4.068   7.441
  233    HG3  GLN  32           1HG      GLN  32   9.444  -5.258   6.463
  234   HE21  GLN  32          1HE2      GLN  32  12.514  -4.285   7.762
  235   HE22  GLN  32          2HE2      GLN  32  13.347  -5.766   7.451
  236    H    ASN  33           H        ASN  33   7.684  -1.016   4.380
  237    HA   ASN  33           HA       ASN  33   7.421   0.253   2.516
  238    HB2  ASN  33           2HB      ASN  33  10.447   0.203   2.518
  239    HB3  ASN  33           1HB      ASN  33   9.448   1.320   1.594
  240   HD21  ASN  33          1HD2      ASN  33  11.442   1.843   3.660
  241   HD22  ASN  33          2HD2      ASN  33  10.629   2.744   4.890
  242    H    ASN  34           H        ASN  34   6.778  -2.146   1.855
  243    HA   ASN  34           HA       ASN  34   8.089  -2.624  -0.732
  244    HB2  ASN  34           2HB      ASN  34   7.231  -4.676   1.298
  245    HB3  ASN  34           1HB      ASN  34   7.548  -5.079  -0.385
  246   HD21  ASN  34          1HD2      ASN  34   9.695  -3.085  -0.575
  247   HD22  ASN  34          2HD2      ASN  34  11.046  -3.773   0.253
  248    H    VAL  35           H        VAL  35   6.610  -1.792  -2.074
  249    HA   VAL  35           HA       VAL  35   3.823  -1.856  -1.680
  250    HB   VAL  35           HB       VAL  35   4.409  -0.176  -3.127
  251   HG11  VAL  35          1HG1      VAL  35   6.343  -2.136  -4.275
  252   HG12  VAL  35          2HG1      VAL  35   6.620  -0.526  -3.609
  253   HG13  VAL  35          3HG1      VAL  35   5.874  -0.705  -5.196
  254   HG21  VAL  35          3HG2      VAL  35   3.749  -2.337  -5.120
  255   HG22  VAL  35          1HG2      VAL  35   3.460  -0.605  -5.282
  256   HG23  VAL  35          2HG2      VAL  35   2.559  -1.544  -4.092
  257    H    GLU  36           H        GLU  36   6.030  -4.097  -3.204
  258    HA   GLU  36           HA       GLU  36   4.209  -5.575  -4.728
  259    HB2  GLU  36           2HB      GLU  36   6.712  -6.511  -3.334
  260    HB3  GLU  36           1HB      GLU  36   5.858  -7.414  -4.574
  261    HG2  GLU  36           2HG      GLU  36   7.130  -4.711  -4.946
  262    HG3  GLU  36           1HG      GLU  36   7.825  -6.252  -5.450
  263    H    VAL  37           H        VAL  37   5.516  -6.484  -1.526
  264    HA   VAL  37           HA       VAL  37   3.780  -8.606  -1.051
  265    HB   VAL  37           HB       VAL  37   4.929  -6.753   1.044
  266   HG11  VAL  37          1HG1      VAL  37   3.168  -8.262   1.858
  267   HG12  VAL  37          2HG1      VAL  37   4.747  -8.651   2.539
  268   HG13  VAL  37          3HG1      VAL  37   4.080  -9.640   1.240
  269   HG21  VAL  37          3HG2      VAL  37   6.645  -7.622  -0.506
  270   HG22  VAL  37          1HG2      VAL  37   6.130  -9.264  -0.119
  271   HG23  VAL  37          2HG2      VAL  37   6.834  -8.241   1.135
  272    H    ALA  38           H        ALA  38   3.459  -5.187  -0.150
  273    HA   ALA  38           HA       ALA  38   1.049  -5.355   1.238
  274    HB1  ALA  38           3HB      ALA  38   2.225  -3.347   1.437
  275    HB2  ALA  38           1HB      ALA  38   0.814  -2.916   0.470
  276    HB3  ALA  38           2HB      ALA  38   2.379  -3.161  -0.309
  277    H    ARG  39           H        ARG  39   1.722  -5.017  -2.210
  278    HA   ARG  39           HA       ARG  39  -0.975  -4.649  -3.011
  279    HE   ARG  39           HE       ARG  39  -0.116  -4.624  -7.082
  280    HB2  ARG  39           2HB      ARG  39   1.576  -5.334  -4.426
  281    HB3  ARG  39           1HB      ARG  39   0.044  -5.542  -5.270
  282    HG2  ARG  39           2HG      ARG  39  -0.485  -3.182  -4.861
  283    HG3  ARG  39           1HG      ARG  39   1.073  -2.989  -4.055
  284    HD2  ARG  39           2HD      ARG  39   1.287  -2.205  -6.304
  285    HD3  ARG  39           1HD      ARG  39   2.185  -3.712  -6.138
  286   HH11  ARG  39          1HH1      ARG  39   1.767  -1.865  -8.073
  287   HH12  ARG  39          2HH1      ARG  39   1.256  -1.947  -9.726
  288   HH21  ARG  39          1HH2      ARG  39  -0.793  -4.743  -9.256
  289   HH22  ARG  39          2HH2      ARG  39  -0.200  -3.583 -10.399
  290    H    SER  40           H        SER  40   1.056  -7.453  -2.475
  291    HA   SER  40           HA       SER  40  -0.487  -9.407  -3.734
  292    HG   SER  40           HG       SER  40   1.266 -11.878  -2.486
  293    HB2  SER  40           2HB      SER  40   1.761  -9.859  -2.850
  294    HB3  SER  40           1HB      SER  40   1.161  -9.661  -1.204
  295    H    ILE  41           H        ILE  41  -0.643  -8.142  -0.419
  296    HA   ILE  41           HA       ILE  41  -2.978  -9.732   0.189
  297    HB   ILE  41           HB       ILE  41  -1.328  -9.177   1.944
  298   HG12  ILE  41          2HG1      ILE  41  -2.984  -8.456   3.676
  299   HG13  ILE  41          1HG1      ILE  41  -4.127  -8.110   2.382
  300   HG21  ILE  41          1HG2      ILE  41  -0.734  -6.935   1.221
  301   HG22  ILE  41          2HG2      ILE  41  -1.274  -6.921   2.899
  302   HG23  ILE  41          3HG2      ILE  41  -2.351  -6.360   1.621
  303   HD11  ILE  41          3HD1      ILE  41  -4.584 -10.257   3.408
  304   HD12  ILE  41          1HD1      ILE  41  -2.950 -10.802   3.029
  305   HD13  ILE  41          2HD1      ILE  41  -4.089 -10.461   1.727
  306    H    LEU  42           H        LEU  42  -2.305  -6.600  -1.088
  307    HA   LEU  42           HA       LEU  42  -4.748  -5.321  -0.425
  308    HG   LEU  42           HG       LEU  42  -3.309  -2.307  -1.907
  309    HB2  LEU  42           2HB      LEU  42  -2.398  -4.509  -1.537
  310    HB3  LEU  42           1HB      LEU  42  -3.432  -4.541  -2.948
  311   HD11  LEU  42          1HD1      LEU  42  -5.704  -1.866  -1.851
  312   HD12  LEU  42          2HD1      LEU  42  -6.032  -3.593  -1.705
  313   HD13  LEU  42          3HD1      LEU  42  -5.296  -2.956  -3.177
  314   HD21  LEU  42          3HD2      LEU  42  -4.657  -3.643   0.440
  315   HD22  LEU  42          1HD2      LEU  42  -4.391  -1.911   0.247
  316   HD23  LEU  42          2HD2      LEU  42  -3.015  -3.001   0.412
  317    H    ARG  43           H        ARG  43  -3.768  -7.512  -2.940
  318    HA   ARG  43           HA       ARG  43  -6.188  -7.098  -4.493
  319    HE   ARG  43           HE       ARG  43  -3.970  -8.495  -8.172
  320    HB2  ARG  43           2HB      ARG  43  -3.921  -9.072  -4.852
  321    HB3  ARG  43           1HB      ARG  43  -5.249  -8.828  -5.979
  322    HG2  ARG  43           2HG      ARG  43  -3.700  -6.434  -5.260
  323    HG3  ARG  43           1HG      ARG  43  -2.878  -7.645  -6.248
  324    HD2  ARG  43           2HD      ARG  43  -5.597  -6.563  -6.874
  325    HD3  ARG  43           1HD      ARG  43  -4.127  -5.843  -7.501
  326   HH11  ARG  43          1HH1      ARG  43  -6.233  -5.909  -8.751
  327   HH12  ARG  43          2HH1      ARG  43  -6.752  -6.533 -10.282
  328   HH21  ARG  43          1HH2      ARG  43  -4.648  -9.327 -10.182
  329   HH22  ARG  43          2HH2      ARG  43  -5.850  -8.478 -11.096
  330    H    GLU  44           H        GLU  44  -4.956  -9.214  -2.059
  331    HA   GLU  44           HA       GLU  44  -6.517 -11.492  -2.449
  332    HB2  GLU  44           2HB      GLU  44  -4.640 -11.335  -0.847
  333    HB3  GLU  44           1HB      GLU  44  -5.618 -10.295   0.179
  334    HG2  GLU  44           2HG      GLU  44  -5.579 -12.573   1.014
  335    HG3  GLU  44           1HG      GLU  44  -7.206 -12.103   0.525
  336    H    PHE  45           H        PHE  45  -7.339  -8.370  -1.147
  337    HA   PHE  45           HA       PHE  45 -10.097  -9.321  -0.742
  338    HD1  PHE  45           2HD      PHE  45 -10.859 -10.216   1.433
  339    HD2  PHE  45           1HD      PHE  45  -7.140  -8.359   2.342
  340    HE1  PHE  45           2HE      PHE  45 -10.344 -12.031   3.011
  341    HE2  PHE  45           1HE      PHE  45  -6.616 -10.172   3.922
  342    HZ   PHE  45           HZ       PHE  45  -8.220 -12.011   4.258
  343    HB2  PHE  45           2HB      PHE  45  -8.600  -7.293   0.931
  344    HB3  PHE  45           1HB      PHE  45 -10.317  -7.649   1.085
  345    H    ALA  46           H        ALA  46 -11.535  -8.325  -1.979
  346    HA   ALA  46           HA       ALA  46 -11.403  -5.516  -2.540
  347    HB1  ALA  46           3HB      ALA  46  -9.791  -6.326  -4.182
  348    HB2  ALA  46           1HB      ALA  46 -11.238  -5.695  -4.969
  349    HB3  ALA  46           2HB      ALA  46 -11.000  -7.436  -4.828
  Start of MODEL   13
    1    HA   ALA   3           HA       ALA   3  12.849  14.565  -4.552
    2    HB1  ALA   3           3HB      ALA   3  11.040  15.978  -3.765
    3    HB2  ALA   3           1HB      ALA   3  11.582  17.289  -4.813
    4    HB3  ALA   3           2HB      ALA   3  12.595  16.754  -3.472
    5    H    LEU   4           H        LEU   4  12.143  13.068  -5.976
    6    HA   LEU   4           HA       LEU   4  10.067  13.920  -7.883
    7    HG   LEU   4           HG       LEU   4  13.067  14.067  -8.667
    8    HB2  LEU   4           2HB      LEU   4  12.161  11.787  -8.316
    9    HB3  LEU   4           1HB      LEU   4  10.851  12.160  -9.419
   10   HD11  LEU   4          1HD1      LEU   4  13.910  12.201  -9.981
   11   HD12  LEU   4          2HD1      LEU   4  13.887  13.682 -10.939
   12   HD13  LEU   4          3HD1      LEU   4  12.642  12.456 -11.180
   13   HD21  LEU   4          3HD2      LEU   4  10.996  15.208  -9.245
   14   HD22  LEU   4          1HD2      LEU   4  10.879  14.269 -10.733
   15   HD23  LEU   4          2HD2      LEU   4  12.199  15.419 -10.517
   16    H    GLU   5           H        GLU   5  11.364  10.750  -6.929
   17    HA   GLU   5           HA       GLU   5   8.623   9.884  -6.355
   18    HB2  GLU   5           2HB      GLU   5   9.532   7.597  -6.487
   19    HB3  GLU   5           1HB      GLU   5   9.850   8.516  -7.951
   20    HG2  GLU   5           2HG      GLU   5  12.137   8.926  -7.200
   21    HG3  GLU   5           1HG      GLU   5  11.818   7.999  -5.734
   22    H    ASN   6           H        ASN   6   7.966   9.253  -4.372
   23    HA   ASN   6           HA       ASN   6   9.938   8.873  -2.252
   24    HB2  ASN   6           2HB      ASN   6   7.666  10.864  -2.063
   25    HB3  ASN   6           1HB      ASN   6   8.732  10.407  -0.737
   26   HD21  ASN   6          1HD2      ASN   6  10.902  11.052  -0.794
   27   HD22  ASN   6          2HD2      ASN   6  11.427  12.367  -1.784
   28    H    VAL   7           H        VAL   7   8.240   8.736  -0.095
   29    HA   VAL   7           HA       VAL   7   7.211   6.153  -0.271
   30    HB   VAL   7           HB       VAL   7   5.982   6.719   1.861
   31   HG11  VAL   7          1HG1      VAL   7   8.923   7.355   1.679
   32   HG12  VAL   7          2HG1      VAL   7   8.197   5.766   1.923
   33   HG13  VAL   7          3HG1      VAL   7   8.056   7.000   3.174
   34   HG21  VAL   7          3HG2      VAL   7   5.608   9.094   1.400
   35   HG22  VAL   7          1HG2      VAL   7   7.345   9.383   1.477
   36   HG23  VAL   7          2HG2      VAL   7   6.473   8.863   2.918
   37    H    ASP   8           H        ASP   8   5.609   9.276  -0.659
   38    HA   ASP   8           HA       ASP   8   2.951   8.454  -0.688
   39    HB2  ASP   8           2HB      ASP   8   4.237  10.632  -2.351
   40    HB3  ASP   8           1HB      ASP   8   2.514  10.477  -2.022
   41    H    ALA   9           H        ALA   9   5.273   8.630  -3.377
   42    HA   ALA   9           HA       ALA   9   3.603   7.889  -5.458
   43    HB1  ALA   9           3HB      ALA   9   5.919   8.636  -5.768
   44    HB2  ALA   9           1HB      ALA   9   5.605   7.121  -6.614
   45    HB3  ALA   9           2HB      ALA   9   6.493   7.113  -5.091
   46    H    LYS  10           H        LYS  10   5.242   5.889  -3.065
   47    HA   LYS  10           HA       LYS  10   4.540   3.392  -4.227
   48    HB2  LYS  10           2HB      LYS  10   5.112   3.923  -1.311
   49    HB3  LYS  10           1HB      LYS  10   5.293   2.403  -2.170
   50    HG2  LYS  10           2HG      LYS  10   6.970   4.875  -2.466
   51    HG3  LYS  10           1HG      LYS  10   7.463   3.320  -1.817
   52    HD2  LYS  10           2HD      LYS  10   6.597   3.832  -4.652
   53    HD3  LYS  10           1HD      LYS  10   8.272   3.747  -4.109
   54    HE2  LYS  10           2HE      LYS  10   6.213   1.566  -4.166
   55    HE3  LYS  10           1HE      LYS  10   7.765   1.646  -4.986
   56    HZ1  LYS  10           3HZ      LYS  10   7.386   1.420  -2.057
   57    HZ2  LYS  10           1HZ      LYS  10   8.878   1.502  -2.851
   58    HZ3  LYS  10           2HZ      LYS  10   7.864   0.168  -3.088
   59    H    ILE  11           H        ILE  11   3.071   5.511  -1.832
   60    HA   ILE  11           HA       ILE  11   1.011   3.784  -1.009
   61    HB   ILE  11           HB       ILE  11   0.970   6.806  -1.131
   62   HG12  ILE  11          2HG1      ILE  11   1.734   4.904   1.104
   63   HG13  ILE  11          1HG1      ILE  11   2.835   5.946   0.211
   64   HG21  ILE  11          1HG2      ILE  11  -0.603   5.664   0.969
   65   HG22  ILE  11          2HG2      ILE  11  -1.074   4.939  -0.571
   66   HG23  ILE  11          3HG2      ILE  11  -1.117   6.694  -0.367
   67   HD11  ILE  11          3HD1      ILE  11   2.345   6.878   2.386
   68   HD12  ILE  11          1HD1      ILE  11   0.618   6.853   2.032
   69   HD13  ILE  11          2HD1      ILE  11   1.689   7.912   1.117
   70    H    ALA  12           H        ALA  12   0.878   6.505  -3.318
   71    HA   ALA  12           HA       ALA  12  -1.664   6.076  -4.312
   72    HB1  ALA  12           3HB      ALA  12  -0.317   8.046  -4.871
   73    HB2  ALA  12           1HB      ALA  12  -0.934   7.262  -6.327
   74    HB3  ALA  12           2HB      ALA  12   0.751   7.042  -5.852
   75    H    LYS  13           H        LYS  13   1.394   4.571  -5.176
   76    HA   LYS  13           HA       LYS  13   0.659   3.092  -7.397
   77    HB2  LYS  13           2HB      LYS  13   2.961   3.226  -6.498
   78    HB3  LYS  13           1HB      LYS  13   2.478   2.214  -5.145
   79    HG2  LYS  13           2HG      LYS  13   3.639   0.869  -6.748
   80    HG3  LYS  13           1HG      LYS  13   1.936   0.405  -6.737
   81    HD2  LYS  13           2HD      LYS  13   1.525   1.372  -8.801
   82    HD3  LYS  13           1HD      LYS  13   2.912   2.453  -8.679
   83    HE2  LYS  13           2HE      LYS  13   4.416   0.557  -8.936
   84    HE3  LYS  13           1HE      LYS  13   3.035  -0.531  -9.068
   85    HZ1  LYS  13           3HZ      LYS  13   3.926   0.032 -11.240
   86    HZ2  LYS  13           1HZ      LYS  13   3.683   1.681 -10.943
   87    HZ3  LYS  13           2HZ      LYS  13   2.357   0.640 -11.073
   88    H    LEU  14           H        LEU  14   0.206   2.422  -3.957
   89    HA   LEU  14           HA       LEU  14  -1.058  -0.108  -4.381
   90    HG   LEU  14           HG       LEU  14  -1.091  -1.375  -2.683
   91    HB2  LEU  14           2HB      LEU  14   0.027   1.271  -2.215
   92    HB3  LEU  14           1HB      LEU  14  -1.689   1.179  -1.855
   93   HD11  LEU  14          1HD1      LEU  14   1.205  -0.314  -1.054
   94   HD12  LEU  14          2HD1      LEU  14   1.276  -0.980  -2.686
   95   HD13  LEU  14          3HD1      LEU  14   0.868  -2.024  -1.324
   96   HD21  LEU  14          3HD2      LEU  14  -1.111  -0.295   0.130
   97   HD22  LEU  14          1HD2      LEU  14  -1.368  -1.975  -0.338
   98   HD23  LEU  14          2HD2      LEU  14  -2.531  -0.738  -0.816
   99    H    MET  15           H        MET  15  -2.093   3.212  -4.113
  100    HA   MET  15           HA       MET  15  -4.840   2.736  -3.620
  101    HB2  MET  15           2HB      MET  15  -3.191   5.043  -4.491
  102    HB3  MET  15           1HB      MET  15  -4.903   5.110  -4.883
  103    HG2  MET  15           2HG      MET  15  -4.331   6.217  -2.755
  104    HG3  MET  15           1HG      MET  15  -5.506   4.916  -2.577
  105    HE1  MET  15           3HE      MET  15  -4.024   6.125  -0.078
  106    HE2  MET  15           1HE      MET  15  -3.569   4.659   0.790
  107    HE3  MET  15           2HE      MET  15  -5.151   4.772   0.018
  108    H    GLY  16           H        GLY  16  -2.884   2.389  -6.402
  109    HA2  GLY  16           2HA      GLY  16  -4.432   2.875  -8.575
  110    HA3  GLY  16           1HA      GLY  16  -3.433   1.434  -8.435
  111    H    GLU  17           H        GLU  17  -4.585  -0.151  -6.724
  112    HA   GLU  17           HA       GLU  17  -6.780  -1.243  -8.073
  113    HB2  GLU  17           2HB      GLU  17  -5.669  -1.703  -5.310
  114    HB3  GLU  17           1HB      GLU  17  -7.054  -2.604  -5.924
  115    HG2  GLU  17           2HG      GLU  17  -5.798  -3.687  -7.542
  116    HG3  GLU  17           1HG      GLU  17  -4.498  -2.487  -7.472
  117    H    GLY  18           H        GLY  18  -6.576   0.840  -5.238
  118    HA2  GLY  18           2HA      GLY  18  -8.196   2.425  -4.613
  119    HA3  GLY  18           1HA      GLY  18  -9.376   1.582  -5.607
  120    H    TYR  19           H        TYR  19  -7.682   1.575  -2.531
  121    HA   TYR  19           HA       TYR  19  -9.932   0.125  -1.354
  122    HD1  TYR  19           2HD      TYR  19  -7.820  -1.730  -3.575
  123    HD2  TYR  19           1HD      TYR  19  -9.677  -2.802   0.099
  124    HE1  TYR  19           2HE      TYR  19  -8.785  -3.720  -4.651
  125    HE2  TYR  19           1HE      TYR  19 -10.646  -4.796  -0.967
  126    HH   TYR  19           HH       TYR  19  -9.639  -5.940  -3.986
  127    HB2  TYR  19           2HB      TYR  19  -7.086  -0.774  -1.382
  128    HB3  TYR  19           1HB      TYR  19  -8.047  -1.082   0.061
  129    H    ALA  20           H        ALA  20  -9.411  -0.024   1.181
  130    HA   ALA  20           HA       ALA  20  -9.657   2.519   2.225
  131    HB1  ALA  20           3HB      ALA  20 -10.080   0.193   3.298
  132    HB2  ALA  20           1HB      ALA  20  -9.615   1.549   4.327
  133    HB3  ALA  20           2HB      ALA  20  -8.413   0.344   3.861
  134    H    PHE  21           H        PHE  21  -8.256   3.839   3.477
  135    HA   PHE  21           HA       PHE  21  -5.590   3.986   2.395
  136    HD1  PHE  21           2HD      PHE  21  -9.022   5.563   4.099
  137    HD2  PHE  21           1HD      PHE  21  -5.264   6.201   5.991
  138    HE1  PHE  21           2HE      PHE  21 -10.174   6.006   6.226
  139    HE2  PHE  21           1HE      PHE  21  -6.408   6.645   8.123
  140    HZ   PHE  21           HZ       PHE  21  -8.867   6.548   8.243
  141    HB2  PHE  21           2HB      PHE  21  -5.398   6.063   3.638
  142    HB3  PHE  21           1HB      PHE  21  -6.948   6.020   2.806
  143    H    GLU  22           H        GLU  22  -7.113   2.998   5.373
  144    HA   GLU  22           HA       GLU  22  -4.816   2.943   7.008
  145    HB2  GLU  22           2HB      GLU  22  -7.138   2.839   7.868
  146    HB3  GLU  22           1HB      GLU  22  -7.293   1.219   7.199
  147    HG2  GLU  22           2HG      GLU  22  -5.544   0.416   8.670
  148    HG3  GLU  22           1HG      GLU  22  -5.312   2.043   9.307
  149    H    GLU  23           H        GLU  23  -6.364   0.453   5.001
  150    HA   GLU  23           HA       GLU  23  -4.615  -1.642   5.697
  151    HB2  GLU  23           2HB      GLU  23  -6.335  -1.182   3.268
  152    HB3  GLU  23           1HB      GLU  23  -5.409  -2.656   3.516
  153    HG2  GLU  23           2HG      GLU  23  -6.612  -2.888   5.717
  154    HG3  GLU  23           1HG      GLU  23  -7.675  -1.594   5.169
  155    H    VAL  24           H        VAL  24  -4.391   0.911   3.306
  156    HA   VAL  24           HA       VAL  24  -2.259  -0.203   1.803
  157    HB   VAL  24           HB       VAL  24  -3.176   2.658   2.086
  158   HG11  VAL  24          1HG1      VAL  24  -1.345   1.536  -0.026
  159   HG12  VAL  24          2HG1      VAL  24  -0.787   2.442   1.376
  160   HG13  VAL  24          3HG1      VAL  24  -1.834   3.215   0.188
  161   HG21  VAL  24          3HG2      VAL  24  -3.571   0.761  -0.217
  162   HG22  VAL  24          1HG2      VAL  24  -4.344   2.323   0.047
  163   HG23  VAL  24          2HG2      VAL  24  -4.744   0.955   1.085
  164    H    LYS  25           H        LYS  25  -2.120   2.687   3.900
  165    HA   LYS  25           HA       LYS  25   0.643   2.829   4.046
  166    HB2  LYS  25           2HB      LYS  25  -1.489   3.772   5.944
  167    HB3  LYS  25           1HB      LYS  25   0.216   4.071   6.241
  168    HG2  LYS  25           2HG      LYS  25  -0.607   6.015   5.217
  169    HG3  LYS  25           1HG      LYS  25   0.295   5.159   3.973
  170    HD2  LYS  25           2HD      LYS  25  -1.712   4.359   2.957
  171    HD3  LYS  25           1HD      LYS  25  -2.688   4.939   4.308
  172    HE2  LYS  25           2HE      LYS  25  -1.115   6.678   2.411
  173    HE3  LYS  25           1HE      LYS  25  -2.855   6.403   2.340
  174    HZ1  LYS  25           3HZ      LYS  25  -2.328   8.482   3.448
  175    HZ2  LYS  25           1HZ      LYS  25  -1.399   7.664   4.601
  176    HZ3  LYS  25           2HZ      LYS  25  -3.070   7.409   4.524
  177    H    ARG  26           H        ARG  26  -1.577   0.979   6.100
  178    HA   ARG  26           HA       ARG  26   0.406   0.222   7.983
  179    HE   ARG  26           HE       ARG  26  -3.732  -3.856   6.756
  180    HB2  ARG  26           2HB      ARG  26  -1.207  -1.071   8.994
  181    HB3  ARG  26           1HB      ARG  26  -2.210   0.085   8.132
  182    HG2  ARG  26           2HG      ARG  26  -2.437  -1.593   6.302
  183    HG3  ARG  26           1HG      ARG  26  -1.604  -2.752   7.343
  184    HD2  ARG  26           2HD      ARG  26  -3.342  -2.395   9.059
  185    HD3  ARG  26           1HD      ARG  26  -4.182  -1.319   7.943
  186   HH11  ARG  26          1HH1      ARG  26  -5.741  -2.211   9.078
  187   HH12  ARG  26          2HH1      ARG  26  -7.075  -3.299   8.888
  188   HH21  ARG  26          1HH2      ARG  26  -5.482  -5.298   6.504
  189   HH22  ARG  26          2HH2      ARG  26  -6.927  -5.055   7.427
  190    H    ALA  27           H        ALA  27  -0.729  -1.173   4.955
  191    HA   ALA  27           HA       ALA  27   0.713  -3.619   5.212
  192    HB1  ALA  27           3HB      ALA  27  -1.214  -3.404   3.720
  193    HB2  ALA  27           1HB      ALA  27   0.220  -3.937   2.844
  194    HB3  ALA  27           2HB      ALA  27  -0.316  -2.262   2.721
  195    H    LEU  28           H        LEU  28   1.469  -0.431   4.039
  196    HA   LEU  28           HA       LEU  28   3.882  -1.172   2.690
  197    HG   LEU  28           HG       LEU  28   1.943   0.308   1.357
  198    HB2  LEU  28           2HB      LEU  28   2.637   1.431   3.517
  199    HB3  LEU  28           1HB      LEU  28   4.287   1.380   2.916
  200   HD11  LEU  28          1HD1      LEU  28   2.326   2.455   0.021
  201   HD12  LEU  28          2HD1      LEU  28   3.154   3.050   1.461
  202   HD13  LEU  28          3HD1      LEU  28   1.453   2.589   1.547
  203   HD21  LEU  28          3HD2      LEU  28   4.577   1.229   0.278
  204   HD22  LEU  28          1HD2      LEU  28   3.410   0.114  -0.431
  205   HD23  LEU  28          2HD2      LEU  28   4.399  -0.395   0.938
  206    H    GLU  29           H        GLU  29   3.044   0.084   5.870
  207    HA   GLU  29           HA       GLU  29   5.678   0.582   6.751
  208    HB2  GLU  29           2HB      GLU  29   3.730   1.555   7.859
  209    HB3  GLU  29           1HB      GLU  29   3.181  -0.045   8.340
  210    HG2  GLU  29           2HG      GLU  29   4.237   1.147  10.184
  211    HG3  GLU  29           1HG      GLU  29   5.123  -0.317   9.759
  212    H    ILE  30           H        ILE  30   3.500  -2.183   7.309
  213    HA   ILE  30           HA       ILE  30   5.208  -3.740   8.857
  214    HB   ILE  30           HB       ILE  30   3.118  -4.659   6.881
  215   HG12  ILE  30          2HG1      ILE  30   2.978  -4.309   9.883
  216   HG13  ILE  30          1HG1      ILE  30   2.341  -3.154   8.719
  217   HG21  ILE  30          1HG2      ILE  30   3.628  -6.404   9.136
  218   HG22  ILE  30          2HG2      ILE  30   5.063  -6.191   8.133
  219   HG23  ILE  30          3HG2      ILE  30   3.564  -6.778   7.413
  220   HD11  ILE  30          3HD1      ILE  30   0.600  -4.591   9.658
  221   HD12  ILE  30          1HD1      ILE  30   1.428  -6.007   9.009
  222   HD13  ILE  30          2HD1      ILE  30   0.758  -4.796   7.913
  223    H    ALA  31           H        ALA  31   4.783  -3.748   5.321
  224    HA   ALA  31           HA       ALA  31   6.978  -5.599   4.982
  225    HB1  ALA  31           3HB      ALA  31   4.943  -5.673   3.557
  226    HB2  ALA  31           1HB      ALA  31   6.446  -5.552   2.643
  227    HB3  ALA  31           2HB      ALA  31   5.429  -4.129   2.859
  228    H    GLN  32           H        GLN  32   7.521  -2.987   6.184
  229    HA   GLN  32           HA       GLN  32   9.148  -1.409   6.168
  230    HB2  GLN  32           2HB      GLN  32  10.273  -2.834   3.755
  231    HB3  GLN  32           1HB      GLN  32  11.132  -1.765   4.856
  232    HG2  GLN  32           2HG      GLN  32  10.778  -3.390   6.668
  233    HG3  GLN  32           1HG      GLN  32   9.995  -4.472   5.518
  234   HE21  GLN  32          1HE2      GLN  32  12.998  -3.073   6.558
  235   HE22  GLN  32          2HE2      GLN  32  14.035  -4.128   5.665
  236    H    ASN  33           H        ASN  33   9.257  -1.905   2.669
  237    HA   ASN  33           HA       ASN  33   7.619   0.441   2.182
  238    HB2  ASN  33           2HB      ASN  33  10.528   0.350   1.350
  239    HB3  ASN  33           1HB      ASN  33   9.364   1.566   0.834
  240   HD21  ASN  33          1HD2      ASN  33  11.271   0.357   3.471
  241   HD22  ASN  33          2HD2      ASN  33  11.083   1.729   4.501
  242    H    ASN  34           H        ASN  34   7.690  -2.483   1.572
  243    HA   ASN  34           HA       ASN  34   8.019  -2.537  -1.319
  244    HB2  ASN  34           2HB      ASN  34   7.242  -4.716   0.616
  245    HB3  ASN  34           1HB      ASN  34   7.527  -4.947  -1.104
  246   HD21  ASN  34          1HD2      ASN  34   8.874  -6.138   1.183
  247   HD22  ASN  34          2HD2      ASN  34  10.546  -5.735   1.020
  248    H    VAL  35           H        VAL  35   6.413  -2.276  -2.713
  249    HA   VAL  35           HA       VAL  35   3.692  -2.016  -1.707
  250    HB   VAL  35           HB       VAL  35   3.922  -0.257  -3.118
  251   HG11  VAL  35          1HG1      VAL  35   5.866  -1.926  -4.689
  252   HG12  VAL  35          2HG1      VAL  35   6.195  -0.509  -3.692
  253   HG13  VAL  35          3HG1      VAL  35   5.320  -0.333  -5.213
  254   HG21  VAL  35          3HG2      VAL  35   3.391  -2.242  -5.308
  255   HG22  VAL  35          1HG2      VAL  35   2.790  -0.592  -5.149
  256   HG23  VAL  35          2HG2      VAL  35   2.196  -1.855  -4.074
  257    H    GLU  36           H        GLU  36   5.517  -3.966  -4.026
  258    HA   GLU  36           HA       GLU  36   3.439  -5.396  -5.177
  259    HB2  GLU  36           2HB      GLU  36   5.214  -7.255  -5.365
  260    HB3  GLU  36           1HB      GLU  36   5.542  -5.712  -6.143
  261    HG2  GLU  36           2HG      GLU  36   6.892  -5.058  -4.182
  262    HG3  GLU  36           1HG      GLU  36   6.633  -6.665  -3.506
  263    H    VAL  37           H        VAL  37   5.358  -6.300  -2.308
  264    HA   VAL  37           HA       VAL  37   3.888  -8.611  -1.674
  265    HB   VAL  37           HB       VAL  37   5.305  -6.817   0.302
  266   HG11  VAL  37          1HG1      VAL  37   4.659  -9.760   0.339
  267   HG12  VAL  37          2HG1      VAL  37   3.942  -8.510   1.353
  268   HG13  VAL  37          3HG1      VAL  37   5.646  -8.924   1.537
  269   HG21  VAL  37          3HG2      VAL  37   6.769  -7.337  -1.596
  270   HG22  VAL  37          1HG2      VAL  37   6.461  -9.057  -1.354
  271   HG23  VAL  37          2HG2      VAL  37   7.307  -8.129  -0.116
  272    H    ALA  38           H        ALA  38   3.591  -5.254  -0.603
  273    HA   ALA  38           HA       ALA  38   1.506  -5.607   1.234
  274    HB1  ALA  38           3HB      ALA  38   2.595  -3.561   1.373
  275    HB2  ALA  38           1HB      ALA  38   1.050  -3.133   0.639
  276    HB3  ALA  38           2HB      ALA  38   2.496  -3.279  -0.364
  277    H    ARG  39           H        ARG  39   1.550  -5.386  -2.241
  278    HA   ARG  39           HA       ARG  39  -1.232  -4.865  -2.583
  279    HE   ARG  39           HE       ARG  39  -1.085  -4.705  -6.723
  280    HB2  ARG  39           2HB      ARG  39   0.971  -5.793  -4.405
  281    HB3  ARG  39           1HB      ARG  39  -0.702  -5.808  -4.949
  282    HG2  ARG  39           2HG      ARG  39  -0.870  -3.419  -4.567
  283    HG3  ARG  39           1HG      ARG  39   0.783  -3.389  -3.949
  284    HD2  ARG  39           2HD      ARG  39   0.741  -2.644  -6.250
  285    HD3  ARG  39           1HD      ARG  39   1.599  -4.177  -6.113
  286   HH11  ARG  39          1HH1      ARG  39   1.752  -3.305  -8.186
  287   HH12  ARG  39          2HH1      ARG  39   1.288  -3.733  -9.799
  288   HH21  ARG  39          1HH2      ARG  39  -1.700  -5.276  -8.845
  289   HH22  ARG  39          2HH2      ARG  39  -0.673  -4.852 -10.173
  290    H    SER  40           H        SER  40   0.770  -7.767  -2.502
  291    HA   SER  40           HA       SER  40  -1.164  -9.628  -3.291
  292    HG   SER  40           HG       SER  40  -0.492 -11.841  -2.753
  293    HB2  SER  40           2HB      SER  40   1.210 -10.207  -3.120
  294    HB3  SER  40           1HB      SER  40   1.150  -9.994  -1.370
  295    H    ILE  41           H        ILE  41  -0.317  -8.380  -0.080
  296    HA   ILE  41           HA       ILE  41  -2.359  -9.931   1.229
  297    HB   ILE  41           HB       ILE  41  -1.792  -8.576   3.235
  298   HG12  ILE  41          2HG1      ILE  41   0.314  -7.327   1.458
  299   HG13  ILE  41          1HG1      ILE  41  -1.166  -6.513   1.955
  300   HG21  ILE  41          1HG2      ILE  41   0.481  -9.474   3.497
  301   HG22  ILE  41          2HG2      ILE  41   0.537  -9.803   1.766
  302   HG23  ILE  41          3HG2      ILE  41  -0.624 -10.651   2.787
  303   HD11  ILE  41          3HD1      ILE  41  -0.482  -6.651   4.278
  304   HD12  ILE  41          1HD1      ILE  41   0.748  -5.843   3.307
  305   HD13  ILE  41          2HD1      ILE  41   0.981  -7.517   3.809
  306    H    LEU  42           H        LEU  42  -2.117  -6.763  -0.190
  307    HA   LEU  42           HA       LEU  42  -4.226  -5.454   1.083
  308    HG   LEU  42           HG       LEU  42  -3.652  -2.655  -1.209
  309    HB2  LEU  42           2HB      LEU  42  -2.480  -4.537  -0.531
  310    HB3  LEU  42           1HB      LEU  42  -3.489  -5.141  -1.823
  311   HD11  LEU  42          1HD1      LEU  42  -6.003  -2.587  -1.756
  312   HD12  LEU  42          2HD1      LEU  42  -6.189  -4.280  -1.302
  313   HD13  LEU  42          3HD1      LEU  42  -5.205  -3.845  -2.699
  314   HD21  LEU  42          3HD2      LEU  42  -5.334  -3.802   1.020
  315   HD22  LEU  42          1HD2      LEU  42  -5.224  -2.100   0.571
  316   HD23  LEU  42          2HD2      LEU  42  -3.811  -2.936   1.215
  317    H    ARG  43           H        ARG  43  -4.200  -7.742  -1.584
  318    HA   ARG  43           HA       ARG  43  -7.047  -7.440  -2.052
  319    HE   ARG  43           HE       ARG  43  -9.334  -9.883  -4.922
  320    HB2  ARG  43           2HB      ARG  43  -5.589  -7.803  -3.963
  321    HB3  ARG  43           1HB      ARG  43  -5.011  -9.315  -3.271
  322    HG2  ARG  43           2HG      ARG  43  -6.553 -10.162  -4.695
  323    HG3  ARG  43           1HG      ARG  43  -7.625  -9.842  -3.329
  324    HD2  ARG  43           2HD      ARG  43  -8.002  -7.572  -4.341
  325    HD3  ARG  43           1HD      ARG  43  -7.218  -8.176  -5.786
  326   HH11  ARG  43          1HH1      ARG  43  -8.631  -6.941  -6.656
  327   HH12  ARG  43          2HH1      ARG  43 -10.073  -7.011  -7.613
  328   HH21  ARG  43          1HH2      ARG  43 -11.232  -9.978  -6.172
  329   HH22  ARG  43          2HH2      ARG  43 -11.554  -8.736  -7.336
  330    H    GLU  44           H        GLU  44  -4.885 -10.117  -1.096
  331    HA   GLU  44           HA       GLU  44  -6.931 -11.932  -0.466
  332    HB2  GLU  44           2HB      GLU  44  -4.107 -11.766   0.598
  333    HB3  GLU  44           1HB      GLU  44  -5.179 -13.142   0.821
  334    HG2  GLU  44           2HG      GLU  44  -5.266 -13.454  -1.608
  335    HG3  GLU  44           1HG      GLU  44  -4.165 -12.093  -1.812
  336    H    PHE  45           H        PHE  45  -4.759 -10.506   1.962
  337    HA   PHE  45           HA       PHE  45  -6.674 -10.863   4.046
  338    HD1  PHE  45           1HD      PHE  45  -5.713 -11.504   6.511
  339    HD2  PHE  45           2HD      PHE  45  -4.347  -7.586   5.564
  340    HE1  PHE  45           1HE      PHE  45  -6.122 -10.804   8.834
  341    HE2  PHE  45           2HE      PHE  45  -4.753  -6.879   7.886
  342    HZ   PHE  45           HZ       PHE  45  -5.642  -8.489   9.524
  343    HB2  PHE  45           2HB      PHE  45  -4.271 -10.987   4.490
  344    HB3  PHE  45           1HB      PHE  45  -4.083  -9.303   4.011
  345    H    ALA  46           H        ALA  46  -8.516  -9.705   3.771
  346    HA   ALA  46           HA       ALA  46  -8.255  -6.788   3.455
  347    HB1  ALA  46           3HB      ALA  46  -9.523  -7.890   1.676
  348    HB2  ALA  46           1HB      ALA  46 -10.541  -6.797   2.615
  349    HB3  ALA  46           2HB      ALA  46 -10.640  -8.538   2.876
  Start of MODEL   14
    1    HA   ALA   3           HA       ALA   3  11.418  12.644   1.267
    2    HB1  ALA   3           3HB      ALA   3   9.890  10.135   0.587
    3    HB2  ALA   3           1HB      ALA   3   9.485  11.266   1.877
    4    HB3  ALA   3           2HB      ALA   3  10.990  10.349   1.949
    5    H    LEU   4           H        LEU   4  12.844  10.381   1.283
    6    HA   LEU   4           HA       LEU   4  14.737  10.747  -0.744
    7    HG   LEU   4           HG       LEU   4  16.881   8.320   1.029
    8    HB2  LEU   4           2HB      LEU   4  14.863   9.554   1.597
    9    HB3  LEU   4           1HB      LEU   4  14.475   8.120   0.666
   10   HD11  LEU   4          1HD1      LEU   4  17.630   8.055  -1.259
   11   HD12  LEU   4          2HD1      LEU   4  16.153   8.815  -1.852
   12   HD13  LEU   4          3HD1      LEU   4  16.073   7.257  -1.028
   13   HD21  LEU   4          3HD2      LEU   4  17.033  10.742   1.214
   14   HD22  LEU   4          1HD2      LEU   4  16.656  10.907  -0.501
   15   HD23  LEU   4          2HD2      LEU   4  18.158  10.132  -0.000
   16    H    GLU   5           H        GLU   5  12.655   7.883  -0.268
   17    HA   GLU   5           HA       GLU   5  12.917   7.301  -3.130
   18    HB2  GLU   5           2HB      GLU   5  12.046   5.066  -2.550
   19    HB3  GLU   5           1HB      GLU   5  13.502   5.469  -1.650
   20    HG2  GLU   5           2HG      GLU   5  12.128   6.056   0.292
   21    HG3  GLU   5           1HG      GLU   5  10.680   5.612  -0.612
   22    H    ASN   6           H        ASN   6  10.959   9.087  -1.346
   23    HA   ASN   6           HA       ASN   6   8.836   9.867  -1.511
   24    HB2  ASN   6           2HB      ASN   6   8.981   8.568  -4.239
   25    HB3  ASN   6           1HB      ASN   6   7.747   9.717  -3.727
   26   HD21  ASN   6          1HD2      ASN   6   9.678   9.899  -5.897
   27   HD22  ASN   6          2HD2      ASN   6  10.596  11.334  -5.604
   28    H    VAL   7           H        VAL   7   8.224   8.384   0.188
   29    HA   VAL   7           HA       VAL   7   7.207   5.818  -0.233
   30    HB   VAL   7           HB       VAL   7   6.704   7.847   1.920
   31   HG11  VAL   7          1HG1      VAL   7   5.597   6.036   3.209
   32   HG12  VAL   7          2HG1      VAL   7   5.581   5.051   1.746
   33   HG13  VAL   7          3HG1      VAL   7   4.662   6.555   1.806
   34   HG21  VAL   7          3HG2      VAL   7   8.001   5.170   2.166
   35   HG22  VAL   7          1HG2      VAL   7   8.190   6.599   3.186
   36   HG23  VAL   7          2HG2      VAL   7   8.875   6.573   1.562
   37    H    ASP   8           H        ASP   8   5.690   8.980  -0.455
   38    HA   ASP   8           HA       ASP   8   3.007   8.278  -0.554
   39    HB2  ASP   8           2HB      ASP   8   3.842  10.608  -0.497
   40    HB3  ASP   8           1HB      ASP   8   4.393  10.436  -2.163
   41    H    ALA   9           H        ALA   9   5.411   8.327  -3.160
   42    HA   ALA   9           HA       ALA   9   3.741   7.745  -5.307
   43    HB1  ALA   9           3HB      ALA   9   6.073   8.367  -5.602
   44    HB2  ALA   9           1HB      ALA   9   5.743   6.833  -6.407
   45    HB3  ALA   9           2HB      ALA   9   6.587   6.853  -4.859
   46    H    LYS  10           H        LYS  10   5.163   5.636  -2.879
   47    HA   LYS  10           HA       LYS  10   4.353   3.198  -4.120
   48    HB2  LYS  10           2HB      LYS  10   4.789   3.509  -1.162
   49    HB3  LYS  10           1HB      LYS  10   5.117   2.116  -2.175
   50    HG2  LYS  10           2HG      LYS  10   6.703   4.639  -1.877
   51    HG3  LYS  10           1HG      LYS  10   7.219   2.973  -1.633
   52    HD2  LYS  10           2HD      LYS  10   6.510   4.212  -4.293
   53    HD3  LYS  10           1HD      LYS  10   8.148   3.956  -3.691
   54    HE2  LYS  10           2HE      LYS  10   7.617   1.516  -3.553
   55    HE3  LYS  10           1HE      LYS  10   6.088   1.866  -4.360
   56    HZ1  LYS  10           3HZ      LYS  10   8.800   2.355  -5.466
   57    HZ2  LYS  10           1HZ      LYS  10   7.349   2.765  -6.234
   58    HZ3  LYS  10           2HZ      LYS  10   7.728   1.141  -5.951
   59    H    ILE  11           H        ILE  11   2.997   5.351  -1.689
   60    HA   ILE  11           HA       ILE  11   0.813   3.778  -0.918
   61    HB   ILE  11           HB       ILE  11   0.915   6.794  -1.068
   62   HG12  ILE  11          2HG1      ILE  11   1.720   4.877   1.133
   63   HG13  ILE  11          1HG1      ILE  11   2.783   5.948   0.233
   64   HG21  ILE  11          1HG2      ILE  11  -0.655   5.469   1.024
   65   HG22  ILE  11          2HG2      ILE  11  -1.242   5.185  -0.617
   66   HG23  ILE  11          3HG2      ILE  11  -1.069   6.837  -0.011
   67   HD11  ILE  11          3HD1      ILE  11   2.339   6.823   2.447
   68   HD12  ILE  11          1HD1      ILE  11   0.605   6.808   2.123
   69   HD13  ILE  11          2HD1      ILE  11   1.664   7.884   1.210
   70    H    ALA  12           H        ALA  12   0.879   6.497  -3.232
   71    HA   ALA  12           HA       ALA  12  -1.685   6.190  -4.243
   72    HB1  ALA  12           3HB      ALA  12   0.771   7.121  -5.735
   73    HB2  ALA  12           1HB      ALA  12  -0.268   8.132  -4.730
   74    HB3  ALA  12           2HB      ALA  12  -0.902   7.413  -6.210
   75    H    LYS  13           H        LYS  13   1.314   4.550  -5.032
   76    HA   LYS  13           HA       LYS  13   0.563   3.195  -7.337
   77    HB2  LYS  13           2HB      LYS  13   2.857   3.202  -6.391
   78    HB3  LYS  13           1HB      LYS  13   2.308   2.147  -5.097
   79    HG2  LYS  13           2HG      LYS  13   3.424   0.805  -6.724
   80    HG3  LYS  13           1HG      LYS  13   1.697   0.457  -6.816
   81    HD2  LYS  13           2HD      LYS  13   1.511   1.307  -8.892
   82    HD3  LYS  13           1HD      LYS  13   2.667   2.607  -8.586
   83    HE2  LYS  13           2HE      LYS  13   4.503   1.135  -8.906
   84    HE3  LYS  13           1HE      LYS  13   3.439  -0.267  -8.899
   85    HZ1  LYS  13           3HZ      LYS  13   3.441   1.859 -10.971
   86    HZ2  LYS  13           1HZ      LYS  13   2.478   0.468 -10.975
   87    HZ3  LYS  13           2HZ      LYS  13   4.156   0.336 -11.142
   88    H    LEU  14           H        LEU  14  -0.097   2.508  -3.941
   89    HA   LEU  14           HA       LEU  14  -1.494   0.046  -4.585
   90    HG   LEU  14           HG       LEU  14  -0.587  -1.351  -3.047
   91    HB2  LEU  14           2HB      LEU  14  -0.752   1.488  -2.096
   92    HB3  LEU  14           1HB      LEU  14  -2.158   0.441  -2.029
   93   HD11  LEU  14          1HD1      LEU  14   1.257   0.128  -3.589
   94   HD12  LEU  14          2HD1      LEU  14   1.756  -1.085  -2.410
   95   HD13  LEU  14          3HD1      LEU  14   1.424   0.566  -1.889
   96   HD21  LEU  14          3HD2      LEU  14  -0.253  -0.412  -0.204
   97   HD22  LEU  14          1HD2      LEU  14   0.120  -2.024  -0.814
   98   HD23  LEU  14          2HD2      LEU  14  -1.547  -1.448  -0.811
   99    H    MET  15           H        MET  15  -2.227   3.389  -4.002
  100    HA   MET  15           HA       MET  15  -4.981   3.124  -3.414
  101    HB2  MET  15           2HB      MET  15  -3.197   5.203  -3.460
  102    HB3  MET  15           1HB      MET  15  -4.181   5.550  -4.874
  103    HG2  MET  15           2HG      MET  15  -5.269   5.071  -2.110
  104    HG3  MET  15           1HG      MET  15  -4.968   6.659  -2.812
  105    HE1  MET  15           3HE      MET  15  -5.880   6.323  -5.831
  106    HE2  MET  15           1HE      MET  15  -6.291   7.687  -4.789
  107    HE3  MET  15           2HE      MET  15  -7.556   6.856  -5.693
  108    H    GLY  16           H        GLY  16  -3.165   2.818  -6.301
  109    HA2  GLY  16           2HA      GLY  16  -4.892   3.562  -8.314
  110    HA3  GLY  16           1HA      GLY  16  -3.812   2.176  -8.413
  111    H    GLU  17           H        GLU  17  -4.727   0.340  -6.829
  112    HA   GLU  17           HA       GLU  17  -6.933  -0.767  -8.106
  113    HB2  GLU  17           2HB      GLU  17  -5.573  -1.338  -5.492
  114    HB3  GLU  17           1HB      GLU  17  -7.036  -2.214  -5.942
  115    HG2  GLU  17           2HG      GLU  17  -6.007  -3.156  -7.843
  116    HG3  GLU  17           1HG      GLU  17  -4.625  -2.054  -7.725
  117    H    GLY  18           H        GLY  18  -6.720   1.209  -5.206
  118    HA2  GLY  18           2HA      GLY  18  -8.372   2.598  -4.338
  119    HA3  GLY  18           1HA      GLY  18  -9.538   1.854  -5.424
  120    H    TYR  19           H        TYR  19  -7.893   1.595  -2.357
  121    HA   TYR  19           HA       TYR  19 -10.087  -0.022  -1.335
  122    HD1  TYR  19           2HD      TYR  19 -10.158  -2.837  -0.337
  123    HD2  TYR  19           1HD      TYR  19  -7.760  -1.894  -3.721
  124    HE1  TYR  19           2HE      TYR  19 -11.205  -4.679  -1.584
  125    HE2  TYR  19           1HE      TYR  19  -8.802  -3.732  -4.979
  126    HH   TYR  19           HH       TYR  19 -11.605  -5.306  -3.953
  127    HB2  TYR  19           2HB      TYR  19  -7.260  -0.940  -1.579
  128    HB3  TYR  19           1HB      TYR  19  -8.157  -1.405  -0.138
  129    H    ALA  20           H        ALA  20  -9.478  -0.489   1.157
  130    HA   ALA  20           HA       ALA  20  -9.724   1.844   2.552
  131    HB1  ALA  20           3HB      ALA  20  -8.603  -0.820   3.339
  132    HB2  ALA  20           1HB      ALA  20 -10.152  -0.095   3.765
  133    HB3  ALA  20           2HB      ALA  20  -8.662   0.511   4.495
  134    H    PHE  21           H        PHE  21  -8.429   3.486   3.122
  135    HA   PHE  21           HA       PHE  21  -5.771   3.619   2.093
  136    HD1  PHE  21           1HD      PHE  21  -5.548   6.323   0.847
  137    HD2  PHE  21           2HD      PHE  21  -9.298   5.521   2.694
  138    HE1  PHE  21           1HE      PHE  21  -6.709   7.238  -1.119
  139    HE2  PHE  21           2HE      PHE  21 -10.465   6.435   0.730
  140    HZ   PHE  21           HZ       PHE  21  -9.170   7.295  -1.181
  141    HB2  PHE  21           2HB      PHE  21  -7.255   5.476   3.969
  142    HB3  PHE  21           1HB      PHE  21  -5.703   5.832   3.219
  143    H    GLU  22           H        GLU  22  -7.237   2.995   5.195
  144    HA   GLU  22           HA       GLU  22  -4.907   3.211   6.778
  145    HB2  GLU  22           2HB      GLU  22  -7.431   1.599   7.192
  146    HB3  GLU  22           1HB      GLU  22  -6.176   1.793   8.409
  147    HG2  GLU  22           2HG      GLU  22  -7.773   4.030   7.182
  148    HG3  GLU  22           1HG      GLU  22  -8.068   3.306   8.762
  149    H    GLU  23           H        GLU  23  -6.396   0.501   5.063
  150    HA   GLU  23           HA       GLU  23  -4.602  -1.477   5.999
  151    HB2  GLU  23           2HB      GLU  23  -6.390  -1.368   3.576
  152    HB3  GLU  23           1HB      GLU  23  -5.450  -2.787   4.021
  153    HG2  GLU  23           2HG      GLU  23  -6.600  -2.722   6.246
  154    HG3  GLU  23           1HG      GLU  23  -7.667  -1.489   5.576
  155    H    VAL  24           H        VAL  24  -4.448   0.846   3.407
  156    HA   VAL  24           HA       VAL  24  -2.350  -0.418   1.945
  157    HB   VAL  24           HB       VAL  24  -3.291   2.450   1.950
  158   HG11  VAL  24          1HG1      VAL  24  -1.452   1.087  -0.012
  159   HG12  VAL  24          2HG1      VAL  24  -0.947   2.257   1.202
  160   HG13  VAL  24          3HG1      VAL  24  -2.031   2.750  -0.096
  161   HG21  VAL  24          3HG2      VAL  24  -3.725   0.365  -0.170
  162   HG22  VAL  24          1HG2      VAL  24  -4.547   1.911   0.032
  163   HG23  VAL  24          2HG2      VAL  24  -4.851   0.596   1.166
  164    H    LYS  25           H        LYS  25  -2.276   2.618   3.836
  165    HA   LYS  25           HA       LYS  25   0.469   2.931   3.912
  166    HB2  LYS  25           2HB      LYS  25  -1.685   3.771   5.837
  167    HB3  LYS  25           1HB      LYS  25   0.005   4.150   6.137
  168    HG2  LYS  25           2HG      LYS  25  -0.913   6.051   5.124
  169    HG3  LYS  25           1HG      LYS  25   0.036   5.251   3.877
  170    HD2  LYS  25           2HD      LYS  25  -1.930   4.364   2.847
  171    HD3  LYS  25           1HD      LYS  25  -2.933   4.884   4.202
  172    HE2  LYS  25           2HE      LYS  25  -1.428   6.736   2.360
  173    HE3  LYS  25           1HE      LYS  25  -3.144   6.351   2.224
  174    HZ1  LYS  25           3HZ      LYS  25  -1.857   7.646   4.567
  175    HZ2  LYS  25           1HZ      LYS  25  -3.507   7.306   4.404
  176    HZ3  LYS  25           2HZ      LYS  25  -2.772   8.442   3.389
  177    H    ARG  26           H        ARG  26  -1.591   1.100   6.164
  178    HA   ARG  26           HA       ARG  26   0.504   0.440   7.945
  179    HE   ARG  26           HE       ARG  26  -2.194  -2.276   9.864
  180    HB2  ARG  26           2HB      ARG  26  -0.999  -1.026   8.995
  181    HB3  ARG  26           1HB      ARG  26  -2.017   0.256   8.356
  182    HG2  ARG  26           2HG      ARG  26  -2.553  -1.186   6.427
  183    HG3  ARG  26           1HG      ARG  26  -1.622  -2.483   7.178
  184    HD2  ARG  26           2HD      ARG  26  -4.026  -1.109   8.352
  185    HD3  ARG  26           1HD      ARG  26  -4.007  -2.723   7.639
  186   HH11  ARG  26          1HH1      ARG  26  -5.284  -3.478   8.788
  187   HH12  ARG  26          2HH1      ARG  26  -5.525  -4.473  10.183
  188   HH21  ARG  26          1HH2      ARG  26  -2.504  -3.585  11.704
  189   HH22  ARG  26          2HH2      ARG  26  -3.948  -4.533  11.841
  190    H    ALA  27           H        ALA  27  -0.786  -1.156   5.064
  191    HA   ALA  27           HA       ALA  27   0.804  -3.505   5.330
  192    HB1  ALA  27           3HB      ALA  27  -1.244  -3.466   3.990
  193    HB2  ALA  27           1HB      ALA  27   0.142  -3.987   3.034
  194    HB3  ALA  27           2HB      ALA  27  -0.483  -2.348   2.859
  195    H    LEU  28           H        LEU  28   1.485  -0.321   4.361
  196    HA   LEU  28           HA       LEU  28   3.774  -1.042   2.724
  197    HG   LEU  28           HG       LEU  28   1.521   0.329   1.593
  198    HB2  LEU  28           2HB      LEU  28   2.542   1.587   3.525
  199    HB3  LEU  28           1HB      LEU  28   4.080   1.492   2.683
  200   HD11  LEU  28          1HD1      LEU  28   1.592   2.319   0.072
  201   HD12  LEU  28          2HD1      LEU  28   2.804   3.015   1.150
  202   HD13  LEU  28          3HD1      LEU  28   1.180   2.681   1.748
  203   HD21  LEU  28          3HD2      LEU  28   3.956   1.100   0.039
  204   HD22  LEU  28          1HD2      LEU  28   2.690  -0.059  -0.368
  205   HD23  LEU  28          2HD2      LEU  28   3.886  -0.454   0.868
  206    H    GLU  29           H        GLU  29   3.204   0.814   5.711
  207    HA   GLU  29           HA       GLU  29   5.889   1.198   6.383
  208    HB2  GLU  29           2HB      GLU  29   3.487   0.998   8.207
  209    HB3  GLU  29           1HB      GLU  29   5.057   1.641   8.668
  210    HG2  GLU  29           2HG      GLU  29   4.817   3.433   7.044
  211    HG3  GLU  29           1HG      GLU  29   3.261   2.778   6.536
  212    H    ILE  30           H        ILE  30   3.604  -1.249   7.619
  213    HA   ILE  30           HA       ILE  30   5.359  -2.640   9.259
  214    HB   ILE  30           HB       ILE  30   3.054  -3.773   7.673
  215   HG12  ILE  30          2HG1      ILE  30   3.176  -2.740  10.516
  216   HG13  ILE  30          1HG1      ILE  30   2.483  -1.860   9.160
  217   HG21  ILE  30          1HG2      ILE  30   3.764  -4.972  10.251
  218   HG22  ILE  30          2HG2      ILE  30   4.978  -5.183   8.992
  219   HG23  ILE  30          3HG2      ILE  30   3.325  -5.740   8.724
  220   HD11  ILE  30          3HD1      ILE  30   0.759  -2.906  10.511
  221   HD12  ILE  30          1HD1      ILE  30   1.492  -4.488  10.244
  222   HD13  ILE  30          2HD1      ILE  30   0.795  -3.599   8.889
  223    H    ALA  31           H        ALA  31   4.660  -3.162   5.812
  224    HA   ALA  31           HA       ALA  31   6.698  -5.224   5.667
  225    HB1  ALA  31           3HB      ALA  31   4.905  -4.123   3.506
  226    HB2  ALA  31           1HB      ALA  31   4.584  -5.558   4.481
  227    HB3  ALA  31           2HB      ALA  31   5.952  -5.535   3.368
  228    H    GLN  32           H        GLN  32   7.750  -2.755   6.366
  229    HA   GLN  32           HA       GLN  32   9.381  -1.265   5.853
  230    HB2  GLN  32           2HB      GLN  32   9.937  -3.447   3.855
  231    HB3  GLN  32           1HB      GLN  32  10.944  -2.007   3.947
  232    HG2  GLN  32           2HG      GLN  32  11.453  -2.516   6.281
  233    HG3  GLN  32           1HG      GLN  32  10.440  -3.956   6.187
  234   HE21  GLN  32          1HE2      GLN  32  13.430  -2.479   5.205
  235   HE22  GLN  32          2HE2      GLN  32  14.198  -3.923   4.649
  236    H    ASN  33           H        ASN  33   9.222  -2.132   2.465
  237    HA   ASN  33           HA       ASN  33   7.484   0.092   1.812
  238    HB2  ASN  33           2HB      ASN  33  10.383   0.038   0.945
  239    HB3  ASN  33           1HB      ASN  33   9.162   1.117   0.277
  240   HD21  ASN  33          1HD2      ASN  33   8.358   2.793   1.541
  241   HD22  ASN  33          2HD2      ASN  33   9.168   3.332   2.968
  242    H    ASN  34           H        ASN  34   8.335  -2.973   1.369
  243    HA   ASN  34           HA       ASN  34   8.481  -3.338  -1.410
  244    HB2  ASN  34           2HB      ASN  34   7.406  -5.206   0.700
  245    HB3  ASN  34           1HB      ASN  34   7.826  -5.670  -0.944
  246   HD21  ASN  34          1HD2      ASN  34   9.029  -4.740   2.172
  247   HD22  ASN  34          2HD2      ASN  34  10.678  -5.171   1.891
  248    H    VAL  35           H        VAL  35   7.023  -3.007  -2.936
  249    HA   VAL  35           HA       VAL  35   4.254  -2.514  -2.233
  250    HB   VAL  35           HB       VAL  35   5.625  -2.402  -4.919
  251   HG11  VAL  35          1HG1      VAL  35   2.984  -1.175  -4.191
  252   HG12  VAL  35          2HG1      VAL  35   3.113  -2.800  -4.856
  253   HG13  VAL  35          3HG1      VAL  35   3.680  -1.419  -5.793
  254   HG21  VAL  35          3HG2      VAL  35   4.856  -0.201  -3.009
  255   HG22  VAL  35          1HG2      VAL  35   5.557   0.020  -4.612
  256   HG23  VAL  35          2HG2      VAL  35   6.496  -0.759  -3.339
  257    H    GLU  36           H        GLU  36   6.137  -4.918  -4.000
  258    HA   GLU  36           HA       GLU  36   4.052  -6.336  -5.185
  259    HB2  GLU  36           2HB      GLU  36   5.640  -8.311  -5.039
  260    HB3  GLU  36           1HB      GLU  36   6.260  -6.878  -5.846
  261    HG2  GLU  36           2HG      GLU  36   7.458  -6.253  -3.808
  262    HG3  GLU  36           1HG      GLU  36   6.847  -7.702  -3.012
  263    H    VAL  37           H        VAL  37   5.579  -6.853  -2.009
  264    HA   VAL  37           HA       VAL  37   3.859  -8.964  -1.231
  265    HB   VAL  37           HB       VAL  37   5.347  -7.060   0.586
  266   HG11  VAL  37          1HG1      VAL  37   3.645  -8.446   1.692
  267   HG12  VAL  37          2HG1      VAL  37   5.280  -8.873   2.194
  268   HG13  VAL  37          3HG1      VAL  37   4.418  -9.892   1.043
  269   HG21  VAL  37          3HG2      VAL  37   6.277  -9.627  -0.697
  270   HG22  VAL  37          1HG2      VAL  37   7.146  -8.749   0.561
  271   HG23  VAL  37          2HG2      VAL  37   6.891  -8.005  -1.018
  272    H    ALA  38           H        ALA  38   3.799  -5.466  -0.715
  273    HA   ALA  38           HA       ALA  38   1.570  -5.391   0.998
  274    HB1  ALA  38           3HB      ALA  38   2.886  -3.455   0.930
  275    HB2  ALA  38           1HB      ALA  38   1.397  -2.995   0.105
  276    HB3  ALA  38           2HB      ALA  38   2.843  -3.383  -0.831
  277    H    ARG  39           H        ARG  39   1.907  -5.770  -2.424
  278    HA   ARG  39           HA       ARG  39  -0.789  -5.059  -3.092
  279    HE   ARG  39           HE       ARG  39  -0.180  -5.167  -7.442
  280    HB2  ARG  39           2HB      ARG  39   1.503  -6.303  -4.573
  281    HB3  ARG  39           1HB      ARG  39  -0.113  -6.343  -5.267
  282    HG2  ARG  39           2HG      ARG  39  -0.228  -3.951  -5.292
  283    HG3  ARG  39           1HG      ARG  39   1.291  -3.827  -4.402
  284    HD2  ARG  39           2HD      ARG  39   1.649  -3.397  -6.759
  285    HD3  ARG  39           1HD      ARG  39   2.466  -4.880  -6.264
  286   HH11  ARG  39          1HH1      ARG  39   3.278  -5.320  -7.855
  287   HH12  ARG  39          2HH1      ARG  39   3.193  -6.294  -9.285
  288   HH21  ARG  39          1HH2      ARG  39  -0.301  -6.447  -9.324
  289   HH22  ARG  39          2HH2      ARG  39   1.158  -6.933 -10.122
  290    H    SER  40           H        SER  40   0.974  -8.063  -2.492
  291    HA   SER  40           HA       SER  40  -1.089  -9.833  -3.221
  292    HG   SER  40           HG       SER  40   1.189 -10.984  -0.248
  293    HB2  SER  40           2HB      SER  40   0.133 -11.525  -1.966
  294    HB3  SER  40           1HB      SER  40   1.275 -10.523  -2.861
  295    H    ILE  41           H        ILE  41  -0.358  -8.133  -0.234
  296    HA   ILE  41           HA       ILE  41  -2.439  -9.452   1.264
  297    HB   ILE  41           HB       ILE  41  -0.873  -6.955   1.935
  298   HG12  ILE  41          2HG1      ILE  41   0.577  -8.917   1.659
  299   HG13  ILE  41          1HG1      ILE  41   0.491  -8.431   3.349
  300   HG21  ILE  41          1HG2      ILE  41  -2.933  -7.057   3.192
  301   HG22  ILE  41          2HG2      ILE  41  -1.573  -7.421   4.254
  302   HG23  ILE  41          3HG2      ILE  41  -2.601  -8.724   3.660
  303   HD11  ILE  41          3HD1      ILE  41  -0.987 -10.724   2.078
  304   HD12  ILE  41          1HD1      ILE  41  -1.123 -10.229   3.765
  305   HD13  ILE  41          2HD1      ILE  41   0.412 -10.836   3.146
  306    H    LEU  42           H        LEU  42  -2.028  -6.387  -0.424
  307    HA   LEU  42           HA       LEU  42  -4.371  -5.112   0.448
  308    HG   LEU  42           HG       LEU  42  -3.435  -2.318  -1.762
  309    HB2  LEU  42           2HB      LEU  42  -2.340  -4.207  -0.876
  310    HB3  LEU  42           1HB      LEU  42  -3.196  -4.760  -2.296
  311   HD11  LEU  42          1HD1      LEU  42  -5.748  -2.210  -2.367
  312   HD12  LEU  42          2HD1      LEU  42  -6.026  -3.850  -1.782
  313   HD13  LEU  42          3HD1      LEU  42  -5.012  -3.580  -3.199
  314   HD21  LEU  42          3HD2      LEU  42  -5.141  -3.351   0.500
  315   HD22  LEU  42          1HD2      LEU  42  -4.997  -1.669  -0.009
  316   HD23  LEU  42          2HD2      LEU  42  -3.601  -2.509   0.667
  317    H    ARG  43           H        ARG  43  -3.750  -7.365  -2.183
  318    HA   ARG  43           HA       ARG  43  -6.326  -7.135  -3.376
  319    HE   ARG  43           HE       ARG  43  -4.064  -8.720  -6.711
  320    HB2  ARG  43           2HB      ARG  43  -4.338  -7.924  -4.603
  321    HB3  ARG  43           1HB      ARG  43  -4.301  -9.371  -3.600
  322    HG2  ARG  43           2HG      ARG  43  -5.446 -10.254  -5.319
  323    HG3  ARG  43           1HG      ARG  43  -6.825  -9.478  -4.538
  324    HD2  ARG  43           2HD      ARG  43  -6.903  -8.867  -6.825
  325    HD3  ARG  43           1HD      ARG  43  -6.362  -7.465  -5.921
  326   HH11  ARG  43          1HH1      ARG  43  -6.858  -7.394  -8.317
  327   HH12  ARG  43          2HH1      ARG  43  -5.990  -6.969  -9.754
  328   HH21  ARG  43          1HH2      ARG  43  -2.914  -8.161  -8.596
  329   HH22  ARG  43          2HH2      ARG  43  -3.748  -7.405  -9.913
  330    H    GLU  44           H        GLU  44  -4.980  -9.060  -0.803
  331    HA   GLU  44           HA       GLU  44  -7.313 -10.801  -0.714
  332    HB2  GLU  44           2HB      GLU  44  -4.802 -10.721   0.964
  333    HB3  GLU  44           1HB      GLU  44  -6.104 -11.883   1.186
  334    HG2  GLU  44           2HG      GLU  44  -4.429 -11.566  -1.296
  335    HG3  GLU  44           1HG      GLU  44  -4.253 -12.831  -0.080
  336    H    PHE  45           H        PHE  45  -6.952  -7.775   0.103
  337    HA   PHE  45           HA       PHE  45  -7.947  -6.339   1.549
  338    HD1  PHE  45           2HD      PHE  45 -10.492  -5.280   1.408
  339    HD2  PHE  45           1HD      PHE  45 -10.276  -8.143   4.548
  340    HE1  PHE  45           2HE      PHE  45 -11.780  -3.772   2.865
  341    HE2  PHE  45           1HE      PHE  45 -11.563  -6.641   6.012
  342    HZ   PHE  45           HZ       PHE  45 -12.317  -4.452   5.171
  343    HB2  PHE  45           2HB      PHE  45  -9.957  -7.697   1.004
  344    HB3  PHE  45           1HB      PHE  45  -9.599  -8.734   2.382
  345    H    ALA  46           H        ALA  46  -8.398  -9.140   3.653
  346    HA   ALA  46           HA       ALA  46  -7.698  -9.578   5.771
  347    HB1  ALA  46           3HB      ALA  46  -5.631 -10.159   4.812
  348    HB2  ALA  46           1HB      ALA  46  -5.234  -9.116   6.177
  349    HB3  ALA  46           2HB      ALA  46  -5.196  -8.474   4.534
  Start of MODEL   15
    1    HA   ALA   3           HA       ALA   3  13.760  12.475  -2.766
    2    HB1  ALA   3           3HB      ALA   3  15.798  14.337  -1.552
    3    HB2  ALA   3           1HB      ALA   3  16.112  13.160  -2.828
    4    HB3  ALA   3           2HB      ALA   3  15.631  12.612  -1.222
    5    H    LEU   4           H        LEU   4  11.941  14.856  -2.337
    6    HA   LEU   4           HA       LEU   4  11.734  14.927   0.570
    7    HG   LEU   4           HG       LEU   4  11.143  18.434  -0.499
    8    HB2  LEU   4           2HB      LEU   4  10.306  16.404  -1.632
    9    HB3  LEU   4           1HB      LEU   4   9.809  16.514   0.045
   10   HD11  LEU   4          1HD1      LEU   4  11.427  17.519   1.741
   11   HD12  LEU   4          2HD1      LEU   4  12.921  18.255   1.158
   12   HD13  LEU   4          3HD1      LEU   4  12.746  16.500   1.165
   13   HD21  LEU   4          3HD2      LEU   4  13.335  16.525  -1.296
   14   HD22  LEU   4          1HD2      LEU   4  13.426  18.286  -1.286
   15   HD23  LEU   4          2HD2      LEU   4  12.345  17.466  -2.413
   16    H    GLU   5           H        GLU   5   9.334  14.533  -2.040
   17    HA   GLU   5           HA       GLU   5   7.833  12.729  -0.286
   18    HB2  GLU   5           2HB      GLU   5   5.970  13.077  -1.889
   19    HB3  GLU   5           1HB      GLU   5   6.539  14.571  -1.160
   20    HG2  GLU   5           2HG      GLU   5   7.856  15.019  -3.203
   21    HG3  GLU   5           1HG      GLU   5   7.160  13.570  -3.929
   22    H    ASN   6           H        ASN   6   7.871  10.612  -0.603
   23    HA   ASN   6           HA       ASN   6   8.298   9.553  -3.294
   24    HB2  ASN   6           2HB      ASN   6   9.920   8.643  -0.907
   25    HB3  ASN   6           1HB      ASN   6  10.019   7.999  -2.543
   26   HD21  ASN   6          1HD2      ASN   6  10.796  10.653  -0.453
   27   HD22  ASN   6          2HD2      ASN   6  11.904  11.438  -1.522
   28    H    VAL   7           H        VAL   7   7.463   8.962   0.081
   29    HA   VAL   7           HA       VAL   7   6.491   6.345  -0.193
   30    HB   VAL   7           HB       VAL   7   5.181   6.805   1.869
   31   HG11  VAL   7          1HG1      VAL   7   8.050   7.730   1.887
   32   HG12  VAL   7          2HG1      VAL   7   7.476   6.069   2.044
   33   HG13  VAL   7          3HG1      VAL   7   7.128   7.245   3.311
   34   HG21  VAL   7          3HG2      VAL   7   4.588   9.124   1.436
   35   HG22  VAL   7          1HG2      VAL   7   6.284   9.595   1.551
   36   HG23  VAL   7          2HG2      VAL   7   5.440   8.983   2.974
   37    H    ASP   8           H        ASP   8   4.991   9.463  -0.792
   38    HA   ASP   8           HA       ASP   8   2.312   8.689  -0.942
   39    HB2  ASP   8           2HB      ASP   8   3.182  11.047  -1.007
   40    HB3  ASP   8           1HB      ASP   8   3.659  10.769  -2.680
   41    H    ALA   9           H        ALA   9   4.810   8.725  -3.474
   42    HA   ALA   9           HA       ALA   9   3.241   7.926  -5.625
   43    HB1  ALA   9           3HB      ALA   9   5.575   8.668  -5.831
   44    HB2  ALA   9           1HB      ALA   9   5.299   7.132  -6.653
   45    HB3  ALA   9           2HB      ALA   9   6.109   7.161  -5.088
   46    H    LYS  10           H        LYS  10   4.689   6.058  -3.036
   47    HA   LYS  10           HA       LYS  10   4.108   3.493  -4.113
   48    HB2  LYS  10           2HB      LYS  10   4.400   4.204  -1.190
   49    HB3  LYS  10           1HB      LYS  10   4.675   2.639  -1.943
   50    HG2  LYS  10           2HG      LYS  10   6.311   4.887  -2.939
   51    HG3  LYS  10           1HG      LYS  10   6.643   4.325  -1.300
   52    HD2  LYS  10           2HD      LYS  10   8.065   3.166  -2.882
   53    HD3  LYS  10           1HD      LYS  10   6.918   2.035  -2.168
   54    HE2  LYS  10           2HE      LYS  10   5.569   2.056  -4.130
   55    HE3  LYS  10           1HE      LYS  10   6.504   3.379  -4.828
   56    HZ1  LYS  10           3HZ      LYS  10   7.087   1.215  -5.779
   57    HZ2  LYS  10           1HZ      LYS  10   7.568   0.666  -4.253
   58    HZ3  LYS  10           2HZ      LYS  10   8.406   1.930  -5.001
   59    H    ILE  11           H        ILE  11   2.487   5.673  -1.867
   60    HA   ILE  11           HA       ILE  11   0.338   4.048  -1.149
   61    HB   ILE  11           HB       ILE  11   0.330   7.053  -1.490
   62   HG12  ILE  11          2HG1      ILE  11   0.907   5.349   0.949
   63   HG13  ILE  11          1HG1      ILE  11   2.107   6.237   0.020
   64   HG21  ILE  11          1HG2      ILE  11  -1.372   5.900   0.570
   65   HG22  ILE  11          2HG2      ILE  11  -1.794   5.339  -1.051
   66   HG23  ILE  11          3HG2      ILE  11  -1.761   7.069  -0.694
   67   HD11  ILE  11          3HD1      ILE  11   1.549   7.439   2.032
   68   HD12  ILE  11          1HD1      ILE  11  -0.159   7.430   1.596
   69   HD13  ILE  11          2HD1      ILE  11   0.994   8.339   0.621
   70    H    ALA  12           H        ALA  12   0.410   6.605  -3.638
   71    HA   ALA  12           HA       ALA  12  -2.067   6.134  -4.775
   72    HB1  ALA  12           3HB      ALA  12  -1.184   7.199  -6.800
   73    HB2  ALA  12           1HB      ALA  12   0.456   7.017  -6.179
   74    HB3  ALA  12           2HB      ALA  12  -0.689   8.068  -5.348
   75    H    LYS  13           H        LYS  13   1.039   4.585  -5.378
   76    HA   LYS  13           HA       LYS  13   0.414   3.017  -7.569
   77    HB2  LYS  13           2HB      LYS  13   2.666   3.226  -6.507
   78    HB3  LYS  13           1HB      LYS  13   2.115   2.166  -5.218
   79    HG2  LYS  13           2HG      LYS  13   3.335   0.800  -6.697
   80    HG3  LYS  13           1HG      LYS  13   1.635   0.452  -7.012
   81    HD2  LYS  13           2HD      LYS  13   1.709   1.335  -9.086
   82    HD3  LYS  13           1HD      LYS  13   2.852   2.604  -8.628
   83    HE2  LYS  13           2HE      LYS  13   3.572  -0.289  -8.868
   84    HE3  LYS  13           1HE      LYS  13   3.725   0.845 -10.209
   85    HZ1  LYS  13           3HZ      LYS  13   5.819   0.580  -9.037
   86    HZ2  LYS  13           1HZ      LYS  13   5.100   1.052  -7.581
   87    HZ3  LYS  13           2HZ      LYS  13   5.244   2.160  -8.851
   88    H    LEU  14           H        LEU  14  -0.328   2.566  -4.157
   89    HA   LEU  14           HA       LEU  14  -1.616   0.008  -4.672
   90    HG   LEU  14           HG       LEU  14  -0.599  -1.276  -3.048
   91    HB2  LEU  14           2HB      LEU  14  -0.956   1.599  -2.241
   92    HB3  LEU  14           1HB      LEU  14  -2.272   0.444  -2.142
   93   HD11  LEU  14          1HD1      LEU  14   1.090   0.347  -3.775
   94   HD12  LEU  14          2HD1      LEU  14   1.736  -0.827  -2.629
   95   HD13  LEU  14          3HD1      LEU  14   1.352   0.809  -2.093
   96   HD21  LEU  14          3HD2      LEU  14  -0.115  -0.124  -0.309
   97   HD22  LEU  14          1HD2      LEU  14   0.200  -1.778  -0.835
   98   HD23  LEU  14          2HD2      LEU  14  -1.458  -1.185  -0.738
   99    H    MET  15           H        MET  15  -2.446   3.338  -4.467
  100    HA   MET  15           HA       MET  15  -5.173   3.086  -3.744
  101    HB2  MET  15           2HB      MET  15  -3.670   5.225  -5.253
  102    HB3  MET  15           1HB      MET  15  -5.379   5.358  -4.862
  103    HG2  MET  15           2HG      MET  15  -3.093   5.153  -2.917
  104    HG3  MET  15           1HG      MET  15  -4.084   6.571  -3.247
  105    HE1  MET  15           3HE      MET  15  -6.665   6.723  -2.671
  106    HE2  MET  15           1HE      MET  15  -7.568   5.459  -1.837
  107    HE3  MET  15           2HE      MET  15  -6.999   5.195  -3.486
  108    H    GLY  16           H        GLY  16  -3.430   2.556  -6.674
  109    HA2  GLY  16           2HA      GLY  16  -5.256   2.910  -8.680
  110    HA3  GLY  16           1HA      GLY  16  -4.124   1.564  -8.636
  111    H    GLU  17           H        GLU  17  -4.911  -0.084  -6.800
  112    HA   GLU  17           HA       GLU  17  -7.114  -1.423  -7.839
  113    HB2  GLU  17           2HB      GLU  17  -5.759  -1.599  -5.151
  114    HB3  GLU  17           1HB      GLU  17  -7.076  -2.674  -5.620
  115    HG2  GLU  17           2HG      GLU  17  -5.822  -3.695  -7.286
  116    HG3  GLU  17           1HG      GLU  17  -4.648  -2.370  -7.338
  117    H    GLY  18           H        GLY  18  -6.876   0.945  -5.266
  118    HA2  GLY  18           2HA      GLY  18  -8.563   2.373  -4.526
  119    HA3  GLY  18           1HA      GLY  18  -9.738   1.404  -5.404
  120    H    TYR  19           H        TYR  19  -8.010   1.827  -2.420
  121    HA   TYR  19           HA       TYR  19 -10.034   0.303  -1.019
  122    HD1  TYR  19           2HD      TYR  19  -9.323  -1.561   1.505
  123    HD2  TYR  19           1HD      TYR  19  -8.895  -2.614  -2.594
  124    HE1  TYR  19           2HE      TYR  19 -10.701  -3.564   1.883
  125    HE2  TYR  19           1HE      TYR  19 -10.272  -4.619  -2.229
  126    HH   TYR  19           HH       TYR  19 -10.922  -6.093  -0.357
  127    HB2  TYR  19           2HB      TYR  19  -7.536  -0.899  -1.656
  128    HB3  TYR  19           1HB      TYR  19  -7.544  -0.574   0.073
  129    H    ALA  20           H        ALA  20  -9.154   0.208   1.464
  130    HA   ALA  20           HA       ALA  20  -9.296   2.829   2.404
  131    HB1  ALA  20           3HB      ALA  20  -9.739   0.609   3.633
  132    HB2  ALA  20           1HB      ALA  20  -9.050   1.950   4.549
  133    HB3  ALA  20           2HB      ALA  20  -8.012   0.636   3.997
  134    H    PHE  21           H        PHE  21  -7.780   4.291   3.140
  135    HA   PHE  21           HA       PHE  21  -5.191   4.129   1.929
  136    HD1  PHE  21           1HD      PHE  21  -5.041   6.438   5.492
  137    HD2  PHE  21           2HD      PHE  21  -8.456   6.428   2.952
  138    HE1  PHE  21           1HE      PHE  21  -6.435   7.207   7.369
  139    HE2  PHE  21           2HE      PHE  21  -9.856   7.196   4.825
  140    HZ   PHE  21           HZ       PHE  21  -8.845   7.586   7.036
  141    HB2  PHE  21           2HB      PHE  21  -4.816   6.330   3.079
  142    HB3  PHE  21           1HB      PHE  21  -6.235   6.291   2.036
  143    H    GLU  22           H        GLU  22  -6.537   3.675   5.112
  144    HA   GLU  22           HA       GLU  22  -4.110   3.663   6.560
  145    HB2  GLU  22           2HB      GLU  22  -6.341   3.907   7.605
  146    HB3  GLU  22           1HB      GLU  22  -6.697   2.232   7.201
  147    HG2  GLU  22           2HG      GLU  22  -4.872   1.487   8.628
  148    HG3  GLU  22           1HG      GLU  22  -4.485   3.163   9.015
  149    H    GLU  23           H        GLU  23  -5.942   1.142   4.903
  150    HA   GLU  23           HA       GLU  23  -4.371  -1.037   5.804
  151    HB2  GLU  23           2HB      GLU  23  -6.231  -0.676   3.467
  152    HB3  GLU  23           1HB      GLU  23  -5.380  -2.188   3.761
  153    HG2  GLU  23           2HG      GLU  23  -6.398  -2.218   6.039
  154    HG3  GLU  23           1HG      GLU  23  -7.381  -0.839   5.549
  155    H    VAL  24           H        VAL  24  -3.971   1.319   3.311
  156    HA   VAL  24           HA       VAL  24  -2.078  -0.132   1.738
  157    HB   VAL  24           HB       VAL  24  -2.767   2.793   1.865
  158   HG11  VAL  24          1HG1      VAL  24  -1.037   1.421  -0.185
  159   HG12  VAL  24          2HG1      VAL  24  -0.429   2.449   1.108
  160   HG13  VAL  24          3HG1      VAL  24  -1.472   3.128  -0.141
  161   HG21  VAL  24          3HG2      VAL  24  -3.325   0.870  -0.371
  162   HG22  VAL  24          1HG2      VAL  24  -4.071   2.434  -0.054
  163   HG23  VAL  24          2HG2      VAL  24  -4.431   1.057   0.988
  164    H    LYS  25           H        LYS  25  -1.740   2.606   4.002
  165    HA   LYS  25           HA       LYS  25   1.100   2.590   3.873
  166    HB2  LYS  25           2HB      LYS  25  -0.897   3.942   5.655
  167    HB3  LYS  25           1HB      LYS  25   0.818   3.999   6.040
  168    HG2  LYS  25           2HG      LYS  25   0.417   5.957   4.839
  169    HG3  LYS  25           1HG      LYS  25   1.160   4.858   3.688
  170    HD2  LYS  25           2HD      LYS  25  -0.559   5.622   2.414
  171    HD3  LYS  25           1HD      LYS  25  -1.325   4.240   3.173
  172    HE2  LYS  25           2HE      LYS  25  -1.573   7.129   3.975
  173    HE3  LYS  25           1HE      LYS  25  -2.834   6.097   3.303
  174    HZ1  LYS  25           3HZ      LYS  25  -2.640   4.708   5.321
  175    HZ2  LYS  25           1HZ      LYS  25  -3.151   6.288   5.650
  176    HZ3  LYS  25           2HZ      LYS  25  -1.554   5.832   5.967
  177    H    ARG  26           H        ARG  26  -1.225   0.901   5.848
  178    HA   ARG  26           HA       ARG  26   0.705   0.110   7.821
  179    HE   ARG  26           HE       ARG  26  -4.355  -2.849   6.328
  180    HB2  ARG  26           2HB      ARG  26  -1.003  -1.093   8.855
  181    HB3  ARG  26           1HB      ARG  26  -1.867   0.236   8.097
  182    HG2  ARG  26           2HG      ARG  26  -2.445  -1.255   6.221
  183    HG3  ARG  26           1HG      ARG  26  -1.663  -2.587   7.077
  184    HD2  ARG  26           2HD      ARG  26  -3.206  -2.285   8.949
  185    HD3  ARG  26           1HD      ARG  26  -3.976  -0.951   8.090
  186   HH11  ARG  26          1HH1      ARG  26  -4.586  -3.077   9.797
  187   HH12  ARG  26          2HH1      ARG  26  -5.788  -4.323   9.765
  188   HH21  ARG  26          1HH2      ARG  26  -5.939  -4.490   6.275
  189   HH22  ARG  26          2HH2      ARG  26  -6.558  -5.125   7.763
  190    H    ALA  27           H        ALA  27  -0.643  -1.227   4.861
  191    HA   ALA  27           HA       ALA  27   0.575  -3.795   5.130
  192    HB1  ALA  27           3HB      ALA  27  -1.363  -3.452   3.689
  193    HB2  ALA  27           1HB      ALA  27  -0.004  -4.096   2.768
  194    HB3  ALA  27           2HB      ALA  27  -0.416  -2.384   2.653
  195    H    LEU  28           H        LEU  28   1.629  -0.696   4.036
  196    HA   LEU  28           HA       LEU  28   3.913  -1.653   2.575
  197    HG   LEU  28           HG       LEU  28   1.935   0.076   1.444
  198    HB2  LEU  28           2HB      LEU  28   3.016   1.067   3.497
  199    HB3  LEU  28           1HB      LEU  28   4.567   0.817   2.717
  200   HD11  LEU  28          1HD1      LEU  28   2.320   2.130   0.073
  201   HD12  LEU  28          2HD1      LEU  28   3.576   2.590   1.223
  202   HD13  LEU  28          3HD1      LEU  28   1.902   2.442   1.758
  203   HD21  LEU  28          3HD2      LEU  28   4.488   0.633   0.006
  204   HD22  LEU  28          1HD2      LEU  28   3.128  -0.382  -0.471
  205   HD23  LEU  28          2HD2      LEU  28   4.253  -0.937   0.770
  206    H    GLU  29           H        GLU  29   3.465   0.066   5.662
  207    HA   GLU  29           HA       GLU  29   6.130   0.104   6.463
  208    HB2  GLU  29           2HB      GLU  29   4.380   1.414   7.565
  209    HB3  GLU  29           1HB      GLU  29   3.651  -0.060   8.186
  210    HG2  GLU  29           2HG      GLU  29   5.681  -0.501   9.489
  211    HG3  GLU  29           1HG      GLU  29   6.378   1.002   8.888
  212    H    ILE  30           H        ILE  30   3.604  -2.268   7.299
  213    HA   ILE  30           HA       ILE  30   5.125  -3.963   8.885
  214    HB   ILE  30           HB       ILE  30   2.849  -4.658   7.030
  215   HG12  ILE  30          2HG1      ILE  30   2.897  -4.202  10.020
  216   HG13  ILE  30          1HG1      ILE  30   2.381  -3.002   8.841
  217   HG21  ILE  30          1HG2      ILE  30   3.150  -6.404   9.298
  218   HG22  ILE  30          2HG2      ILE  30   4.610  -6.409   8.311
  219   HG23  ILE  30          3HG2      ILE  30   3.052  -6.803   7.583
  220   HD11  ILE  30          3HD1      ILE  30   0.479  -4.107   9.866
  221   HD12  ILE  30          1HD1      ILE  30   1.079  -5.673   9.320
  222   HD13  ILE  30          2HD1      ILE  30   0.560  -4.467   8.142
  223    H    ALA  31           H        ALA  31   4.739  -3.946   5.363
  224    HA   ALA  31           HA       ALA  31   6.378  -6.278   5.008
  225    HB1  ALA  31           3HB      ALA  31   4.573  -5.787   3.450
  226    HB2  ALA  31           1HB      ALA  31   6.126  -5.837   2.615
  227    HB3  ALA  31           2HB      ALA  31   5.371  -4.286   2.981
  228    H    GLN  32           H        GLN  32   7.507  -3.827   6.351
  229    HA   GLN  32           HA       GLN  32   9.470  -2.687   6.451
  230    HB2  GLN  32           2HB      GLN  32  10.402  -4.807   4.506
  231    HB3  GLN  32           1HB      GLN  32  11.440  -3.759   5.465
  232    HG2  GLN  32           2HG      GLN  32   9.520  -5.799   6.566
  233    HG3  GLN  32           1HG      GLN  32  11.263  -6.006   6.409
  234   HE21  GLN  32          1HE2      GLN  32   8.705  -4.407   8.132
  235   HE22  GLN  32          2HE2      GLN  32   9.668  -3.849   9.454
  236    H    ASN  33           H        ASN  33   7.661  -1.520   4.802
  237    HA   ASN  33           HA       ASN  33   7.425   0.035   3.165
  238    HB2  ASN  33           2HB      ASN  33  10.449   0.064   3.272
  239    HB3  ASN  33           1HB      ASN  33   9.450   1.277   2.477
  240   HD21  ASN  33          1HD2      ASN  33   7.391   1.210   4.521
  241   HD22  ASN  33          2HD2      ASN  33   8.042   2.032   5.894
  242    H    ASN  34           H        ASN  34   6.854  -2.219   2.103
  243    HA   ASN  34           HA       ASN  34   8.187  -2.207  -0.508
  244    HB2  ASN  34           2HB      ASN  34   7.727  -4.570   1.273
  245    HB3  ASN  34           1HB      ASN  34   7.749  -4.776  -0.473
  246   HD21  ASN  34          1HD2      ASN  34   9.611  -3.916   2.338
  247   HD22  ASN  34          2HD2      ASN  34  11.165  -4.070   1.601
  248    H    VAL  35           H        VAL  35   6.801  -2.029  -2.128
  249    HA   VAL  35           HA       VAL  35   3.973  -2.048  -1.601
  250    HB   VAL  35           HB       VAL  35   4.454  -0.334  -3.052
  251   HG11  VAL  35          1HG1      VAL  35   6.444  -2.195  -4.286
  252   HG12  VAL  35          2HG1      VAL  35   6.696  -0.618  -3.540
  253   HG13  VAL  35          3HG1      VAL  35   5.923  -0.730  -5.120
  254   HG21  VAL  35          3HG2      VAL  35   3.903  -2.485  -5.082
  255   HG22  VAL  35          1HG2      VAL  35   3.440  -0.785  -5.146
  256   HG23  VAL  35          2HG2      VAL  35   2.678  -1.864  -3.977
  257    H    GLU  36           H        GLU  36   6.292  -4.190  -3.072
  258    HA   GLU  36           HA       GLU  36   4.599  -5.785  -4.613
  259    HB2  GLU  36           2HB      GLU  36   7.084  -6.540  -3.087
  260    HB3  GLU  36           1HB      GLU  36   6.308  -7.568  -4.281
  261    HG2  GLU  36           2HG      GLU  36   7.429  -4.828  -4.820
  262    HG3  GLU  36           1HG      GLU  36   8.248  -6.350  -5.173
  263    H    VAL  37           H        VAL  37   5.819  -6.594  -1.351
  264    HA   VAL  37           HA       VAL  37   4.039  -8.696  -0.883
  265    HB   VAL  37           HB       VAL  37   5.230  -6.848   1.194
  266   HG11  VAL  37          1HG1      VAL  37   3.413  -8.236   2.052
  267   HG12  VAL  37          2HG1      VAL  37   4.967  -8.725   2.721
  268   HG13  VAL  37          3HG1      VAL  37   4.221  -9.678   1.439
  269   HG21  VAL  37          3HG2      VAL  37   6.328  -9.387  -0.010
  270   HG22  VAL  37          1HG2      VAL  37   7.022  -8.529   1.367
  271   HG23  VAL  37          2HG2      VAL  37   6.975  -7.759  -0.218
  272    H    ALA  38           H        ALA  38   3.747  -5.237  -0.373
  273    HA   ALA  38           HA       ALA  38   1.342  -5.265   1.100
  274    HB1  ALA  38           3HB      ALA  38   2.544  -3.270   1.201
  275    HB2  ALA  38           1HB      ALA  38   1.175  -2.871   0.163
  276    HB3  ALA  38           2HB      ALA  38   2.757  -3.200  -0.548
  277    H    ARG  39           H        ARG  39   2.088  -5.487  -2.294
  278    HA   ARG  39           HA       ARG  39  -0.551  -4.940  -3.243
  279    HE   ARG  39           HE       ARG  39   0.791  -5.507  -7.323
  280    HB2  ARG  39           2HB      ARG  39   1.986  -5.958  -4.446
  281    HB3  ARG  39           1HB      ARG  39   0.483  -6.234  -5.318
  282    HG2  ARG  39           2HG      ARG  39   0.063  -3.900  -5.493
  283    HG3  ARG  39           1HG      ARG  39   1.381  -3.521  -4.384
  284    HD2  ARG  39           2HD      ARG  39   2.031  -3.099  -6.687
  285    HD3  ARG  39           1HD      ARG  39   2.994  -4.394  -5.981
  286   HH11  ARG  39          1HH1      ARG  39   3.789  -3.857  -7.981
  287   HH12  ARG  39          2HH1      ARG  39   4.009  -4.604  -9.529
  288   HH21  ARG  39          1HH2      ARG  39   1.077  -6.501  -9.356
  289   HH22  ARG  39          2HH2      ARG  39   2.469  -6.107 -10.309
  290    H    SER  40           H        SER  40   1.223  -7.784  -2.255
  291    HA   SER  40           HA       SER  40  -0.598  -9.707  -3.278
  292    HG   SER  40           HG       SER  40   0.189 -11.972  -2.570
  293    HB2  SER  40           2HB      SER  40   1.711 -10.294  -2.675
  294    HB3  SER  40           1HB      SER  40   1.367  -9.936  -0.984
  295    H    ILE  41           H        ILE  41  -0.307  -8.015  -0.194
  296    HA   ILE  41           HA       ILE  41  -2.502  -9.466   0.993
  297    HB   ILE  41           HB       ILE  41  -0.691  -8.692   2.421
  298   HG12  ILE  41          2HG1      ILE  41  -3.238  -7.169   3.017
  299   HG13  ILE  41          1HG1      ILE  41  -2.999  -8.884   3.336
  300   HG21  ILE  41          1HG2      ILE  41  -0.368  -6.299   2.875
  301   HG22  ILE  41          2HG2      ILE  41  -1.546  -5.914   1.620
  302   HG23  ILE  41          3HG2      ILE  41  -0.032  -6.710   1.193
  303   HD11  ILE  41          3HD1      ILE  41  -2.725  -7.536   5.345
  304   HD12  ILE  41          1HD1      ILE  41  -1.419  -6.640   4.569
  305   HD13  ILE  41          2HD1      ILE  41  -1.228  -8.359   4.910
  306    H    LEU  42           H        LEU  42  -2.041  -6.421  -0.668
  307    HA   LEU  42           HA       LEU  42  -4.505  -5.226   0.092
  308    HG   LEU  42           HG       LEU  42  -3.422  -2.245  -1.778
  309    HB2  LEU  42           2HB      LEU  42  -2.326  -4.232  -1.004
  310    HB3  LEU  42           1HB      LEU  42  -3.158  -4.595  -2.501
  311   HD11  LEU  42          1HD1      LEU  42  -5.122  -3.331  -3.183
  312   HD12  LEU  42          2HD1      LEU  42  -5.816  -2.103  -2.124
  313   HD13  LEU  42          3HD1      LEU  42  -6.000  -3.812  -1.731
  314   HD21  LEU  42          3HD2      LEU  42  -4.949  -3.434   0.537
  315   HD22  LEU  42          1HD2      LEU  42  -4.837  -1.720   0.139
  316   HD23  LEU  42          2HD2      LEU  42  -3.396  -2.606   0.637
  317    H    ARG  43           H        ARG  43  -3.471  -7.096  -2.736
  318    HA   ARG  43           HA       ARG  43  -5.985  -6.936  -4.067
  319    HE   ARG  43           HE       ARG  43  -6.852  -9.538  -7.743
  320    HB2  ARG  43           2HB      ARG  43  -3.942  -7.336  -5.316
  321    HB3  ARG  43           1HB      ARG  43  -3.667  -8.841  -4.446
  322    HG2  ARG  43           2HG      ARG  43  -4.595  -9.705  -6.316
  323    HG3  ARG  43           1HG      ARG  43  -6.090  -9.351  -5.447
  324    HD2  ARG  43           2HD      ARG  43  -6.055  -7.106  -6.559
  325    HD3  ARG  43           1HD      ARG  43  -4.775  -7.714  -7.587
  326   HH11  ARG  43          1HH1      ARG  43  -6.301  -6.187  -8.529
  327   HH12  ARG  43          2HH1      ARG  43  -7.438  -6.174  -9.835
  328   HH21  ARG  43          1HH2      ARG  43  -8.347  -9.528  -9.466
  329   HH22  ARG  43          2HH2      ARG  43  -8.600  -8.071 -10.368
  330    H    GLU  44           H        GLU  44  -4.353  -9.666  -2.438
  331    HA   GLU  44           HA       GLU  44  -6.563 -11.400  -2.561
  332    HB2  GLU  44           2HB      GLU  44  -4.241 -11.382  -0.625
  333    HB3  GLU  44           1HB      GLU  44  -5.373 -12.712  -0.826
  334    HG2  GLU  44           2HG      GLU  44  -3.519 -11.642  -2.942
  335    HG3  GLU  44           1HG      GLU  44  -3.290 -13.121  -2.011
  336    H    PHE  45           H        PHE  45  -5.264 -10.326   0.556
  337    HA   PHE  45           HA       PHE  45  -7.602  -8.984   1.414
  338    HD1  PHE  45           2HD      PHE  45  -7.295 -12.989   0.475
  339    HD2  PHE  45           1HD      PHE  45  -6.820 -11.771   4.525
  340    HE1  PHE  45           2HE      PHE  45  -6.081 -15.074   0.956
  341    HE2  PHE  45           1HE      PHE  45  -5.605 -13.854   5.013
  342    HZ   PHE  45           HZ       PHE  45  -5.235 -15.510   3.228
  343    HB2  PHE  45           2HB      PHE  45  -8.387 -10.659   3.076
  344    HB3  PHE  45           1HB      PHE  45  -8.620 -11.182   1.411
  345    H    ALA  46           H        ALA  46  -7.406  -8.125   3.518
  346    HA   ALA  46           HA       ALA  46  -4.725  -8.447   4.699
  347    HB1  ALA  46           3HB      ALA  46  -5.073  -6.236   3.712
  348    HB2  ALA  46           1HB      ALA  46  -4.884  -6.140   5.463
  349    HB3  ALA  46           2HB      ALA  46  -6.487  -6.001   4.741